A0A089G5R2_HUMAN Loading...

C-C chemokine receptor type 5

Receptor for a number of inflammatory CC-chemokines including CCL3/MIP-1-alpha, CCL4/MIP-1-beta and RANTES and subsequently transduces a signal by increasing the intracellular calcium ion level. May play a role in the control of granulocytic lineage proliferation or differentiation. Participates in T-lymphocyte migration to the infection site by acting as a chemotactic receptor.

AlphaFold DB , UniProt , Accession A0A089G5R2, Species HUMAN (Homo sapiens, Human), Gene CCR5, Length 352 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
1M38.7Very low39Very low223 Ų223152.9 Ų152.9100%1.09979%0.791SS**  087.70-91.6-168.9-178.300103.8
2D34.6Very low39.1Very low165 Ų165152.2 Ų152.288%0.88279%0.786SS**  trans-99.8105.8-164.4-60.5-8.1000107.8
3Y42Very low39.1Very low213 Ų213150.7 Ų150.784%0.83578%0.781SS**  trans-92.3120.2161.6-86-89.5000107.6
4Q35.3Very low39.1Very low187 Ų187154.3 Ų154.387%0.87478%0.781SS**  -168.3114.4129.8-106.9155.8-24.500113.3
5V47.4Very low39.5Very low139 Ų139158.6 Ų158.684%0.84279%0.786SS**  trans-19120.3157.9-176.50000115.3
6S40.5Very low40Very low119 Ų119156.4 Ų156.483%0.83279%0.785SS**  trans-117.5105.2164.859.80000110.6
7S39.5Very low40.4Very low78 Ų78153.9 Ų153.955%0.54579%0.786SS.*  trans-166.3117.1152.4-177.50000109.7I9S7-I9 VanDerWaalsContact C-N 3.32Å; S7-I9 PolarHBondContact O-N 3.04Å; S7-I9 WeakPolarHBondContact OG-CG1 3.36Å; S7-I9 PolarHBondContact OG-N 3.08Å
8P40.8Very low40.9Very low109 Ų109155.7 Ų155.771%0.70879%0.79SS**  trans-95.166.3160.636.4-25.7000108.2Y10P8-Y10 HydrophobicContact CB-CD2 4.49Å; P8-Y10 HydrophobicContact CB-CE2 4.11Å; P8-Y10 PolarHBondContact O-N 3.42Å
9I37.4Very low41.9Very low126 Ų126153.5 Ų153.565%0.64679%0.787SS**  trans-81.9100.4154.3-68.6172.1000104.4S7 D11S7-I9 VanDerWaalsContact C-N 3.32Å; S7-I9 PolarHBondContact O-N 3.04Å; S7-I9 WeakPolarHBondContact OG-CG1 3.36Å; S7-I9 PolarHBondContact OG-N 3.08Å; I9-D11 PolarHBondContact O-N 3.43Å
10Y37.9Very low43.1Very low205 Ų205147.9 Ų147.980%0.80476%0.762SS**  trans-67.888.4168.4-72.6-85.6000107.8P8 I12P8-Y10 HydrophobicContact CB-CD2 4.49Å; P8-Y10 HydrophobicContact CB-CE2 4.11Å; P8-Y10 PolarHBondContact O-N 3.42Å; Y10-I12 PolarHBondContact O-N 3.25Å; Y10-I12 VanDerWaalsContact O-N 3.08Å
11D34.9Very low44.1Very low118 Ų118148.2 Ų148.263%0.63176%0.76SS**  trans-64.7105.6161.3-86.1-27.1000107.1I9 N13I9-D11 PolarHBondContact O-N 3.43Å; D11-N13 PolarHBondContact O-N 3.34Å
12I40.3Very low45.4Very low144 Ų144141.9 Ų141.974%0.73873%0.727SS**  trans-7078.1166.7-55.8176.7000106.3Y10 Y14Y10-I12 PolarHBondContact O-N 3.25Å; Y10-I12 VanDerWaalsContact O-N 3.08Å; I12-Y14 HydrophobicContact CG2-CD2 3.79Å; I12-Y14 HydrophobicContact CG2-CE2 3.96Å; I12-Y14 PolarHBondContact O-N 3.5Å
13N38.8Very low46.8Very low133 Ų133138.4 Ų138.471%0.71171%0.707SS**  trans-7588.3173.7-84-41.8000109.1D11 Y15D11-N13 PolarHBondContact O-N 3.34Å; N13-Y15 PolarHBondContact O-N 3.37Å
14Y39.3Very low48Very low201 Ų201134.1 Ų134.179%0.78870%0.698SS**  trans-74.7106.4154.1-90.6-89.7000107.7I12 T16I12-Y14 HydrophobicContact CG2-CD2 3.79Å; I12-Y14 HydrophobicContact CG2-CE2 3.96Å; I12-Y14 PolarHBondContact O-N 3.5Å; Y14-T16 PolarHBondContact O-N 2.9Å
15Y45.2Very low49.7Very low219 Ų219126.5 Ų126.586%0.85967%0.665SS**SBendtrans-54.2126.7164-109.6-103.7000108.6N13N13-Y15 PolarHBondContact O-N 3.37Å
16T46.9Very low50.9Low124 Ų124125.2 Ų125.276%0.76165%0.648SS**SBendtrans94.7110.4-179.665.70000117.1Y14Y14-T16 PolarHBondContact O-N 2.9Å
17S46.7Very low52.8Low114 Ų114125 Ų12580%0.79763%0.634SS**  trans64.987.7169.930.40000116.8
18E50Low54.7Low186 Ų186126.8 Ų126.887%0.86964%0.636SS**  trans-51.2130.6157.4-72.9-176.4169.200109.5C20E18-C20 PolarHBondContact O-N 3.12Å; E18-C20 VanDerWaalsContact O-N 3.14Å
19P60Low56.5Low113 Ų113122.4 Ų122.473%0.73461%0.609SS**  trans-60.5121.1174.721.9-29.6000109.2Q21P19-Q21 PolarHBondContact O-N 2.83Å
20C65.8Low58.7Low42 Ų42117.8 Ų117.828%0.28459%0.589SS.*  trans-50.8106.8-179.2-170.80000110E18 K22 C269E18-C20 PolarHBondContact O-N 3.12Å; E18-C20 VanDerWaalsContact O-N 3.14Å; C20-K22 PolarHBondContact O-N 3.14Å; C20-C269 HydrophobicContact CB-CB 4.09Å; C20-C269 WeakPolarHBondContact CB-SG 3.49Å; C20-C269 WeakPolarHBondContact SG-CB 3.34Å; C20-C269 PolarHBondContact SG-O 3.22Å; C20-C269 CovalentContact SG-SG 2.07Å; C20-C269 PolarHBondContact SG-SG 3.35Å
21Q63Low61Low154 Ų154118 Ų11872%0.7259%0.589SS**  trans-74.6121.5-172.6-72.4-163.5-13.200111.9P19 I23P19-Q21 PolarHBondContact O-N 2.83Å; Q21-I23 HydrophobicContact CB-CD1 4.44Å; Q21-I23 HydrophobicContact CB-CG1 4.47Å
22K66.5Low63.5Low91 Ų91117.8 Ų117.840%0.39659%0.587SS.*  trans-106.927.1-174.4-55.1-178.4-168.1177.40114.3C20 N24 V25 D276C20-K22 PolarHBondContact O-N 3.14Å; K22-N24 PolarHBondContact O-N 3.15Å; K22-V25 PolarHBondContact O-N 3.11Å; K22-D276 WeakPolarHBondContact CE-OD2 3.43Å; K22-D276 VanDerWaalsContact NZ-CG 3.26Å; K22-D276 IonicContact NZ-OD1 3.5Å; K22-D276 PolarHBondContact NZ-OD1 3.41Å; K22-D276 IonicContact NZ-OD2 2.62Å; K22-D276 PolarHBondContact NZ-OD2 3.19Å
23I63.8Low65.8Low91 Ų91111.2 Ų111.247%0.46755%0.553SS.*Hα-helixtrans-57.5-42.6-165-61.2170.7000113Q21 V25 Q27Q21-I23 HydrophobicContact CB-CD1 4.44Å; Q21-I23 HydrophobicContact CB-CG1 4.47Å; I23-V25 VanDerWaalsContact C-N 3.34Å; I23-V25 PolarHBondContact O-N 3.29Å; I23-Q27 PolarHBondContact O-N 3.39Å
24N68.6Low68.3Low123 Ų123106.2 Ų106.266%0.65853%0.528SS*.Hα-helixtrans-67.4-31.9-175-66.2-12.3000113.5K22 I28K22-N24 PolarHBondContact O-N 3.15Å; N24-I28 WeakPolarHBondContact O-CG1 3.34Å; N24-I28 PolarHBondContact O-N 3.46Å
25V71Confident70.8Confident28 Ų28100.4 Ų100.417%0.1752%0.515CS..Hα-helixtrans-74.1-43.7-175.9-1750000110.8K22 I23 Q27 I28 A29 Q277K22-V25 PolarHBondContact O-N 3.11Å; I23-V25 VanDerWaalsContact C-N 3.34Å; I23-V25 PolarHBondContact O-N 3.29Å; V25-Q27 VanDerWaalsContact C-N 3.32Å; V25-Q27 PolarHBondContact O-N 3.31Å; V25-I28 PolarHBondContact O-N 3.19Å; V25-A29 WeakPolarHBondContact O-CB 3.46Å; V25-A29 PolarHBondContact O-N 3.27Å; V25-Q277 HydrophobicContact CB-CG 4.22Å; V25-Q277 HydrophobicContact CG1-CG 3.78Å; V25-Q277 HydrophobicContact CG2-CG 3.35Å
26K72.6Confident73Confident111 Ų11192.7 Ų92.748%0.48349%0.488SS..Hα-helixtrans-62.3-39.9-179.5-167.8178179.2-176.90111.5A29 A30K26-A29 PolarHBondContact O-N 3.43Å; K26-A30 VanDerWaalsContact O-CB 3.27Å; K26-A30 WeakPolarHBondContact O-CB 3.41Å; K26-A30 PolarHBondContact O-N 2.88Å
27Q79.1Confident75.2Confident115 Ų11587 Ų8754%0.53745%0.453SS..Hα-helixtrans-67.9-40179.1-70.2-179.6-5.600113.2I23 V25 R31I23-Q27 PolarHBondContact O-N 3.39Å; V25-Q27 VanDerWaalsContact C-N 3.32Å; V25-Q27 PolarHBondContact O-N 3.31Å; Q27-R31 PolarHBondContact O-N 3.15Å
28I79.3Confident77.4Confident116 Ų11684.3 Ų84.360%0.59543%0.434SS*.Hα-helixtrans-67.2-45.8176.3-66169.5000109.9N24 V25 A30 R31 L32N24-I28 WeakPolarHBondContact O-CG1 3.34Å; N24-I28 PolarHBondContact O-N 3.46Å; V25-I28 PolarHBondContact O-N 3.19Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3.34Å; I28-R31 PolarHBondContact O-N 3.15Å; I28-L32 PolarHBondContact O-N 3.17Å
29A80.3Confident79.4Confident17 Ų1779.6 Ų79.614%0.1442%0.415CS..Hα-helixtrans-58.3-44176.700000111.9V25 K26 R31 L32 L33 Q280V25-A29 WeakPolarHBondContact O-CB 3.46Å; V25-A29 PolarHBondContact O-N 3.27Å; K26-A29 PolarHBondContact O-N 3.43Å; A29-R31 PolarHBondContact O-N 3.37Å; A29-L32 PolarHBondContact O-N 3.1Å; A29-L33 HydrophobicContact CB-CD1 3.78Å; A29-L33 HydrophobicContact CB-CG 4.29Å; A29-L33 VanDerWaalsContact O-CB 3.25Å; A29-L33 WeakPolarHBondContact O-CB 3.48Å; A29-L33 VanDerWaalsContact O-CG 3.23Å; A29-L33 WeakPolarHBondContact O-CG 3.17Å; A29-L33 PolarHBondContact O-N 3.31Å; A29-Q280 HydrophobicContact CB-CG 4.48Å
30A82.1Confident81.1Confident28 Ų2874.5 Ų74.523%0.23138%0.381CS..Hα-helixtrans-61.2-27.5178.400000114K26 I28 P34 A90K26-A30 VanDerWaalsContact O-CB 3.27Å; K26-A30 WeakPolarHBondContact O-CB 3.41Å; K26-A30 PolarHBondContact O-N 2.88Å; I28-A30 VanDerWaalsContact C-N 3.33Å; I28-A30 PolarHBondContact O-N 3.34Å; A30-P34 VanDerWaalsContact O-CD 3.25Å; A30-P34 WeakPolarHBondContact O-CD 3.22Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.29Å; A30-A90 VanDerWaalsContact CA-O 3.32Å; A30-A90 WeakPolarHBondContact CA-O 3.5Å; A30-A90 VanDerWaalsContact CB-O 3.28Å; A30-A90 WeakPolarHBondContact CB-O 3.28Å
31R86.6Confident82.5Confident210 Ų21075.5 Ų75.579%0.79238%0.381SS*.Hα-helixtrans-88.7-37.1177.8-67.8-178.8-177.2-175.11.7112.9Q27 I28 A29 P35Q27-R31 PolarHBondContact O-N 3.15Å; I28-R31 PolarHBondContact O-N 3.15Å; A29-R31 PolarHBondContact O-N 3.37Å; R31-P35 WeakPolarHBondContact O-CD 3.37Å
32L88.1Confident84Confident113 Ų11372.8 Ų72.859%0.59237%0.37SS*.Hα-helixtrans-88.9-39.5-172.6-169.774.1000113.2I28 A29 P35 L36I28-L32 PolarHBondContact O-N 3.17Å; A29-L32 PolarHBondContact O-N 3.1Å; L32-P35 WeakPolarHBondContact O-CD 3.44Å; L32-P35 WeakPolarHBondContact O-CG 3.46Å; L32-L36 WeakPolarHBondContact O-CB 3.35Å; L32-L36 PolarHBondContact O-N 3.01Å
33L88.6Confident85.3Confident6 Ų674.3 Ų74.33%0.03138%0.377CS..Hα-helixtrans-68.4-43.6-172.4-62.5178000113.3A29 L36 Y37 A90 Q280 T284A29-L33 HydrophobicContact CB-CD1 3.78Å; A29-L33 HydrophobicContact CB-CG 4.29Å; A29-L33 VanDerWaalsContact O-CB 3.25Å; A29-L33 WeakPolarHBondContact O-CB 3.48Å; A29-L33 VanDerWaalsContact O-CG 3.23Å; A29-L33 WeakPolarHBondContact O-CG 3.17Å; A29-L33 PolarHBondContact O-N 3.31Å; L33-L36 PolarHBondContact O-N 3.31Å; L33-Y37 HydrophobicContact CB-CD2 4.47Å; L33-Y37 HydrophobicContact CB-CE2 4.3Å; L33-Y37 HydrophobicContact CD2-CE1 4.24Å; L33-Y37 VanDerWaalsContact O-CB 3.25Å; L33-Y37 WeakPolarHBondContact O-CB 3.31Å; L33-Y37 PolarHBondContact O-N 3.21Å; L33-A90 HydrophobicContact CB-CB 4.03Å; L33-A90 HydrophobicContact CD1-CB 3.77Å; L33-Q280 HydrophobicContact CD1-CG 4.45Å; L33-Q280 VanDerWaalsContact CD1-NE2 3.31Å; L33-T284 HydrophobicContact CD2-CG2 3.44Å; L33-T284 VanDerWaalsContact CD2-CG2 3.44Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.34Å
34P90.1Very high86.7Confident28 Ų2870 Ų7018%0.18236%0.355CS..Hα-helixtrans-59.5-49-177.5-23.634000115.4A30 S38 A87 A91A30-P34 VanDerWaalsContact O-CD 3.25Å; A30-P34 WeakPolarHBondContact O-CD 3.22Å; A30-P34 VanDerWaalsContact O-CG 3.28Å; A30-P34 WeakPolarHBondContact O-CG 3.29Å; P34-S38 WeakPolarHBondContact O-CB 3.48Å; P34-S38 PolarHBondContact O-N 3.47Å; P34-S38 PolarHBondContact O-OG 2.85Å; P34-A87 HydrophobicContact CB-CB 4.46Å; P34-A91 HydrophobicContact CG-CB 3.81Å
35P92.2Very high88Confident79 Ų7968.2 Ų68.251%0.51334%0.341SS..Hα-helixtrans-66.3-38.2177.425.3-33.1000112R31 L32 S38 L39R31-P35 WeakPolarHBondContact O-CD 3.37Å; L32-P35 WeakPolarHBondContact O-CD 3.44Å; L32-P35 WeakPolarHBondContact O-CG 3.46Å; P35-S38 PolarHBondContact O-N 2.89Å; P35-L39 PolarHBondContact O-N 3.14Å
36L92.7Very high89.1Confident57 Ų5771.2 Ų71.230%0.29836%0.36SS..Hα-helixtrans-63.3-49177.6178.962.9000111.7L32 L33 S38 L39 V40 T284 T288L32-L36 WeakPolarHBondContact O-CB 3.35Å; L32-L36 PolarHBondContact O-N 3.01Å; L33-L36 PolarHBondContact O-N 3.31Å; L36-S38 VanDerWaalsContact C-N 3.32Å; L36-S38 PolarHBondContact O-N 3.28Å; L36-L39 WeakPolarHBondContact O-CB 3.34Å; L36-L39 PolarHBondContact O-N 3.43Å; L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.06Å; L36-T284 HydrophobicContact CD2-CG2 3.53Å; L36-T288 HydrophobicContact CD1-CG2 4.46Å; L36-T288 HydrophobicContact CD2-CG2 4.44Å; L36-T288 HydrophobicContact CG-CG2 4.49Å
37Y92.7Very high90.1Very high4 Ų466.6 Ų66.62%0.01634%0.344CS..Hα-helixtrans-66-34.6178.9-77.51.9000112.4L33 L39 V40 F41 V83 W86 A87 T284 M287L33-Y37 HydrophobicContact CB-CD2 4.47Å; L33-Y37 HydrophobicContact CB-CE2 4.3Å; L33-Y37 HydrophobicContact CD2-CE1 4.24Å; L33-Y37 VanDerWaalsContact O-CB 3.25Å; L33-Y37 WeakPolarHBondContact O-CB 3.31Å; L33-Y37 PolarHBondContact O-N 3.21Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; Y37-V40 PolarHBondContact O-N 2.93Å; Y37-F41 WeakPolarHBondContact O-CB 3.19Å; Y37-F41 PolarHBondContact O-N 3.35Å; Y37-V83 VanDerWaalsContact CB-CG1 3.48Å; Y37-V83 HydrophobicContact CD1-CG1 4.34Å; Y37-V83 HydrophobicContact CD2-CG1 4.23Å; Y37-V83 HydrophobicContact CG-CG1 3.79Å; Y37-V83 WeakPolarHBondContact O-CG1 3.25Å; Y37-W86 HydrophobicContact CD2-CB 4.36Å; Y37-W86 HydrophobicContact CE2-CB 4.12Å; Y37-A87 HydrophobicContact CD2-CB 3.97Å; Y37-A87 HydrophobicContact CG-CB 4.43Å; Y37-T284 HydrophobicContact CE1-CG2 3.84Å; Y37-T284 PolarHBondContact OH-OG1 3.29Å; Y37-M287 HydrophobicContact CE1-CB 4.04Å; Y37-M287 HydrophobicContact CE1-CG 4.4Å
38S91.9Very high90.9Very high59 Ų5961.1 Ų61.141%0.41332%0.318SS..Hα-helixtrans-61.6-43.1171.5-59.30000111.5P34 P35 L36 F41 I42P34-S38 WeakPolarHBondContact O-CB 3.48Å; P34-S38 PolarHBondContact O-N 3.47Å; P34-S38 PolarHBondContact O-OG 2.85Å; P35-S38 PolarHBondContact O-N 2.89Å; L36-S38 VanDerWaalsContact C-N 3.32Å; L36-S38 PolarHBondContact O-N 3.28Å; S38-F41 PolarHBondContact O-N 3.16Å; S38-I42 VanDerWaalsContact O-CG1 3.31Å; S38-I42 WeakPolarHBondContact O-CG1 3.23Å; S38-I42 PolarHBondContact O-N 3.02Å
39L93.5Very high91.6Very high87 Ų8759 Ų5946%0.45531%0.306SS..Hα-helixtrans-64.8-44.2176.6-166.868.7000111.9P35 L36 Y37 F41 I42 F43P35-L39 PolarHBondContact O-N 3.14Å; L36-L39 WeakPolarHBondContact O-CB 3.34Å; L36-L39 PolarHBondContact O-N 3.43Å; Y37-L39 VanDerWaalsContact C-N 3.34Å; L39-F41 VanDerWaalsContact C-N 3.32Å; L39-F41 PolarHBondContact O-N 3.42Å; L39-I42 PolarHBondContact O-N 3.47Å; L39-F43 HydrophobicContact CD1-CD2 3.82Å; L39-F43 HydrophobicContact CD1-CE2 3.25Å; L39-F43 HydrophobicContact CD1-CZ 3.97Å; L39-F43 HydrophobicContact CD2-CD2 4.44Å; L39-F43 HydrophobicContact CD2-CE2 4.03Å; L39-F43 HydrophobicContact CG-CD2 3.67Å; L39-F43 HydrophobicContact CG-CE2 3.48Å; L39-F43 VanDerWaalsContact CG-CE2 3.48Å; L39-F43 WeakPolarHBondContact O-CD2 3.49Å; L39-F43 PolarHBondContact O-N 3.09Å
40V94.4Very high92.1Very high6 Ų659.8 Ų59.84%0.03631%0.308CS..Hα-helixtrans-59.1-44.6175.1170.90000110.7L36 Y37 G44 L80 T288 C290 C291L36-V40 WeakPolarHBondContact O-CG2 3.36Å; L36-V40 PolarHBondContact O-N 3.06Å; Y37-V40 PolarHBondContact O-N 2.93Å; V40-G44 WeakPolarHBondContact O-CA 3.24Å; V40-G44 PolarHBondContact O-N 2.92Å; V40-L80 HydrophobicContact CG1-CD2 4.42Å; V40-T288 HydrophobicContact CG2-CG2 3.66Å; V40-C290 VanDerWaalsContact CG1-SG 3.56Å; V40-C291 HydrophobicContact CG1-CB 4.49Å
41F94.7Very high92.6Very high63 Ų6358.5 Ų58.528%0.27630%0.298SS..Hα-helixtrans-61.1-49.5177.7177.2-106.5000111.7Y37 S38 L39 F45 L80 P84Y37-F41 WeakPolarHBondContact O-CB 3.19Å; Y37-F41 PolarHBondContact O-N 3.35Å; S38-F41 PolarHBondContact O-N 3.16Å; L39-F41 VanDerWaalsContact C-N 3.32Å; L39-F41 PolarHBondContact O-N 3.42Å; F41-F45 HydrophobicContact CE2-CD2 4.4Å; F41-F45 HydrophobicContact CZ-CD2 4.49Å; F41-F45 WeakPolarHBondContact O-CB 3.3Å; F41-F45 PolarHBondContact O-N 2.83Å; F41-L80 HydrophobicContact CD2-CB 4.37Å; F41-L80 WeakPolarHBondContact CD2-O 3.42Å; F41-P84 HydrophobicContact CB-CG 4.4Å; F41-P84 HydrophobicContact CD1-CG 4.28Å; F41-P84 HydrophobicContact CD2-CG 3.84Å; F41-P84 HydrophobicContact CE2-CG 4.16Å; F41-P84 HydrophobicContact CG-CG 3.9Å
42I94.4Very high93Very high97 Ų9749.8 Ų49.850%0.49727%0.266SS..Hα-helixtrans-61.1-54.9-178.8-67.4165.8000110.9S38 L39 V46S38-I42 VanDerWaalsContact O-CG1 3.31Å; S38-I42 WeakPolarHBondContact O-CG1 3.23Å; S38-I42 PolarHBondContact O-N 3.02Å; L39-I42 PolarHBondContact O-N 3.47Å; I42-V46 WeakPolarHBondContact O-CB 3.28Å; I42-V46 VanDerWaalsContact O-CG2 3.31Å; I42-V46 WeakPolarHBondContact O-CG2 3.39Å; I42-V46 PolarHBondContact O-N 3.46Å; I42-V46 VanDerWaalsContact O-N 3.09Å
43F93.8Very high93.1Very high123 Ų12348 Ų4854%0.53926%0.257SS..Hα-helixtrans-68.5-39.4-177.7-71.3-49.2000112.4L39 G47 C291L39-F43 HydrophobicContact CD1-CD2 3.82Å; L39-F43 HydrophobicContact CD1-CE2 3.25Å; L39-F43 HydrophobicContact CD1-CZ 3.97Å; L39-F43 HydrophobicContact CD2-CD2 4.44Å; L39-F43 HydrophobicContact CD2-CE2 4.03Å; L39-F43 HydrophobicContact CG-CD2 3.67Å; L39-F43 HydrophobicContact CG-CE2 3.48Å; L39-F43 VanDerWaalsContact CG-CE2 3.48Å; L39-F43 WeakPolarHBondContact O-CD2 3.49Å; L39-F43 PolarHBondContact O-N 3.09Å; F43-G47 WeakPolarHBondContact O-CA 3.4Å; F43-G47 PolarHBondContact O-N 2.83Å; F43-C291 HydrophobicContact CB-CB 4.38Å
44G94.7Very high93.1Very high0 Ų047.7 Ų47.70%026%0.256CS..Hα-helixtrans-64.5-45.317800000111.9V40 N48 L80V40-G44 WeakPolarHBondContact O-CA 3.24Å; V40-G44 PolarHBondContact O-N 2.92Å; G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 3.46Å; G44-N48 PolarHBondContact O-N 3.12Å; G44-N48 PolarHBondContact O-ND2 2.9Å; G44-L80 WeakPolarHBondContact O-CD1 3.26Å
45F95.1Very high93.1Very high85 Ų8546.5 Ų46.537%0.37325%0.247SC..Hα-helixtrans-66.4-51.4-179.2-171-92000111.2F41 G47 M49 L77F41-F45 HydrophobicContact CE2-CD2 4.4Å; F41-F45 HydrophobicContact CZ-CD2 4.49Å; F41-F45 WeakPolarHBondContact O-CB 3.3Å; F41-F45 PolarHBondContact O-N 2.83Å; F45-G47 PolarHBondContact O-N 3.2Å; F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.44Å; F45-M49 HydrophobicContact CE1-CE 4.27Å; F45-M49 HydrophobicContact CE1-CG 3.96Å; F45-M49 HydrophobicContact CE2-CE 3.63Å; F45-M49 HydrophobicContact CZ-CE 3.53Å; F45-M49 HydrophobicContact CZ-CG 4.16Å; F45-M49 VanDerWaalsContact O-CB 3.25Å; F45-M49 WeakPolarHBondContact O-CB 3.46Å; F45-M49 WeakPolarHBondContact O-CG 3.49Å; F45-M49 PolarHBondContact O-N 3.45Å; F45-L77 HydrophobicContact CD2-CD2 3.89Å; F45-L77 HydrophobicContact CE2-CD2 4.27Å
46V94.1Very high93Very high92 Ų9246.5 Ų46.556%0.55824%0.242SC*.Hα-helixtrans-61.7-45.2179175.10000110.9I42 L50I42-V46 WeakPolarHBondContact O-CB 3.28Å; I42-V46 VanDerWaalsContact O-CG2 3.31Å; I42-V46 WeakPolarHBondContact O-CG2 3.39Å; I42-V46 PolarHBondContact O-N 3.46Å; I42-V46 VanDerWaalsContact O-N 3.09Å; V46-L50 WeakPolarHBondContact O-CB 3.29Å; V46-L50 PolarHBondContact O-N 3.26Å
47G93.4Very high92.7Very high14 Ų1448 Ų4814%0.14425%0.251CS..Hα-helixtrans-62.8-51.3-179.200000112.6F43 F45 L50 V51F43-G47 WeakPolarHBondContact O-CA 3.4Å; F43-G47 PolarHBondContact O-N 2.83Å; F45-G47 PolarHBondContact O-N 3.2Å; G47-L50 PolarHBondContact O-N 3.46Å; G47-V51 WeakPolarHBondContact O-CG2 2.91Å; G47-V51 PolarHBondContact O-N 3.23Å
48N95.3Very high92.3Very high0 Ų049.7 Ų49.70%026%0.263CS..Hα-helixtrans-69.6-36.9-178.4-74-63.3000112.1G44 L50 V51 I52 D76 L77 C290G44-N48 VanDerWaalsContact O-CB 3.29Å; G44-N48 WeakPolarHBondContact O-CB 3.46Å; G44-N48 PolarHBondContact O-N 3.12Å; G44-N48 PolarHBondContact O-ND2 2.9Å; N48-L50 VanDerWaalsContact C-N 3.33Å; N48-L50 PolarHBondContact O-N 3Å; N48-V51 WeakPolarHBondContact O-CB 3.42Å; N48-V51 PolarHBondContact O-N 3.43Å; N48-I52 WeakPolarHBondContact O-CG1 3.36Å; N48-I52 PolarHBondContact O-N 2.68Å; N48-D76 PolarHBondContact OD1-OD2 2.97Å; N48-L77 HydrophobicContact CB-CD2 4.05Å; N48-L77 HydrophobicContact CB-CG 4.01Å; N48-C290 PolarHBondContact ND2-O 3.34Å
49M94.4Very high91.8Very high70 Ų7048.6 Ų48.635%0.34525%0.251SS..Hα-helixtrans-61.2-41.9171.9-74.2-62.3179.300112F45 V51 I52 L53 L77F45-M49 HydrophobicContact CD1-CG 4.17Å; F45-M49 HydrophobicContact CD2-CE 4.44Å; F45-M49 HydrophobicContact CE1-CE 4.27Å; F45-M49 HydrophobicContact CE1-CG 3.96Å; F45-M49 HydrophobicContact CE2-CE 3.63Å; F45-M49 HydrophobicContact CZ-CE 3.53Å; F45-M49 HydrophobicContact CZ-CG 4.16Å; F45-M49 VanDerWaalsContact O-CB 3.25Å; F45-M49 WeakPolarHBondContact O-CB 3.46Å; F45-M49 WeakPolarHBondContact O-CG 3.49Å; F45-M49 PolarHBondContact O-N 3.45Å; M49-V51 VanDerWaalsContact C-N 3.33Å; M49-V51 PolarHBondContact O-N 2.91Å; M49-I52 PolarHBondContact O-N 2.92Å; M49-L53 WeakPolarHBondContact O-CG 3.24Å; M49-L53 PolarHBondContact O-N 3.08Å; M49-L77 HydrophobicContact CE-CD1 3.54Å; M49-L77 HydrophobicContact CE-CD2 3.92Å; M49-L77 HydrophobicContact CE-CG 4.38Å; M49-L77 HydrophobicContact CG-CD1 4.48Å; M49-L77 HydrophobicContact CG-CD2 4.38Å; M49-L77 HydrophobicContact SD-CD1 3.77Å
50L91.9Very high91.5Very high34 Ų3453.1 Ų53.118%0.17826%0.262CS..Hα-helixtrans-62.7-40.8175.6-176.762.9000111.8V46 G47 N48 L53 I54 L308 F311 F312V46-L50 WeakPolarHBondContact O-CB 3.29Å; V46-L50 PolarHBondContact O-N 3.26Å; G47-L50 PolarHBondContact O-N 3.46Å; N48-L50 VanDerWaalsContact C-N 3.33Å; N48-L50 PolarHBondContact O-N 3Å; L50-L53 PolarHBondContact O-N 3.12Å; L50-I54 HydrophobicContact CD1-CD1 4.04Å; L50-I54 HydrophobicContact CD1-CG1 4.33Å; L50-I54 HydrophobicContact CG-CD1 3.87Å; L50-I54 WeakPolarHBondContact O-CB 3.43Å; L50-I54 WeakPolarHBondContact O-CG1 3.37Å; L50-I54 PolarHBondContact O-N 3.05Å; L50-L308 HydrophobicContact CD2-CD1 3.78Å; L50-L308 HydrophobicContact CD2-CG 4.33Å; L50-F311 HydrophobicContact CD1-CD1 3.86Å; L50-F311 HydrophobicContact CD1-CE1 3.73Å; L50-F311 HydrophobicContact CD1-CZ 4.44Å; L50-F312 HydrophobicContact CD2-CE2 4.43Å
51V92.5Very high91.2Very high2 Ų254.9 Ų54.91%0.01227%0.27CS..Hα-helixtrans-58.1-50.1174.5172.10000110.5G47 N48 M49 L53 I54 L55 A73 P294 Y297 F304G47-V51 WeakPolarHBondContact O-CG2 2.91Å; G47-V51 PolarHBondContact O-N 3.23Å; N48-V51 WeakPolarHBondContact O-CB 3.42Å; N48-V51 PolarHBondContact O-N 3.43Å; M49-V51 VanDerWaalsContact C-N 3.33Å; M49-V51 PolarHBondContact O-N 2.91Å; V51-L53 PolarHBondContact O-N 2.98Å; V51-I54 PolarHBondContact O-N 2.71Å; V51-L55 HydrophobicContact CG1-CD1 3.79Å; V51-L55 HydrophobicContact CG1-CG 4.25Å; V51-L55 WeakPolarHBondContact O-CB 3.37Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.49Å; V51-L55 PolarHBondContact O-N 3Å; V51-A73 HydrophobicContact CB-CB 4.43Å; V51-A73 HydrophobicContact CG1-CB 4.03Å; V51-P294 HydrophobicContact CG2-CB 4.1Å; V51-P294 HydrophobicContact CG2-CG 4.18Å; V51-Y297 HydrophobicContact CG1-CD2 4.28Å; V51-Y297 HydrophobicContact CG1-CE2 4.17Å; V51-Y297 HydrophobicContact CG2-CD2 3.67Å; V51-Y297 HydrophobicContact CG2-CE2 4.12Å; V51-F304 HydrophobicContact CB-CE2 4.38Å; V51-F304 HydrophobicContact CB-CZ 4.38Å; V51-F304 HydrophobicContact CG1-CE2 4.45Å; V51-F304 HydrophobicContact CG2-CE2 3.99Å; V51-F304 HydrophobicContact CG2-CZ 3.64Å
52I94.1Very high90.8Very high26 Ų2659.6 Ų59.613%0.13329%0.291CS..Hα-helixtrans-57.8-48.8178.4-68.1178.5000111N48 M49 I54 L55 I56 L70 A73 I74 L77N48-I52 WeakPolarHBondContact O-CG1 3.36Å; N48-I52 PolarHBondContact O-N 2.68Å; M49-I52 PolarHBondContact O-N 2.92Å; I52-I54 VanDerWaalsContact C-N 3.35Å; I52-I54 PolarHBondContact O-N 3.46Å; I52-L55 PolarHBondContact O-N 2.89Å; I52-I56 HydrophobicContact CG2-CD1 3.65Å; I52-I56 HydrophobicContact CG2-CG1 4.44Å; I52-I56 WeakPolarHBondContact O-CG1 3.23Å; I52-I56 PolarHBondContact O-N 3.38Å; I52-L70 HydrophobicContact CB-CD1 4.26Å; I52-L70 HydrophobicContact CG1-CD1 3.97Å; I52-L70 HydrophobicContact CG2-CD1 3.95Å; I52-A73 HydrophobicContact CD1-CB 4.27Å; I52-A73 HydrophobicContact CG1-CB 3.81Å; I52-I74 HydrophobicContact CD1-CG1 4.02Å; I52-L77 HydrophobicContact CD1-CD1 3.35Å
53L91.3Very high90.5Very high76 Ų7656.8 Ų56.840%0.39828%0.28SS..Hα-helixtrans-59.7-42.9179.5-72.8171.6000112.3M49 L50 V51 N57 F311M49-L53 WeakPolarHBondContact O-CG 3.24Å; M49-L53 PolarHBondContact O-N 3.08Å; L50-L53 PolarHBondContact O-N 3.12Å; V51-L53 PolarHBondContact O-N 2.98Å; L53-N57 VanDerWaalsContact O-CB 3.23Å; L53-N57 WeakPolarHBondContact O-CB 3.4Å; L53-N57 PolarHBondContact O-N 2.72Å; L53-N57 PolarHBondContact O-ND2 3.36Å; L53-F311 HydrophobicContact CD1-CZ 4.38Å
54I88.6Confident90.4Very high0 Ų051.8 Ų51.80%026%0.258CS..Iπ-helixtrans-66.4-42.3177.6-72.2169.2000110.9L50 V51 I52 C58 K59 F304 Y307 L308L50-I54 HydrophobicContact CD1-CD1 4.04Å; L50-I54 HydrophobicContact CD1-CG1 4.33Å; L50-I54 HydrophobicContact CG-CD1 3.87Å; L50-I54 WeakPolarHBondContact O-CB 3.43Å; L50-I54 WeakPolarHBondContact O-CG1 3.37Å; L50-I54 PolarHBondContact O-N 3.05Å; V51-I54 PolarHBondContact O-N 2.71Å; I52-I54 VanDerWaalsContact C-N 3.35Å; I52-I54 PolarHBondContact O-N 3.46Å; I54-C58 HydrophobicContact CG2-CB 4.31Å; I54-C58 WeakPolarHBondContact O-CA 3.42Å; I54-C58 VanDerWaalsContact O-CB 3.25Å; I54-C58 WeakPolarHBondContact O-CB 3.36Å; I54-C58 PolarHBondContact O-N 3.49Å; I54-K59 PolarHBondContact O-N 3.3Å; I54-F304 HydrophobicContact CB-CE2 4.06Å; I54-F304 HydrophobicContact CD1-CD2 4.49Å; I54-F304 HydrophobicContact CD1-CE1 4.21Å; I54-F304 HydrophobicContact CD1-CE2 3.74Å; I54-F304 HydrophobicContact CD1-CZ 3.57Å; I54-F304 HydrophobicContact CG2-CD2 4.07Å; I54-F304 HydrophobicContact CG2-CE2 3.89Å; I54-Y307 HydrophobicContact CG2-CG 4.36Å; I54-L308 HydrophobicContact CD1-CB 4.05Å; I54-L308 HydrophobicContact CD1-CD1 4.48Å; I54-L308 HydrophobicContact CD1-CG 4.39Å
55L89.5Confident90.2Very high2 Ų252.6 Ų52.61%0.0126%0.263CS..Iπ-helixtrans-64.7-42.1-179.5-71.3178.2000112.1V51 I52 K59 R60 L61 D66 L69 L70V51-L55 HydrophobicContact CG1-CD1 3.79Å; V51-L55 HydrophobicContact CG1-CG 4.25Å; V51-L55 WeakPolarHBondContact O-CB 3.37Å; V51-L55 VanDerWaalsContact O-CG 3.25Å; V51-L55 WeakPolarHBondContact O-CG 3.49Å; V51-L55 PolarHBondContact O-N 3Å; I52-L55 PolarHBondContact O-N 2.89Å; L55-K59 HydrophobicContact CD2-CD 3.93Å; L55-K59 CarbonylContact O-C 3.09Å; L55-R60 PolarHBondContact O-N 3.34Å; L55-L61 HydrophobicContact CB-CD2 3.91Å; L55-L61 PolarHBondContact O-N 3.33Å; L55-D66 HydrophobicContact CD2-CB 4.39Å; L55-L69 HydrophobicContact CD1-CB 3.92Å; L55-L70 HydrophobicContact CD1-CB 4Å; L55-L70 HydrophobicContact CD1-CD1 4.5Å
56I90.5Very high90Very high79 Ų7949.2 Ų49.241%0.40525%0.249SC..Iπ-helixtrans-75.5-54179.7-64.3173.9000111I52 R60 L61 L70I52-I56 HydrophobicContact CG2-CD1 3.65Å; I52-I56 HydrophobicContact CG2-CG1 4.44Å; I52-I56 WeakPolarHBondContact O-CG1 3.23Å; I52-I56 PolarHBondContact O-N 3.38Å; I56-R60 WeakPolarHBondContact O-CA 3.32Å; I56-R60 PolarHBondContact O-N 2.75Å; I56-L61 HydrophobicContact CG1-CD1 4.35Å; I56-L70 HydrophobicContact CD1-CD1 4.42Å; I56-L70 HydrophobicContact CG1-CD1 4.38Å
57N85.7Confident90Very high89 Ų8945.5 Ų45.548%0.47623%0.226SC..Iπ-helixtrans-84.7-37.5-168.3-62.7-36.5000113.6L53L53-N57 VanDerWaalsContact O-CB 3.23Å; L53-N57 WeakPolarHBondContact O-CB 3.4Å; L53-N57 PolarHBondContact O-N 2.72Å; L53-N57 PolarHBondContact O-ND2 3.36Å
58C83.9Confident90.1Very high39 Ų3945 Ų4526%0.26422%0.22SC..Iπ-helixtrans-94.9-48.8-175.3-55.30000111.7I54 Y307I54-C58 HydrophobicContact CG2-CB 4.31Å; I54-C58 WeakPolarHBondContact O-CA 3.42Å; I54-C58 VanDerWaalsContact O-CB 3.25Å; I54-C58 WeakPolarHBondContact O-CB 3.36Å; I54-C58 PolarHBondContact O-N 3.49Å; C58-Y307 HydrophobicContact CB-CD1 3.64Å; C58-Y307 HydrophobicContact CB-CE1 4.23Å; C58-Y307 HydrophobicContact CB-CG 4.16Å
59K82.6Confident90Very high37 Ų3745.6 Ų45.616%0.16122%0.223CC..Iπ-helixtrans-86.1-23.5-178.6-75.9-159.2-179.3172.80114.5I54 L55 L61 D66 Y307I54-K59 PolarHBondContact O-N 3.3Å; L55-K59 HydrophobicContact CD2-CD 3.93Å; L55-K59 CarbonylContact O-C 3.09Å; K59-L61 PolarHBondContact O-N 2.91Å; K59-D66 WeakPolarHBondContact CD-OD1 3.28Å; K59-D66 IonicContact NZ-OD1 3.29Å; K59-D66 PolarHBondContact NZ-OD1 3.48Å; K59-Y307 HydrophobicContact CD-CE2 4.23Å; K59-Y307 HydrophobicContact CG-CD2 3.98Å; K59-Y307 HydrophobicContact CG-CE2 3.64Å
60R87.3Confident90.1Very high182 Ų18243.4 Ų43.469%0.68721%0.212SC*.THydrogen-bonded Turntrans55.332.5-179.6-53.7-174.8-178.9-177.1-0.5113.9L55 I56 K62L55-R60 PolarHBondContact O-N 3.34Å; I56-R60 WeakPolarHBondContact O-CA 3.32Å; I56-R60 PolarHBondContact O-N 2.75Å; R60-K62 HydrophobicContact CB-CG 4.39Å; R60-K62 PolarHBondContact O-N 3.01Å
61L87.4Confident90.3Very high42 Ų4242.7 Ų42.722%0.2221%0.209CC..THydrogen-bonded Turntrans46.739.6171.8-55.9175000115.3L55 I56 K59 S63 D66 I67 L70L55-L61 HydrophobicContact CB-CD2 3.91Å; L55-L61 PolarHBondContact O-N 3.33Å; I56-L61 HydrophobicContact CG1-CD1 4.35Å; K59-L61 PolarHBondContact O-N 2.91Å; L61-S63 PolarHBondContact O-N 2.9Å; L61-D66 HydrophobicContact CD2-CB 4.23Å; L61-I67 HydrophobicContact CB-CD1 3.9Å; L61-I67 HydrophobicContact CD1-CD1 4.26Å; L61-I67 HydrophobicContact CG-CD1 4.46Å; L61-L70 HydrophobicContact CD1-CD2 3.77Å; L61-L70 HydrophobicContact CD2-CB 4.18Å; L61-L70 HydrophobicContact CD2-CD2 4.03Å
62K85.9Confident90.5Very high162 Ų16242.6 Ų42.670%0.70421%0.208SC*.  trans-74.8-6.2-172.2-65.3-175.8179.8-172.90114.6R60R60-K62 HydrophobicContact CB-CG 4.39Å; R60-K62 PolarHBondContact O-N 3.01Å
63S88.1Confident90.6Very high38 Ų3841.4 Ų41.427%0.26620%0.202SC..SBendtrans-135151.3-176.775.60000112L61 T65 D66 I67L61-S63 PolarHBondContact O-N 2.9Å; S63-T65 PolarHBondContact O-N 3.41Å; S63-D66 WeakPolarHBondContact O-CB 3.32Å; S63-D66 PolarHBondContact O-N 3.4Å; S63-D66 PolarHBondContact OG-N 3.33Å; S63-D66 PolarHBondContact OG-OD2 2.83Å; S63-I67 PolarHBondContact O-N 2.87Å
64M91.1Very high90.8Very high19 Ų1940.5 Ų40.59%0.09420%0.197CC..Hα-helixtrans-53.4-36.9174.5-173.7173.8-176.900112.4D66 I67 Y68 R140M64-D66 PolarHBondContact O-N 3.01Å; M64-I67 WeakPolarHBondContact O-CB 3.16Å; M64-I67 PolarHBondContact O-N 3.5Å; M64-Y68 HydrophobicContact CE-CE2 3.82Å; M64-Y68 WeakPolarHBondContact CE-OH 3.41Å; M64-Y68 HydrophobicContact CG-CD2 4.42Å; M64-Y68 HydrophobicContact CG-CE2 3.85Å; M64-Y68 PolarHBondContact O-N 2.66Å; M64-R140 HydrophobicContact SD-CB 3.93Å; M64-R140 HydrophobicContact SD-CG 4.11Å
65T90.7Very high91.2Very high16 Ų1640.5 Ų40.510%0.09820%0.197CC..Hα-helixtrans-63.5-40.2174.8-43.60000112.5S63 I67 Y68 L69 L122 D125 R126 R140S63-T65 PolarHBondContact O-N 3.41Å; T65-I67 VanDerWaalsContact C-N 3.28Å; T65-I67 PolarHBondContact O-N 3.32Å; T65-Y68 PolarHBondContact O-N 2.7Å; T65-L69 HydrophobicContact CG2-CD1 4.26Å; T65-L69 HydrophobicContact CG2-CG 4.5Å; T65-L69 WeakPolarHBondContact O-CB 3.28Å; T65-L69 VanDerWaalsContact O-CG 3.29Å; T65-L69 WeakPolarHBondContact O-CG 3.4Å; T65-L69 PolarHBondContact O-N 3.07Å; T65-L122 HydrophobicContact CG2-CD2 3.7Å; T65-D125 PolarHBondContact OG1-OD2 3.29Å; T65-R126 PolarHBondContact OG1-NH2 3.31Å; T65-R140 PolarHBondContact OG1-NH2 2.88Å
66D91.4Very high91.5Very high14 Ų1440.8 Ų40.88%0.07520%0.199CC..Hα-helixtrans-67.7-32.4178.2-60.1-49.9000110.8L55 K59 L61 S63 M64 L70L55-D66 HydrophobicContact CD2-CB 4.39Å; K59-D66 WeakPolarHBondContact CD-OD1 3.28Å; K59-D66 IonicContact NZ-OD1 3.29Å; K59-D66 PolarHBondContact NZ-OD1 3.48Å; L61-D66 HydrophobicContact CD2-CB 4.23Å; S63-D66 WeakPolarHBondContact O-CB 3.32Å; S63-D66 PolarHBondContact O-N 3.4Å; S63-D66 PolarHBondContact OG-N 3.33Å; S63-D66 PolarHBondContact OG-OD2 2.83Å; M64-D66 PolarHBondContact O-N 3.01Å; D66-L70 WeakPolarHBondContact O-CB 3.38Å; D66-L70 PolarHBondContact O-N 2.9Å
67I94.9Very high91.7Very high14 Ų1438.2 Ų38.27%0.07219%0.186CC..Hα-helixtrans-63.9-46171.8-59.4-65.1000111.1L61 S63 M64 T65 L70 N71 V142L61-I67 HydrophobicContact CB-CD1 3.9Å; L61-I67 HydrophobicContact CD1-CD1 4.26Å; L61-I67 HydrophobicContact CG-CD1 4.46Å; S63-I67 PolarHBondContact O-N 2.87Å; M64-I67 WeakPolarHBondContact O-CB 3.16Å; M64-I67 PolarHBondContact O-N 3.5Å; T65-I67 VanDerWaalsContact C-N 3.28Å; T65-I67 PolarHBondContact O-N 3.32Å; I67-L70 WeakPolarHBondContact O-CB 3.4Å; I67-L70 PolarHBondContact O-N 3.49Å; I67-N71 PolarHBondContact O-N 2.85Å; I67-N71 PolarHBondContact O-ND2 3.03Å; I67-V142 HydrophobicContact CD1-CG1 4.23Å; I67-V142 HydrophobicContact CG1-CG1 4.26Å
68Y95.3Very high92.1Very high4 Ų437.7 Ų37.72%0.01618%0.179CC..Hα-helixtrans-68.4-38.4178.3-64.1-25.1000113.1M64 T65 L70 N71 L72 F118 L121 L122 D125 T148M64-Y68 HydrophobicContact CE-CE2 3.82Å; M64-Y68 WeakPolarHBondContact CE-OH 3.41Å; M64-Y68 HydrophobicContact CG-CD2 4.42Å; M64-Y68 HydrophobicContact CG-CE2 3.85Å; M64-Y68 PolarHBondContact O-N 2.66Å; T65-Y68 PolarHBondContact O-N 2.7Å; Y68-L70 VanDerWaalsContact C-N 3.29Å; Y68-L70 PolarHBondContact O-N 3.35Å; Y68-N71 PolarHBondContact O-N 3.46Å; Y68-L72 WeakPolarHBondContact O-CB 3.2Å; Y68-L72 PolarHBondContact O-N 3.09Å; Y68-F118 HydrophobicContact CD1-CD1 4.08Å; Y68-F118 HydrophobicContact CD1-CE1 4.22Å; Y68-L121 HydrophobicContact CD1-CD1 4.47Å; Y68-L121 HydrophobicContact CD2-CB 4.01Å; Y68-L121 HydrophobicContact CE1-CB 4.44Å; Y68-L121 HydrophobicContact CE1-CD1 4.01Å; Y68-L121 HydrophobicContact CE2-CB 3.81Å; Y68-L121 HydrophobicContact CG-CB 4.39Å; Y68-L122 HydrophobicContact CD2-CD2 4.38Å; Y68-D125 HydrophobicContact CD2-CB 4.31Å; Y68-D125 HydrophobicContact CE2-CB 4.13Å; Y68-T148 WeakPolarHBondContact CE1-OG1 3.49Å; Y68-T148 PolarHBondContact OH-OG1 3.1Å
69L93.3Very high92.3Very high13 Ų1336.2 Ų36.27%0.06817%0.168CC..Hα-helixtrans-62.9-36.5173-70.8171.6000112L55 T65 A73 L122 Y297L55-L69 HydrophobicContact CD1-CB 3.92Å; T65-L69 HydrophobicContact CG2-CD1 4.26Å; T65-L69 HydrophobicContact CG2-CG 4.5Å; T65-L69 WeakPolarHBondContact O-CB 3.28Å; T65-L69 VanDerWaalsContact O-CG 3.29Å; T65-L69 WeakPolarHBondContact O-CG 3.4Å; T65-L69 PolarHBondContact O-N 3.07Å; L69-A73 PolarHBondContact O-N 2.93Å; L69-A73 VanDerWaalsContact O-N 3.1Å; L69-L122 HydrophobicContact CD2-CD1 3.89Å; L69-L122 HydrophobicContact CD2-CD2 4.22Å; L69-L122 HydrophobicContact CG-CD2 4.11Å; L69-Y297 HydrophobicContact CD2-CE1 3.81Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.33Å
70L95.6Very high92.9Very high23 Ų2334.4 Ų34.412%0.1216%0.161CC..Hα-helixtrans-63.8-49174.4177.670.9000111I52 L55 I56 L61 D66 I67 Y68 L72 A73 I74I52-L70 HydrophobicContact CB-CD1 4.26Å; I52-L70 HydrophobicContact CG1-CD1 3.97Å; I52-L70 HydrophobicContact CG2-CD1 3.95Å; L55-L70 HydrophobicContact CD1-CB 4Å; L55-L70 HydrophobicContact CD1-CD1 4.5Å; I56-L70 HydrophobicContact CD1-CD1 4.42Å; I56-L70 HydrophobicContact CG1-CD1 4.38Å; L61-L70 HydrophobicContact CD1-CD2 3.77Å; L61-L70 HydrophobicContact CD2-CB 4.18Å; L61-L70 HydrophobicContact CD2-CD2 4.03Å; D66-L70 WeakPolarHBondContact O-CB 3.38Å; D66-L70 PolarHBondContact O-N 2.9Å; I67-L70 WeakPolarHBondContact O-CB 3.4Å; I67-L70 PolarHBondContact O-N 3.49Å; Y68-L70 VanDerWaalsContact C-N 3.29Å; Y68-L70 PolarHBondContact O-N 3.35Å; L70-L72 VanDerWaalsContact C-N 3.3Å; L70-L72 PolarHBondContact O-N 3.41Å; L70-A73 PolarHBondContact O-N 3.23Å; L70-I74 HydrophobicContact CD1-CD1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.05Å; L70-I74 WeakPolarHBondContact O-CG1 3.47Å; L70-I74 PolarHBondContact O-N 2.91Å
71N97.5Very high93.2Very high19 Ų1928.2 Ų28.210%0.10214%0.144CC..Hα-helixtrans-65.7-34.1179.7-76-81000112.4I67 Y68 I74 S75 F118 S149 W153I67-N71 PolarHBondContact O-N 2.85Å; I67-N71 PolarHBondContact O-ND2 3.03Å; Y68-N71 PolarHBondContact O-N 3.46Å; N71-I74 PolarHBondContact O-N 3.47Å; N71-S75 WeakPolarHBondContact O-CB 3.42Å; N71-S75 PolarHBondContact O-N 3.37Å; N71-F118 HydrophobicContact CB-CD1 3.76Å; N71-F118 HydrophobicContact CB-CD2 3.79Å; N71-F118 HydrophobicContact CB-CE1 3.44Å; N71-F118 VanDerWaalsContact CB-CE1 3.44Å; N71-F118 HydrophobicContact CB-CE2 3.49Å; N71-F118 VanDerWaalsContact CB-CE2 3.49Å; N71-F118 HydrophobicContact CB-CG 3.96Å; N71-F118 HydrophobicContact CB-CZ 3.32Å; N71-S149 PolarHBondContact ND2-OG 3.36Å; N71-W153 PolarHBondContact OD1-NE1 3.38Å
72L95.4Very high93.5Very high1 Ų126.2 Ų26.21%0.00513%0.134CC..Hα-helixtrans-62.3-43.9172.5-177.458.9000111.6Y68 L70 I74 S75 D76 G115 F118 I119 L122 Y297Y68-L72 WeakPolarHBondContact O-CB 3.2Å; Y68-L72 PolarHBondContact O-N 3.09Å; L70-L72 VanDerWaalsContact C-N 3.3Å; L70-L72 PolarHBondContact O-N 3.41Å; L72-I74 VanDerWaalsContact C-N 3.33Å; L72-I74 PolarHBondContact O-N 3.46Å; L72-S75 VanDerWaalsContact O-CB 3.29Å; L72-S75 WeakPolarHBondContact O-CB 3.43Å; L72-S75 PolarHBondContact O-N 3.43Å; L72-D76 PolarHBondContact O-N 3.39Å; L72-G115 WeakPolarHBondContact CD1-O 3.35Å; L72-F118 HydrophobicContact CB-CB 4.17Å; L72-F118 HydrophobicContact CD1-CB 4.35Å; L72-I119 HydrophobicContact CD1-CD1 4.4Å; L72-I119 HydrophobicContact CD1-CG1 4.02Å; L72-I119 HydrophobicContact CD2-CG1 4.05Å; L72-L122 HydrophobicContact CD2-CD1 3.94Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.23Å
73A96Very high93.8Very high1 Ų118.5 Ų18.51%0.00810%0.1CC..Hα-helixtrans-65.4-35.6174.900000112.6V51 I52 L69 L70 D76 L77V51-A73 HydrophobicContact CB-CB 4.43Å; V51-A73 HydrophobicContact CG1-CB 4.03Å; I52-A73 HydrophobicContact CD1-CB 4.27Å; I52-A73 HydrophobicContact CG1-CB 3.81Å; L69-A73 PolarHBondContact O-N 2.93Å; L69-A73 VanDerWaalsContact O-N 3.1Å; L70-A73 PolarHBondContact O-N 3.23Å; A73-D76 PolarHBondContact O-N 3.28Å; A73-L77 WeakPolarHBondContact O-CG 3.2Å; A73-L77 PolarHBondContact O-N 3.22Å
74I96.8Very high94Very high56 Ų5619.2 Ų19.229%0.28710%0.103SC..Hα-helixtrans-66.2-40.2173.7-67.5167.6000110.8I52 L70 N71 L72 L77 F78 W153I52-I74 HydrophobicContact CD1-CG1 4.02Å; L70-I74 HydrophobicContact CD1-CD1 4.45Å; L70-I74 HydrophobicContact CG-CD1 4.05Å; L70-I74 WeakPolarHBondContact O-CG1 3.47Å; L70-I74 PolarHBondContact O-N 2.91Å; N71-I74 PolarHBondContact O-N 3.47Å; L72-I74 VanDerWaalsContact C-N 3.33Å; L72-I74 PolarHBondContact O-N 3.46Å; I74-L77 CarbonylContact O-C 3.59Å; I74-L77 WeakPolarHBondContact O-CA 3.34Å; I74-L77 WeakPolarHBondContact O-CB 3.5Å; I74-L77 PolarHBondContact O-N 3.37Å; I74-L77 VanDerWaalsContact O-N 3.11Å; I74-F78 HydrophobicContact CG2-CD2 4.1Å; I74-F78 HydrophobicContact CG2-CE2 3.71Å; I74-F78 HydrophobicContact CG2-CZ 4.47Å; I74-F78 WeakPolarHBondContact O-CD2 3.3Å; I74-F78 PolarHBondContact O-N 3.27Å; I74-W153 HydrophobicContact CB-CZ2 4.27Å; I74-W153 HydrophobicContact CG2-CH2 3.99Å; I74-W153 HydrophobicContact CG2-CZ2 3.78Å
75S96.8Very high94.1Very high0 Ų020.8 Ų20.80%011%0.11CC..Hα-helixtrans-57.7-47.6174-179.50000111.9N71 L72 L77 F78 F79 G111 S114 G115N71-S75 WeakPolarHBondContact O-CB 3.42Å; N71-S75 PolarHBondContact O-N 3.37Å; L72-S75 VanDerWaalsContact O-CB 3.29Å; L72-S75 WeakPolarHBondContact O-CB 3.43Å; L72-S75 PolarHBondContact O-N 3.43Å; S75-L77 VanDerWaalsContact C-N 3.25Å; S75-L77 PolarHBondContact O-N 2.98Å; S75-F78 PolarHBondContact O-N 3.18Å; S75-F78 VanDerWaalsContact O-N 3.15Å; S75-F79 PolarHBondContact O-N 3.1Å; S75-G111 PolarHBondContact OG-O 3Å; S75-S114 WeakPolarHBondContact CB-OG 3.44Å; S75-S114 PolarHBondContact OG-OG 3.43Å; S75-G115 VanDerWaalsContact OG-CA 3.27Å; S75-G115 WeakPolarHBondContact OG-CA 3.36Å; S75-G115 PolarHBondContact OG-N 2.64Å
76D95.8Very high94.1Very high9 Ų921.7 Ų21.75%0.04811%0.112CC..Hα-helixtrans-61.4-35.6175.2-68.8-35.1000111.3N48 L72 A73 F79 L80 C290 N293N48-D76 PolarHBondContact OD1-OD2 2.97Å; L72-D76 PolarHBondContact O-N 3.39Å; A73-D76 PolarHBondContact O-N 3.28Å; D76-F79 WeakPolarHBondContact O-CB 3.44Å; D76-F79 PolarHBondContact O-N 3.47Å; D76-L80 WeakPolarHBondContact O-CB 3.48Å; D76-L80 WeakPolarHBondContact O-CD1 3.31Å; D76-L80 VanDerWaalsContact O-CG 3.24Å; D76-L80 WeakPolarHBondContact O-CG 3.45Å; D76-L80 PolarHBondContact O-N 3.44Å; D76-C290 HydrophobicContact CB-CB 4.41Å; D76-N293 PolarHBondContact OD2-ND2 3.47Å
77L95Very high94Very high25 Ų2521.4 Ų21.413%0.13111%0.111CC..Hα-helixtrans-74.3-17.9175.7-73.1177.2000115.1F45 N48 M49 I52 A73 I74 S75 L80 P81F45-L77 HydrophobicContact CD2-CD2 3.89Å; F45-L77 HydrophobicContact CE2-CD2 4.27Å; N48-L77 HydrophobicContact CB-CD2 4.05Å; N48-L77 HydrophobicContact CB-CG 4.01Å; M49-L77 HydrophobicContact CE-CD1 3.54Å; M49-L77 HydrophobicContact CE-CD2 3.92Å; M49-L77 HydrophobicContact CE-CG 4.38Å; M49-L77 HydrophobicContact CG-CD1 4.48Å; M49-L77 HydrophobicContact CG-CD2 4.38Å; M49-L77 HydrophobicContact SD-CD1 3.77Å; I52-L77 HydrophobicContact CD1-CD1 3.35Å; A73-L77 WeakPolarHBondContact O-CG 3.2Å; A73-L77 PolarHBondContact O-N 3.22Å; I74-L77 CarbonylContact O-C 3.59Å; I74-L77 WeakPolarHBondContact O-CA 3.34Å; I74-L77 WeakPolarHBondContact O-CB 3.5Å; I74-L77 PolarHBondContact O-N 3.37Å; I74-L77 VanDerWaalsContact O-N 3.11Å; S75-L77 VanDerWaalsContact C-N 3.25Å; S75-L77 PolarHBondContact O-N 2.98Å; L77-L80 HydrophobicContact CD2-CD1 4.02Å; L77-P81 WeakPolarHBondContact O-CD 3.37Å; L77-P81 VanDerWaalsContact O-CG 3.25Å; L77-P81 WeakPolarHBondContact O-CG 3.39Å
78F92.5Very high93.9Very high78 Ų7824.1 Ų24.134%0.34212%0.123SC..Hα-helixtrans-75.9-33.3166.1-78.7-56.9000111.3I74 S75 L107 W153I74-F78 HydrophobicContact CG2-CD2 4.1Å; I74-F78 HydrophobicContact CG2-CE2 3.71Å; I74-F78 HydrophobicContact CG2-CZ 4.47Å; I74-F78 WeakPolarHBondContact O-CD2 3.3Å; I74-F78 PolarHBondContact O-N 3.27Å; S75-F78 PolarHBondContact O-N 3.18Å; S75-F78 VanDerWaalsContact O-N 3.15Å; F78-L107 HydrophobicContact CB-CD2 4.45Å; F78-L107 HydrophobicContact CD1-CD2 3.68Å; F78-L107 HydrophobicContact CE1-CD2 4.33Å; F78-L107 HydrophobicContact CG-CD2 4.39Å; F78-W153 AromaticContact CD2-CH2 3.45Å; F78-W153 HydrophobicContact CD2-CH2 3.45Å; F78-W153 VanDerWaalsContact CD2-CH2 3.45Å; F78-W153 AromaticContact CD2-CZ3 3.58Å; F78-W153 HydrophobicContact CD2-CZ3 3.58Å; F78-W153 HydrophobicContact CE2-CE3 4.38Å; F78-W153 AromaticContact CE2-CH2 3.4Å; F78-W153 HydrophobicContact CE2-CH2 3.4Å; F78-W153 HydrophobicContact CE2-CZ2 4.21Å; F78-W153 AromaticContact CE2-CZ3 3.48Å; F78-W153 HydrophobicContact CE2-CZ3 3.48Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.48Å
79F89.9Confident93.6Very high7 Ų727 Ų273%0.03114%0.135CC..Hα-helixtrans-73.2-46.1179.5-167.7-89.4000112.3S75 D76 T82 V83 Y108 W248 M287 C290S75-F79 PolarHBondContact O-N 3.1Å; D76-F79 WeakPolarHBondContact O-CB 3.44Å; D76-F79 PolarHBondContact O-N 3.47Å; F79-T82 WeakPolarHBondContact O-CB 3.13Å; F79-T82 PolarHBondContact O-N 2.97Å; F79-T82 PolarHBondContact O-OG1 2.87Å; F79-V83 HydrophobicContact CD1-CG2 4.11Å; F79-V83 HydrophobicContact CE1-CG2 4.12Å; F79-Y108 AromaticContact CD2-CD2 3.91Å; F79-Y108 HydrophobicContact CD2-CD2 3.91Å; F79-Y108 HydrophobicContact CD2-CE2 4.31Å; F79-Y108 AromaticContact CE2-CD2 3.24Å; F79-Y108 HydrophobicContact CE2-CD2 3.24Å; F79-Y108 AromaticContact CE2-CE2 3.23Å; F79-Y108 HydrophobicContact CE2-CE2 3.23Å; F79-Y108 HydrophobicContact CE2-CG 4.16Å; F79-Y108 AromaticContact CZ-CD2 3.77Å; F79-Y108 HydrophobicContact CZ-CD2 3.77Å; F79-Y108 AromaticContact CZ-CE2 3.51Å; F79-Y108 HydrophobicContact CZ-CE2 3.51Å; F79-W248 HydrophobicContact CE2-CH2 4.31Å; F79-W248 HydrophobicContact CE2-CZ2 4.37Å; F79-W248 HydrophobicContact CZ-CH2 4.26Å; F79-W248 HydrophobicContact CZ-CZ2 4.25Å; F79-M287 HydrophobicContact CE1-CB 4.33Å; F79-M287 HydrophobicContact CE1-CG 4.48Å; F79-M287 HydrophobicContact CE1-SD 3.56Å; F79-M287 VanDerWaalsContact CE1-SD 3.56Å; F79-M287 HydrophobicContact CE2-SD 4.32Å; F79-M287 HydrophobicContact CZ-CB 4.44Å; F79-M287 HydrophobicContact CZ-CE 4.47Å; F79-M287 HydrophobicContact CZ-CG 4.21Å; F79-M287 HydrophobicContact CZ-SD 3.27Å; F79-M287 WeakPolarHBondContact CZ-SD 3.43Å; F79-C290 HydrophobicContact CD1-CB 3.91Å; F79-C290 HydrophobicContact CE1-CB 4.41Å
80L94.2Very high93.2Very high0 Ų027.3 Ų27.30%014%0.139CC..G310 helixtrans-57.1-45.4-172.2-79.9160.4000115.2V40 F41 G44 D76 L77 T82 V83 P84 C290V40-L80 HydrophobicContact CG1-CD2 4.42Å; F41-L80 HydrophobicContact CD2-CB 4.37Å; F41-L80 WeakPolarHBondContact CD2-O 3.42Å; G44-L80 WeakPolarHBondContact O-CD1 3.26Å; D76-L80 WeakPolarHBondContact O-CB 3.48Å; D76-L80 WeakPolarHBondContact O-CD1 3.31Å; D76-L80 VanDerWaalsContact O-CG 3.24Å; D76-L80 WeakPolarHBondContact O-CG 3.45Å; D76-L80 PolarHBondContact O-N 3.44Å; L77-L80 HydrophobicContact CD2-CD1 4.02Å; L80-T82 PolarHBondContact O-N 3.21Å; L80-T82 VanDerWaalsContact O-N 3.11Å; L80-V83 VanDerWaalsContact O-CB 3.31Å; L80-V83 WeakPolarHBondContact O-CB 3.39Å; L80-V83 PolarHBondContact O-N 3.09Å; L80-P84 VanDerWaalsContact O-CD 3.32Å; L80-P84 WeakPolarHBondContact O-CD 3.44Å; L80-C290 HydrophobicContact CD2-CB 4.49Å; L80-C290 WeakPolarHBondContact CD2-SG 3.19Å; L80-C290 HydrophobicContact CG-CB 4.4Å
81P93.1Very high92.7Very high52 Ų5228.8 Ų28.834%0.33815%0.154SC..G310 helixtrans-61.7-19.2178.1-24.734.9000114L77 P84 F85L77-P81 WeakPolarHBondContact O-CD 3.37Å; L77-P81 VanDerWaalsContact O-CG 3.25Å; L77-P81 WeakPolarHBondContact O-CG 3.39Å; P81-P84 WeakPolarHBondContact O-CD 3.34Å; P81-F85 VanDerWaalsContact O-CD2 3.23Å; P81-F85 WeakPolarHBondContact O-CD2 3.33Å; P81-F85 WeakPolarHBondContact O-CE2 3.13Å
82T93.7Very high92.2Very high0 Ų030 Ų300%017%0.167CC..G310 helixtrans-77.8-26.617676.80000112.4F79 L80 F85 W86 L104 L107F79-T82 WeakPolarHBondContact O-CB 3.13Å; F79-T82 PolarHBondContact O-N 2.97Å; F79-T82 PolarHBondContact O-OG1 2.87Å; L80-T82 PolarHBondContact O-N 3.21Å; L80-T82 VanDerWaalsContact O-N 3.11Å; T82-F85 WeakPolarHBondContact O-CB 3.44Å; T82-F85 PolarHBondContact O-N 3.2Å; T82-W86 PolarHBondContact O-N 3.45Å; T82-W86 VanDerWaalsContact O-N 3.11Å; T82-W86 PolarHBondContact OG1-NE1 3.4Å; T82-L104 HydrophobicContact CG2-CB 4.45Å; T82-L104 HydrophobicContact CG2-CD2 3.9Å; T82-L107 HydrophobicContact CG2-CB 3.6Å; T82-L107 HydrophobicContact CG2-CD1 4.34Å
83V92.9Very high91.9Very high0 Ų032.4 Ų32.40%018%0.178CC..Hα-helixtrans-59-43.7-174175.40000113.2Y37 F79 L80 F85 W86 A87Y37-V83 VanDerWaalsContact CB-CG1 3.48Å; Y37-V83 HydrophobicContact CD1-CG1 4.34Å; Y37-V83 HydrophobicContact CD2-CG1 4.23Å; Y37-V83 HydrophobicContact CG-CG1 3.79Å; Y37-V83 WeakPolarHBondContact O-CG1 3.25Å; F79-V83 HydrophobicContact CD1-CG2 4.11Å; F79-V83 HydrophobicContact CE1-CG2 4.12Å; L80-V83 VanDerWaalsContact O-CB 3.31Å; L80-V83 WeakPolarHBondContact O-CB 3.39Å; L80-V83 PolarHBondContact O-N 3.09Å; V83-F85 VanDerWaalsContact C-N 3.29Å; V83-F85 PolarHBondContact O-N 3.21Å; V83-W86 PolarHBondContact O-N 3.04Å; V83-A87 WeakPolarHBondContact O-CB 3.47Å; V83-A87 PolarHBondContact O-N 2.78Å
84P92.1Very high91.7Very high52 Ų5232.4 Ų32.434%0.33818%0.178SC..Hα-helixtrans-61-33.4174.5-25.735.5000114.3F41 L80 P81 A87 H88F41-P84 HydrophobicContact CB-CG 4.4Å; F41-P84 HydrophobicContact CD1-CG 4.28Å; F41-P84 HydrophobicContact CD2-CG 3.84Å; F41-P84 HydrophobicContact CE2-CG 4.16Å; F41-P84 HydrophobicContact CG-CG 3.9Å; L80-P84 VanDerWaalsContact O-CD 3.32Å; L80-P84 WeakPolarHBondContact O-CD 3.44Å; P81-P84 WeakPolarHBondContact O-CD 3.34Å; P84-A87 WeakPolarHBondContact O-CB 3.39Å; P84-A87 PolarHBondContact O-N 2.98Å; P84-H88 PolarHBondContact O-N 3.01Å
85F93.4Very high91.5Very high53 Ų5333.9 Ų33.923%0.23219%0.186CC..Hα-helixtrans-72.1-40.4177.3-65.5-94.1000111.1P81 T82 V83 A87 H88 Y89 F96 M100 L104P81-F85 VanDerWaalsContact O-CD2 3.23Å; P81-F85 WeakPolarHBondContact O-CD2 3.33Å; P81-F85 WeakPolarHBondContact O-CE2 3.13Å; T82-F85 WeakPolarHBondContact O-CB 3.44Å; T82-F85 PolarHBondContact O-N 3.2Å; V83-F85 VanDerWaalsContact C-N 3.29Å; V83-F85 PolarHBondContact O-N 3.21Å; F85-A87 VanDerWaalsContact C-N 3.28Å; F85-A87 PolarHBondContact O-N 3.01Å; F85-H88 PolarHBondContact O-N 3.37Å; F85-Y89 WeakPolarHBondContact O-CB 3.48Å; F85-Y89 PolarHBondContact O-N 2.9Å; F85-F96 HydrophobicContact CB-CE2 4.31Å; F85-F96 AromaticContact CD1-CD1 3.81Å; F85-F96 HydrophobicContact CD1-CD1 3.81Å; F85-F96 AromaticContact CD1-CD2 3.8Å; F85-F96 HydrophobicContact CD1-CD2 3.8Å; F85-F96 AromaticContact CD1-CE1 3.67Å; F85-F96 HydrophobicContact CD1-CE1 3.67Å; F85-F96 AromaticContact CD1-CE2 3.67Å; F85-F96 HydrophobicContact CD1-CE2 3.67Å; F85-F96 AromaticContact CD1-CG 3.87Å; F85-F96 HydrophobicContact CD1-CG 3.87Å; F85-F96 AromaticContact CD1-CZ 3.6Å; F85-F96 HydrophobicContact CD1-CZ 3.6Å; F85-F96 AromaticContact CE1-CD1 3.8Å; F85-F96 HydrophobicContact CE1-CD1 3.8Å; F85-F96 AromaticContact CE1-CE1 3.77Å; F85-F96 HydrophobicContact CE1-CE1 3.77Å; F85-F96 HydrophobicContact CE1-CG 4.22Å; F85-F96 HydrophobicContact CE1-CZ 4.17Å; F85-F96 HydrophobicContact CG-CE2 4.46Å; F85-M100 HydrophobicContact CE1-CE 4.26Å; F85-M100 HydrophobicContact CE1-CG 4.41Å; F85-M100 HydrophobicContact CZ-CE 4.38Å; F85-L104 HydrophobicContact CB-CD1 3.5Å; F85-L104 VanDerWaalsContact CB-CD1 3.5Å; F85-L104 HydrophobicContact CD1-CD1 3.61Å; F85-L104 HydrophobicContact CD2-CD1 3.84Å; F85-L104 HydrophobicContact CD2-CD2 3.92Å; F85-L104 HydrophobicContact CE1-CD1 4.26Å; F85-L104 HydrophobicContact CE2-CD1 4.45Å; F85-L104 HydrophobicContact CE2-CD2 4.18Å; F85-L104 HydrophobicContact CG-CD1 3.37Å; F85-L104 HydrophobicContact CG-CD2 4.33Å
86W91.3Very high91.3Very high35 Ų3537.2 Ų37.213%0.13320%0.201CC..Hα-helixtrans-65-33.3172.6-60124.8000112.3Y37 T82 V83 Y89 A90 W94 L104 M287Y37-W86 HydrophobicContact CD2-CB 4.36Å; Y37-W86 HydrophobicContact CE2-CB 4.12Å; T82-W86 PolarHBondContact O-N 3.45Å; T82-W86 VanDerWaalsContact O-N 3.11Å; T82-W86 PolarHBondContact OG1-NE1 3.4Å; V83-W86 PolarHBondContact O-N 3.04Å; W86-Y89 HydrophobicContact CE3-CD1 4.05Å; W86-Y89 HydrophobicContact CZ3-CD1 4.3Å; W86-Y89 PolarHBondContact O-N 3.49Å; W86-A90 WeakPolarHBondContact O-CB 3.29Å; W86-A90 PolarHBondContact O-N 3.01Å; W86-W94 HydrophobicContact CE3-CZ3 4.16Å; W86-W94 HydrophobicContact CH2-CZ3 4.33Å; W86-W94 HydrophobicContact CZ3-CH2 4.47Å; W86-W94 AromaticContact CZ3-CZ3 3.82Å; W86-W94 HydrophobicContact CZ3-CZ3 3.82Å; W86-L104 HydrophobicContact CZ2-CB 4.49Å; W86-M287 HydrophobicContact CG-CE 4.5Å
87A89.6Confident91.2Very high7 Ų738.4 Ų38.46%0.05822%0.215CC..Hα-helixtrans-63.2-47.817300000111.7P34 Y37 V83 P84 F85 A90 A91P34-A87 HydrophobicContact CB-CB 4.46Å; Y37-A87 HydrophobicContact CD2-CB 3.97Å; Y37-A87 HydrophobicContact CG-CB 4.43Å; V83-A87 WeakPolarHBondContact O-CB 3.47Å; V83-A87 PolarHBondContact O-N 2.78Å; P84-A87 WeakPolarHBondContact O-CB 3.39Å; P84-A87 PolarHBondContact O-N 2.98Å; F85-A87 VanDerWaalsContact C-N 3.28Å; F85-A87 PolarHBondContact O-N 3.01Å; A87-A90 PolarHBondContact O-N 3.49Å; A87-A91 PolarHBondContact O-N 2.91Å; A87-A91 VanDerWaalsContact O-N 3.13Å
88H91.2Very high91.1Very high72 Ų7240 Ų4033%0.33322%0.224SC..Hα-helixtrans-62-45174.9-177.678.8000111.6P84 F85 A90 A91 A92 D95 F96P84-H88 PolarHBondContact O-N 3.01Å; F85-H88 PolarHBondContact O-N 3.37Å; H88-A90 VanDerWaalsContact C-N 3.3Å; H88-A90 PolarHBondContact O-N 3.32Å; H88-A91 PolarHBondContact O-N 3.23Å; H88-A91 VanDerWaalsContact O-N 3.1Å; H88-A92 PolarHBondContact O-N 3.47Å; H88-D95 IonicContact CD2-OD2 3.83Å; H88-D95 IonicContact CE1-OD2 3.77Å; H88-D95 IonicContact NE2-OD2 2.84Å; H88-D95 PolarHBondContact NE2-OD2 2.86Å; H88-F96 HydrophobicContact CB-CE2 4.26Å; H88-F96 HydrophobicContact CB-CZ 4.13Å; H88-F96 AromaticContact CD2-CE2 3.61Å; H88-F96 AromaticContact CD2-CZ 3.62Å; H88-F96 AromaticContact CG-CZ 3.94Å
89Y89.9Confident91.1Very high65 Ų6541.8 Ų41.826%0.25524%0.241SC..Hα-helixtrans-58.8-40.8178178.1-122000112.4F85 W86 W94F85-Y89 WeakPolarHBondContact O-CB 3.48Å; F85-Y89 PolarHBondContact O-N 2.9Å; W86-Y89 HydrophobicContact CE3-CD1 4.05Å; W86-Y89 HydrophobicContact CZ3-CD1 4.3Å; W86-Y89 PolarHBondContact O-N 3.49Å; Y89-W94 HydrophobicContact CD2-CB 3.9Å; Y89-W94 AromaticContact CD2-CE3 3.87Å; Y89-W94 HydrophobicContact CD2-CE3 3.87Å; Y89-W94 HydrophobicContact CE2-CB 3.98Å; Y89-W94 AromaticContact CG-CE3 3.97Å; Y89-W94 HydrophobicContact CG-CE3 3.97Å
90A85.7Confident91.4Very high19 Ų1944.3 Ų44.316%0.15725%0.254CS..Hα-helixtrans-66.9-35.3175.700000113.1A30 L33 W86 A87 H88A30-A90 VanDerWaalsContact CA-O 3.32Å; A30-A90 WeakPolarHBondContact CA-O 3.5Å; A30-A90 VanDerWaalsContact CB-O 3.28Å; A30-A90 WeakPolarHBondContact CB-O 3.28Å; L33-A90 HydrophobicContact CB-CB 4.03Å; L33-A90 HydrophobicContact CD1-CB 3.77Å; W86-A90 WeakPolarHBondContact O-CB 3.29Å; W86-A90 PolarHBondContact O-N 3.01Å; A87-A90 PolarHBondContact O-N 3.49Å; H88-A90 VanDerWaalsContact C-N 3.3Å; H88-A90 PolarHBondContact O-N 3.32Å
91A84.7Confident91.4Very high53 Ų5344.3 Ų44.344%0.43825%0.254SS..Hα-helixtrans-76.2-36-179.500000113.1P34 A87 H88P34-A91 HydrophobicContact CG-CB 3.81Å; A87-A91 PolarHBondContact O-N 2.91Å; A87-A91 VanDerWaalsContact O-N 3.13Å; H88-A91 PolarHBondContact O-N 3.23Å; H88-A91 VanDerWaalsContact O-N 3.1Å
92A87Confident91.5Very high44 Ų4444.5 Ų44.536%0.36425%0.25SS..SBendtrans-132.9-106.3-171.900000111.4H88H88-A92 PolarHBondContact O-N 3.47Å
93Q87.9Confident91.5Very high52 Ų5249.3 Ų49.324%0.24328%0.276CS..  trans-148.9178.8-177.869.5-176.34.200110.1D95 H175Q93-D95 WeakPolarHBondContact CG-OD1 3.36Å; Q93-D95 PolarHBondContact NE2-OD1 2.88Å; Q93-D95 PolarHBondContact O-N 3.4Å; Q93-H175 HydrophobicContact CB-CB 4.28Å; Q93-H175 PolarHBondContact OE1-ND1 3.46Å; Q93-H175 VanDerWaalsContact OE1-ND1 3.14Å
94W93Very high91.7Very high2 Ų249.6 Ų49.61%0.00828%0.277CS..  trans-84.597.6177.8-170-93.6000112.4W86 Y89 F96 G97 M100 C101 L104 Y176 C178W86-W94 HydrophobicContact CE3-CZ3 4.16Å; W86-W94 HydrophobicContact CH2-CZ3 4.33Å; W86-W94 HydrophobicContact CZ3-CH2 4.47Å; W86-W94 AromaticContact CZ3-CZ3 3.82Å; W86-W94 HydrophobicContact CZ3-CZ3 3.82Å; Y89-W94 HydrophobicContact CD2-CB 3.9Å; Y89-W94 AromaticContact CD2-CE3 3.87Å; Y89-W94 HydrophobicContact CD2-CE3 3.87Å; Y89-W94 HydrophobicContact CE2-CB 3.98Å; Y89-W94 AromaticContact CG-CE3 3.97Å; Y89-W94 HydrophobicContact CG-CE3 3.97Å; W94-F96 HydrophobicContact CD2-CD2 4.21Å; W94-F96 HydrophobicContact CE3-CD2 4.26Å; W94-F96 HydrophobicContact CH2-CD2 4.21Å; W94-F96 HydrophobicContact CZ2-CB 3.95Å; W94-F96 HydrophobicContact CZ2-CD2 4.07Å; W94-F96 HydrophobicContact CZ2-CG 4.48Å; W94-F96 HydrophobicContact CZ3-CD2 4.28Å; W94-G97 PolarHBondContact NE1-O 3.4Å; W94-M100 HydrophobicContact CZ2-CB 4.45Å; W94-C101 HydrophobicContact CH2-CB 4.47Å; W94-C101 HydrophobicContact CZ2-CB 3.62Å; W94-L104 HydrophobicContact CH2-CD1 3.63Å; W94-L104 HydrophobicContact CZ2-CD1 4.18Å; W94-Y176 WeakPolarHBondContact CB-O 3.39Å; W94-Y176 PolarHBondContact N-O 3.06Å; W94-Y176 WeakPolarHBondContact O-CB 3.24Å; W94-C178 HydrophobicContact CB-CB 4.41Å; W94-C178 HydrophobicContact CD2-CB 3.44Å; W94-C178 VanDerWaalsContact CD2-CB 3.44Å; W94-C178 HydrophobicContact CE3-CB 3.58Å; W94-C178 HydrophobicContact CG-CB 3.79Å; W94-C178 HydrophobicContact CH2-CB 4.35Å; W94-C178 HydrophobicContact CZ2-CB 4.32Å; W94-C178 HydrophobicContact CZ3-CB 4.03Å
95D92.6Very high91.8Very high87 Ų8747.5 Ų47.547%0.46526%0.263SS..  trans-96.3-1.9-177.7-59.6-51000114.2H88 Q93H88-D95 IonicContact CD2-OD2 3.83Å; H88-D95 IonicContact CE1-OD2 3.77Å; H88-D95 IonicContact NE2-OD2 2.84Å; H88-D95 PolarHBondContact NE2-OD2 2.86Å; Q93-D95 WeakPolarHBondContact CG-OD1 3.36Å; Q93-D95 PolarHBondContact NE2-OD1 2.88Å; Q93-D95 PolarHBondContact O-N 3.4Å
96F92.3Very high91.9Very high69 Ų6945.1 Ų45.130%0.30325%0.254SS..SBendtrans-930.6-169.2-50.4-75.2000114.7F85 H88 W94 M100F85-F96 HydrophobicContact CB-CE2 4.31Å; F85-F96 AromaticContact CD1-CD1 3.81Å; F85-F96 HydrophobicContact CD1-CD1 3.81Å; F85-F96 AromaticContact CD1-CD2 3.8Å; F85-F96 HydrophobicContact CD1-CD2 3.8Å; F85-F96 AromaticContact CD1-CE1 3.67Å; F85-F96 HydrophobicContact CD1-CE1 3.67Å; F85-F96 AromaticContact CD1-CE2 3.67Å; F85-F96 HydrophobicContact CD1-CE2 3.67Å; F85-F96 AromaticContact CD1-CG 3.87Å; F85-F96 HydrophobicContact CD1-CG 3.87Å; F85-F96 AromaticContact CD1-CZ 3.6Å; F85-F96 HydrophobicContact CD1-CZ 3.6Å; F85-F96 AromaticContact CE1-CD1 3.8Å; F85-F96 HydrophobicContact CE1-CD1 3.8Å; F85-F96 AromaticContact CE1-CE1 3.77Å; F85-F96 HydrophobicContact CE1-CE1 3.77Å; F85-F96 HydrophobicContact CE1-CG 4.22Å; F85-F96 HydrophobicContact CE1-CZ 4.17Å; F85-F96 HydrophobicContact CG-CE2 4.46Å; H88-F96 HydrophobicContact CB-CE2 4.26Å; H88-F96 HydrophobicContact CB-CZ 4.13Å; H88-F96 AromaticContact CD2-CE2 3.61Å; H88-F96 AromaticContact CD2-CZ 3.62Å; H88-F96 AromaticContact CG-CZ 3.94Å; W94-F96 HydrophobicContact CD2-CD2 4.21Å; W94-F96 HydrophobicContact CE3-CD2 4.26Å; W94-F96 HydrophobicContact CH2-CD2 4.21Å; W94-F96 HydrophobicContact CZ2-CB 3.95Å; W94-F96 HydrophobicContact CZ2-CD2 4.07Å; W94-F96 HydrophobicContact CZ2-CG 4.48Å; W94-F96 HydrophobicContact CZ3-CD2 4.28Å; F96-M100 HydrophobicContact CB-CB 3.73Å; F96-M100 HydrophobicContact CB-CG 3.76Å; F96-M100 HydrophobicContact CG-CG 4.49Å; F96-M100 VanDerWaalsContact O-CB 3.26Å; F96-M100 WeakPolarHBondContact O-CB 3.41Å
97G92.8Very high92.2Very high34 Ų3445.3 Ų45.335%0.35126%0.257SS..Hα-helixtrans73.4176.8-179.700000114.8W94 C101W94-G97 PolarHBondContact NE1-O 3.4Å; G97-C101 PolarHBondContact O-N 3.18Å
98N93.3Very high92.4Very high60 Ų6045.7 Ų45.732%0.32126%0.257SS..Hα-helixtrans-70.1-38.6-172-176.174.6000113.8M100 C101 Q102 R168 S169N98-M100 PolarHBondContact O-N 2.89Å; N98-C101 WeakPolarHBondContact O-CB 3.46Å; N98-C101 PolarHBondContact O-N 3.29Å; N98-Q102 PolarHBondContact ND2-OE1 2.91Å; N98-Q102 PolarHBondContact O-N 3.31Å; N98-R168 VanDerWaalsContact OD1-CA 3.26Å; N98-R168 WeakPolarHBondContact OD1-CA 3.36Å; N98-S169 PolarHBondContact OD1-N 3.06Å
99T93.5Very high92.6Very high114 Ų11443.2 Ų43.270%0.69925%0.246SC*.Hα-helixtrans-62.7-44.7-178.848.70000111.5C101 Q102 L103T99-C101 VanDerWaalsContact C-N 3.34Å; T99-Q102 PolarHBondContact O-N 3.47Å; T99-L103 WeakPolarHBondContact O-CB 3.03Å; T99-L103 PolarHBondContact O-N 3.24Å
100M94.4Very high93Very high61 Ų6141.4 Ų41.430%0.324%0.24SC..Hα-helixtrans-67.7-36176.6-166.764.691.900111.5F85 W94 F96 N98 L103 L104F85-M100 HydrophobicContact CE1-CE 4.26Å; F85-M100 HydrophobicContact CE1-CG 4.41Å; F85-M100 HydrophobicContact CZ-CE 4.38Å; W94-M100 HydrophobicContact CZ2-CB 4.45Å; F96-M100 HydrophobicContact CB-CB 3.73Å; F96-M100 HydrophobicContact CB-CG 3.76Å; F96-M100 HydrophobicContact CG-CG 4.49Å; F96-M100 VanDerWaalsContact O-CB 3.26Å; F96-M100 WeakPolarHBondContact O-CB 3.41Å; N98-M100 PolarHBondContact O-N 2.89Å; M100-L103 PolarHBondContact O-N 3.21Å; M100-L103 HydrophobicContact SD-CD2 4.16Å; M100-L104 HydrophobicContact CG-CD1 3.56Å; M100-L104 HydrophobicContact CG-CG 3.95Å; M100-L104 VanDerWaalsContact O-CB 3.32Å; M100-L104 WeakPolarHBondContact O-CB 3.49Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.37Å; M100-L104 PolarHBondContact O-N 2.99Å; M100-L104 HydrophobicContact SD-CD1 4.12Å; M100-L104 HydrophobicContact SD-CD2 4.37Å; M100-L104 HydrophobicContact SD-CG 4Å
101C94.8Very high93.4Very high0 Ų040.8 Ų40.80%024%0.235CC..Hα-helixtrans-58-50.9175.4172.90000110.8W94 G97 N98 T99 L103 L104 T105 T167 C178W94-C101 HydrophobicContact CH2-CB 4.47Å; W94-C101 HydrophobicContact CZ2-CB 3.62Å; G97-C101 PolarHBondContact O-N 3.18Å; N98-C101 WeakPolarHBondContact O-CB 3.46Å; N98-C101 PolarHBondContact O-N 3.29Å; T99-C101 VanDerWaalsContact C-N 3.34Å; C101-L103 PolarHBondContact O-N 2.65Å; C101-L104 PolarHBondContact O-N 2.82Å; C101-T105 VanDerWaalsContact O-CB 3.31Å; C101-T105 WeakPolarHBondContact O-CB 3.08Å; C101-T105 PolarHBondContact O-N 2.91Å; C101-T105 PolarHBondContact O-OG1 3.48Å; C101-T167 VanDerWaalsContact SG-CG2 3.5Å; C101-C178 VanDerWaalsContact CA-SG 3.57Å; C101-C178 HydrophobicContact CB-CB 3.93Å; C101-C178 WeakPolarHBondContact CB-SG 3.15Å; C101-C178 VanDerWaalsContact SG-CA 3.57Å; C101-C178 WeakPolarHBondContact SG-CB 3.25Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.96Å
102Q94.8Very high93.9Very high55 Ų5538.7 Ų38.726%0.25722%0.216SC..Hα-helixtrans-63-42.6177.7-69.7-179.8-32.900112.9N98 T99 G106 I164 T167N98-Q102 PolarHBondContact ND2-OE1 2.91Å; N98-Q102 PolarHBondContact O-N 3.31Å; T99-Q102 PolarHBondContact O-N 3.47Å; Q102-G106 PolarHBondContact O-N 3.43Å; Q102-I164 HydrophobicContact CB-CG2 4.2Å; Q102-T167 WeakPolarHBondContact CG-O 3.36Å; Q102-T167 PolarHBondContact NE2-O 3.31Å
103L95.3Very high94.4Very high102 Ų10236.6 Ų36.653%0.53420%0.199SC..Hα-helixtrans-63.6-49.4178.9-179.964.1000111.8T99 M100 C101 G106 L107T99-L103 WeakPolarHBondContact O-CB 3.03Å; T99-L103 PolarHBondContact O-N 3.24Å; M100-L103 PolarHBondContact O-N 3.21Å; M100-L103 HydrophobicContact SD-CD2 4.16Å; C101-L103 PolarHBondContact O-N 2.65Å; L103-G106 WeakPolarHBondContact O-CA 3.48Å; L103-G106 PolarHBondContact O-N 3.09Å; L103-G106 VanDerWaalsContact O-N 3.14Å; L103-L107 HydrophobicContact CG-CD1 4.46Å; L103-L107 WeakPolarHBondContact O-CG 3.47Å; L103-L107 PolarHBondContact O-N 2.92Å
104L95.6Very high94.9Very high5 Ų534.1 Ų34.13%0.02619%0.188CC..Hα-helixtrans-68.1-38.4-177.9-67.8175.1000111.8T82 F85 W86 W94 M100 C101 G106 L107 Y108T82-L104 HydrophobicContact CG2-CB 4.45Å; T82-L104 HydrophobicContact CG2-CD2 3.9Å; F85-L104 HydrophobicContact CB-CD1 3.5Å; F85-L104 VanDerWaalsContact CB-CD1 3.5Å; F85-L104 HydrophobicContact CD1-CD1 3.61Å; F85-L104 HydrophobicContact CD2-CD1 3.84Å; F85-L104 HydrophobicContact CD2-CD2 3.92Å; F85-L104 HydrophobicContact CE1-CD1 4.26Å; F85-L104 HydrophobicContact CE2-CD1 4.45Å; F85-L104 HydrophobicContact CE2-CD2 4.18Å; F85-L104 HydrophobicContact CG-CD1 3.37Å; F85-L104 HydrophobicContact CG-CD2 4.33Å; W86-L104 HydrophobicContact CZ2-CB 4.49Å; W94-L104 HydrophobicContact CH2-CD1 3.63Å; W94-L104 HydrophobicContact CZ2-CD1 4.18Å; M100-L104 HydrophobicContact CG-CD1 3.56Å; M100-L104 HydrophobicContact CG-CG 3.95Å; M100-L104 VanDerWaalsContact O-CB 3.32Å; M100-L104 WeakPolarHBondContact O-CB 3.49Å; M100-L104 VanDerWaalsContact O-CG 3.24Å; M100-L104 WeakPolarHBondContact O-CG 3.37Å; M100-L104 PolarHBondContact O-N 2.99Å; M100-L104 HydrophobicContact SD-CD1 4.12Å; M100-L104 HydrophobicContact SD-CD2 4.37Å; M100-L104 HydrophobicContact SD-CG 4Å; C101-L104 PolarHBondContact O-N 2.82Å; L104-G106 VanDerWaalsContact C-N 3.29Å; L104-G106 PolarHBondContact O-N 3.01Å; L104-L107 PolarHBondContact O-N 3.44Å; L104-Y108 VanDerWaalsContact O-CB 3.3Å; L104-Y108 WeakPolarHBondContact O-CB 3.49Å; L104-Y108 PolarHBondContact O-N 3.38Å
105T94.9Very high95Very high8 Ų834.4 Ų34.45%0.04919%0.191CC..Hα-helixtrans-61.8-39.4170.3-63.10000111.6C101 Y108 F109 T167C101-T105 VanDerWaalsContact O-CB 3.31Å; C101-T105 WeakPolarHBondContact O-CB 3.08Å; C101-T105 PolarHBondContact O-N 2.91Å; C101-T105 PolarHBondContact O-OG1 3.48Å; T105-Y108 PolarHBondContact O-N 3Å; T105-F109 HydrophobicContact CG2-CD2 3.61Å; T105-F109 HydrophobicContact CG2-CE2 3.49Å; T105-F109 VanDerWaalsContact CG2-CE2 3.49Å; T105-F109 VanDerWaalsContact O-CD2 3.25Å; T105-F109 WeakPolarHBondContact O-CD2 3.26Å; T105-F109 PolarHBondContact O-N 2.94Å; T105-T167 HydrophobicContact CG2-CG2 4.12Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.45Å
106G95.8Very high95.2Very high4 Ų430.3 Ų30.34%0.04117%0.169CC..Hα-helixtrans-61.8-50.2174.300000112.6Q102 L103 L104 Y108 F109 I110 I164Q102-G106 PolarHBondContact O-N 3.43Å; L103-G106 WeakPolarHBondContact O-CA 3.48Å; L103-G106 PolarHBondContact O-N 3.09Å; L103-G106 VanDerWaalsContact O-N 3.14Å; L104-G106 VanDerWaalsContact C-N 3.29Å; L104-G106 PolarHBondContact O-N 3.01Å; G106-Y108 VanDerWaalsContact C-N 3.31Å; G106-Y108 PolarHBondContact O-N 3.34Å; G106-F109 PolarHBondContact O-N 3.39Å; G106-I110 VanDerWaalsContact O-CB 3.29Å; G106-I110 WeakPolarHBondContact O-CB 3.37Å; G106-I110 WeakPolarHBondContact O-CD1 3.44Å; G106-I110 WeakPolarHBondContact O-CG1 3.16Å; G106-I110 PolarHBondContact O-N 2.99Å; G106-I164 VanDerWaalsContact CA-CG1 3.5Å
107L96.3Very high95.5Very high39 Ų3928 Ų2820%0.20416%0.159CC..Hα-helixtrans-60.2-40.5176.7-70.7179.7000112.4F78 T82 L103 L104 G111F78-L107 HydrophobicContact CB-CD2 4.45Å; F78-L107 HydrophobicContact CD1-CD2 3.68Å; F78-L107 HydrophobicContact CE1-CD2 4.33Å; F78-L107 HydrophobicContact CG-CD2 4.39Å; T82-L107 HydrophobicContact CG2-CB 3.6Å; T82-L107 HydrophobicContact CG2-CD1 4.34Å; L103-L107 HydrophobicContact CG-CD1 4.46Å; L103-L107 WeakPolarHBondContact O-CG 3.47Å; L103-L107 PolarHBondContact O-N 2.92Å; L104-L107 PolarHBondContact O-N 3.44Å; L107-G111 PolarHBondContact O-N 3.41Å
108Y95.1Very high95.7Very high14 Ų1426.4 Ų26.46%0.05514%0.142CC..Hα-helixtrans-58.4-53.8174.6172.9-91.3000111.5F79 L104 T105 G106 G111 F112 M287F79-Y108 AromaticContact CD2-CD2 3.91Å; F79-Y108 HydrophobicContact CD2-CD2 3.91Å; F79-Y108 HydrophobicContact CD2-CE2 4.31Å; F79-Y108 AromaticContact CE2-CD2 3.24Å; F79-Y108 HydrophobicContact CE2-CD2 3.24Å; F79-Y108 AromaticContact CE2-CE2 3.23Å; F79-Y108 HydrophobicContact CE2-CE2 3.23Å; F79-Y108 HydrophobicContact CE2-CG 4.16Å; F79-Y108 AromaticContact CZ-CD2 3.77Å; F79-Y108 HydrophobicContact CZ-CD2 3.77Å; F79-Y108 AromaticContact CZ-CE2 3.51Å; F79-Y108 HydrophobicContact CZ-CE2 3.51Å; L104-Y108 VanDerWaalsContact O-CB 3.3Å; L104-Y108 WeakPolarHBondContact O-CB 3.49Å; L104-Y108 PolarHBondContact O-N 3.38Å; T105-Y108 PolarHBondContact O-N 3Å; G106-Y108 VanDerWaalsContact C-N 3.31Å; G106-Y108 PolarHBondContact O-N 3.34Å; Y108-G111 PolarHBondContact O-N 3.14Å; Y108-F112 WeakPolarHBondContact O-CB 3.35Å; Y108-F112 PolarHBondContact O-N 3.43Å; Y108-M287 HydrophobicContact CD2-CE 3.85Å; Y108-M287 HydrophobicContact CD2-SD 4.24Å; Y108-M287 HydrophobicContact CE2-CE 3.24Å; Y108-M287 HydrophobicContact CE2-SD 3.73Å
109F95.5Very high95.8Very high21 Ų2123.7 Ų23.79%0.09213%0.128CC..Hα-helixtrans-69.6-37.9-178.8-78-60.2000112.8T105 G106 F112 F113 S160 I198T105-F109 HydrophobicContact CG2-CD2 3.61Å; T105-F109 HydrophobicContact CG2-CE2 3.49Å; T105-F109 VanDerWaalsContact CG2-CE2 3.49Å; T105-F109 VanDerWaalsContact O-CD2 3.25Å; T105-F109 WeakPolarHBondContact O-CD2 3.26Å; T105-F109 PolarHBondContact O-N 2.94Å; G106-F109 PolarHBondContact O-N 3.39Å; F109-F112 PolarHBondContact O-N 3.3Å; F109-F113 HydrophobicContact CB-CD2 4.21Å; F109-F113 HydrophobicContact CB-CE2 4.14Å; F109-F113 AromaticContact CD1-CE2 3.85Å; F109-F113 HydrophobicContact CD1-CE2 3.85Å; F109-F113 HydrophobicContact CD1-CZ 4.47Å; F109-F113 HydrophobicContact CG-CE2 4.33Å; F109-F113 WeakPolarHBondContact O-CD2 3.38Å; F109-F113 PolarHBondContact O-N 3.3Å; F109-S160 VanDerWaalsContact C-OG 3.23Å; F109-S160 WeakPolarHBondContact CB-OG 3.29Å; F109-S160 PolarHBondContact O-OG 3.44Å; F109-I198 HydrophobicContact CE1-CD1 4.06Å
110I96.9Very high95.9Very high27 Ų2718.9 Ų18.914%0.13810%0.098CC..Hα-helixtrans-61.4-47.8176.3-71.9166.9000109.3G106 F112 S114 W153 V157 S160G106-I110 VanDerWaalsContact O-CB 3.29Å; G106-I110 WeakPolarHBondContact O-CB 3.37Å; G106-I110 WeakPolarHBondContact O-CD1 3.44Å; G106-I110 WeakPolarHBondContact O-CG1 3.16Å; G106-I110 PolarHBondContact O-N 2.99Å; I110-F112 PolarHBondContact O-N 3.44Å; I110-S114 VanDerWaalsContact O-CB 3.25Å; I110-S114 WeakPolarHBondContact O-CB 3.43Å; I110-S114 PolarHBondContact O-N 2.95Å; I110-S114 PolarHBondContact O-OG 2.94Å; I110-W153 HydrophobicContact CG2-CE3 4.17Å; I110-W153 HydrophobicContact CG2-CZ3 3.7Å; I110-V157 HydrophobicContact CD1-CG2 4.04Å; I110-V157 HydrophobicContact CG1-CG2 4.26Å; I110-S160 WeakPolarHBondContact CA-OG 3.25Å; I110-S160 WeakPolarHBondContact CG1-OG 3.25Å; I110-S160 PolarHBondContact N-OG 2.92Å
111G95.9Very high96Very high5 Ų517.6 Ų17.65%0.0529%0.091CC..Hα-helixtrans-63.4-38175.800000112.9S75 L107 Y108 G115S75-G111 PolarHBondContact OG-O 3Å; L107-G111 PolarHBondContact O-N 3.41Å; Y108-G111 PolarHBondContact O-N 3.14Å; G111-G115 PolarHBondContact O-N 3.22Å; G111-G115 VanDerWaalsContact O-N 3.11Å
112F95Very high95.9Very high10 Ų1017.6 Ų17.64%0.0449%0.092CC..Hα-helixtrans-64.6-54.7175.6174.6-101.4000112.3Y108 F109 I110 G115 I116 I198 W248Y108-F112 WeakPolarHBondContact O-CB 3.35Å; Y108-F112 PolarHBondContact O-N 3.43Å; F109-F112 PolarHBondContact O-N 3.3Å; I110-F112 PolarHBondContact O-N 3.44Å; F112-G115 PolarHBondContact O-N 3.04Å; F112-I116 PolarHBondContact O-N 3.36Å; F112-I198 HydrophobicContact CE1-CG2 4.21Å; F112-I198 HydrophobicContact CZ-CG2 4.28Å; F112-W248 HydrophobicContact CD2-CD2 4.14Å; F112-W248 AromaticContact CD2-CE3 3.99Å; F112-W248 HydrophobicContact CD2-CE3 3.99Å; F112-W248 AromaticContact CD2-CH2 3.61Å; F112-W248 HydrophobicContact CD2-CH2 3.61Å; F112-W248 AromaticContact CD2-CZ2 3.78Å; F112-W248 HydrophobicContact CD2-CZ2 3.78Å; F112-W248 AromaticContact CD2-CZ3 3.73Å; F112-W248 HydrophobicContact CD2-CZ3 3.73Å; F112-W248 AromaticContact CE2-CD2 3.69Å; F112-W248 HydrophobicContact CE2-CD2 3.69Å; F112-W248 AromaticContact CE2-CE3 3.46Å; F112-W248 HydrophobicContact CE2-CE3 3.46Å; F112-W248 VanDerWaalsContact CE2-CE3 3.46Å; F112-W248 HydrophobicContact CE2-CG 4.36Å; F112-W248 AromaticContact CE2-CH2 3.98Å; F112-W248 HydrophobicContact CE2-CH2 3.98Å; F112-W248 HydrophobicContact CE2-CZ2 4.2Å; F112-W248 AromaticContact CE2-CZ3 3.61Å; F112-W248 HydrophobicContact CE2-CZ3 3.61Å; F112-W248 HydrophobicContact CZ-CE3 4.47Å
113F96.8Very high95.9Very high0 Ų015 Ų150%08%0.079CC..Hα-helixtrans-69.8-45.2-176.4-72.8-59.2000112.6F109 G115 I116 F117 A156 A159 K197 I198 L201F109-F113 HydrophobicContact CB-CD2 4.21Å; F109-F113 HydrophobicContact CB-CE2 4.14Å; F109-F113 AromaticContact CD1-CE2 3.85Å; F109-F113 HydrophobicContact CD1-CE2 3.85Å; F109-F113 HydrophobicContact CD1-CZ 4.47Å; F109-F113 HydrophobicContact CG-CE2 4.33Å; F109-F113 WeakPolarHBondContact O-CD2 3.38Å; F109-F113 PolarHBondContact O-N 3.3Å; F113-G115 VanDerWaalsContact C-N 3.27Å; F113-G115 PolarHBondContact O-N 3.32Å; F113-I116 VanDerWaalsContact O-CG2 3.26Å; F113-I116 WeakPolarHBondContact O-CG2 3.44Å; F113-I116 PolarHBondContact O-N 3.47Å; F113-F117 HydrophobicContact CB-CD2 4.45Å; F113-F117 HydrophobicContact CB-CE2 4Å; F113-F117 HydrophobicContact CB-CZ 4.4Å; F113-F117 HydrophobicContact CD1-CZ 4.4Å; F113-F117 WeakPolarHBondContact O-CB 3.34Å; F113-F117 WeakPolarHBondContact O-CD2 3.26Å; F113-F117 WeakPolarHBondContact O-CG 3.47Å; F113-F117 PolarHBondContact O-N 3Å; F113-A156 HydrophobicContact CB-CB 4.17Å; F113-A159 HydrophobicContact CD1-CB 4.38Å; F113-A159 HydrophobicContact CD2-CB 3.83Å; F113-A159 HydrophobicContact CE2-CB 4.14Å; F113-A159 HydrophobicContact CG-CB 3.99Å; F113-K197 HydrophobicContact CZ-CD 4.48Å; F113-I198 HydrophobicContact CZ-CG1 4.22Å; F113-L201 HydrophobicContact CD1-CB 4.27Å; F113-L201 HydrophobicContact CD1-CD1 4.3Å; F113-L201 HydrophobicContact CE1-CB 4.03Å; F113-L201 HydrophobicContact CE1-CD1 4.02Å
114S97.7Very high95.8Very high0 Ų013.1 Ų13.10%07%0.069CC..Hα-helixtrans-63.9-36177.861.40000111.3S75 I110 F117 F118 W153S75-S114 WeakPolarHBondContact CB-OG 3.44Å; S75-S114 PolarHBondContact OG-OG 3.43Å; I110-S114 VanDerWaalsContact O-CB 3.25Å; I110-S114 WeakPolarHBondContact O-CB 3.43Å; I110-S114 PolarHBondContact O-N 2.95Å; I110-S114 PolarHBondContact O-OG 2.94Å; S114-F117 PolarHBondContact O-N 2.95Å; S114-F118 WeakPolarHBondContact O-CD2 3.36Å; S114-F118 PolarHBondContact O-N 3.14Å; S114-W153 WeakPolarHBondContact OG-CZ3 3.39Å
115G96.3Very high95.6Very high7 Ų713.1 Ų13.17%0.0727%0.069CC..Hα-helixtrans-56.8-53.9176.100000112.4L72 S75 G111 F112 F113 F117 F118 I119L72-G115 WeakPolarHBondContact CD1-O 3.35Å; S75-G115 VanDerWaalsContact OG-CA 3.27Å; S75-G115 WeakPolarHBondContact OG-CA 3.36Å; S75-G115 PolarHBondContact OG-N 2.64Å; G111-G115 PolarHBondContact O-N 3.22Å; G111-G115 VanDerWaalsContact O-N 3.11Å; F112-G115 PolarHBondContact O-N 3.04Å; F113-G115 VanDerWaalsContact C-N 3.27Å; F113-G115 PolarHBondContact O-N 3.32Å; G115-F117 PolarHBondContact O-N 3.49Å; G115-F118 PolarHBondContact O-N 3.4Å; G115-I119 WeakPolarHBondContact O-CG1 3.23Å; G115-I119 PolarHBondContact O-N 3.1Å; G115-I119 VanDerWaalsContact O-N 3.09Å
116I96.6Very high95.3Very high1 Ų114.6 Ų14.61%0.0057%0.074CC..Hα-helixtrans-67.4-37.1178.9-171.350.9000112.6F112 F113 F118 I119 I120 P206 Y244F112-I116 PolarHBondContact O-N 3.36Å; F113-I116 VanDerWaalsContact O-CG2 3.26Å; F113-I116 WeakPolarHBondContact O-CG2 3.44Å; F113-I116 PolarHBondContact O-N 3.47Å; I116-F118 PolarHBondContact O-N 2.88Å; I116-I119 HydrophobicContact CD1-CB 4.31Å; I116-I119 HydrophobicContact CD1-CG2 4.38Å; I116-I119 PolarHBondContact O-N 3.28Å; I116-I120 HydrophobicContact CG1-CD1 4.19Å; I116-I120 WeakPolarHBondContact O-CG1 3.37Å; I116-I120 PolarHBondContact O-N 3.33Å; I116-P206 HydrophobicContact CD1-CB 3.56Å; I116-P206 HydrophobicContact CD1-CG 3.82Å; I116-P206 HydrophobicContact CG1-CB 3.99Å; I116-P206 HydrophobicContact CG1-CG 3.85Å; I116-Y244 HydrophobicContact CB-CE2 4.05Å; I116-Y244 HydrophobicContact CD1-CD1 3.68Å; I116-Y244 HydrophobicContact CD1-CD2 4.18Å; I116-Y244 HydrophobicContact CD1-CE1 3.32Å; I116-Y244 HydrophobicContact CD1-CE2 3.84Å; I116-Y244 HydrophobicContact CD1-CG 4.11Å; I116-Y244 HydrophobicContact CG1-CE1 3.98Å; I116-Y244 HydrophobicContact CG1-CE2 4.25Å
117F97.9Very high95Very high22 Ų2216.6 Ų16.610%0.0968%0.081CC..Hα-helixtrans-64.7-39.7176.8-63.9-24.4000112.4F113 S114 G115 I120 L121 T152 V155 A156 L201 L205F113-F117 HydrophobicContact CB-CD2 4.45Å; F113-F117 HydrophobicContact CB-CE2 4Å; F113-F117 HydrophobicContact CB-CZ 4.4Å; F113-F117 HydrophobicContact CD1-CZ 4.4Å; F113-F117 WeakPolarHBondContact O-CB 3.34Å; F113-F117 WeakPolarHBondContact O-CD2 3.26Å; F113-F117 WeakPolarHBondContact O-CG 3.47Å; F113-F117 PolarHBondContact O-N 3Å; S114-F117 PolarHBondContact O-N 2.95Å; G115-F117 PolarHBondContact O-N 3.49Å; F117-I120 HydrophobicContact CD1-CD1 4.35Å; F117-I120 WeakPolarHBondContact O-CB 3.17Å; F117-I120 PolarHBondContact O-N 3.24Å; F117-L121 WeakPolarHBondContact O-CG 3.38Å; F117-L121 PolarHBondContact O-N 2.93Å; F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.15Å; F117-T152 HydrophobicContact CG-CG2 4.31Å; F117-V155 HydrophobicContact CD2-CG1 4.48Å; F117-V155 HydrophobicContact CE2-CG1 3.81Å; F117-V155 HydrophobicContact CZ-CG1 4.32Å; F117-A156 HydrophobicContact CD2-CB 4.34Å; F117-A156 HydrophobicContact CE2-CB 4.44Å; F117-L201 HydrophobicContact CE1-CB 4.37Å; F117-L201 HydrophobicContact CE1-CD2 4.45Å; F117-L201 HydrophobicContact CZ-CD1 4.32Å; F117-L201 HydrophobicContact CZ-CD2 4.48Å; F117-L205 HydrophobicContact CE1-CD2 4.37Å
118F97.2Very high94.7Very high0 Ų016.7 Ų16.70%08%0.081CC..Hα-helixtrans-68.5-33.3174.2-75.4-61.4000112.6Y68 N71 L72 S114 G115 I116 L121 L122 S149 T152 W153Y68-F118 HydrophobicContact CD1-CD1 4.08Å; Y68-F118 HydrophobicContact CD1-CE1 4.22Å; N71-F118 HydrophobicContact CB-CD1 3.76Å; N71-F118 HydrophobicContact CB-CD2 3.79Å; N71-F118 HydrophobicContact CB-CE1 3.44Å; N71-F118 VanDerWaalsContact CB-CE1 3.44Å; N71-F118 HydrophobicContact CB-CE2 3.49Å; N71-F118 VanDerWaalsContact CB-CE2 3.49Å; N71-F118 HydrophobicContact CB-CG 3.96Å; N71-F118 HydrophobicContact CB-CZ 3.32Å; L72-F118 HydrophobicContact CB-CB 4.17Å; L72-F118 HydrophobicContact CD1-CB 4.35Å; S114-F118 WeakPolarHBondContact O-CD2 3.36Å; S114-F118 PolarHBondContact O-N 3.14Å; G115-F118 PolarHBondContact O-N 3.4Å; I116-F118 PolarHBondContact O-N 2.88Å; F118-L121 HydrophobicContact CD1-CD1 4.05Å; F118-L121 HydrophobicContact CE1-CD1 4.19Å; F118-L121 PolarHBondContact O-N 3.42Å; F118-L122 WeakPolarHBondContact O-CB 3.06Å; F118-L122 VanDerWaalsContact O-CG 3.25Å; F118-L122 WeakPolarHBondContact O-CG 3.45Å; F118-L122 PolarHBondContact O-N 3.34Å; F118-S149 WeakPolarHBondContact CE1-OG 3.27Å; F118-T152 HydrophobicContact CD2-CG2 4.43Å; F118-T152 HydrophobicContact CE1-CG2 4.11Å; F118-T152 HydrophobicContact CE2-CG2 3.99Å; F118-T152 HydrophobicContact CZ-CG2 3.8Å; F118-W153 AromaticContact CE2-CE2 3.88Å; F118-W153 HydrophobicContact CE2-CZ2 4.02Å; F118-W153 AromaticContact CE2-NE1 3.89Å; F118-W153 AromaticContact CZ-NE1 3.72Å
119I95.3Very high94.3Very high3 Ų317.3 Ų17.32%0.0159%0.089CC..Hα-helixtrans-64.3-40.8171.5-69.4171.5000111.4L72 G115 I116 L122 T123 I240 M241 Y244L72-I119 HydrophobicContact CD1-CD1 4.4Å; L72-I119 HydrophobicContact CD1-CG1 4.02Å; L72-I119 HydrophobicContact CD2-CG1 4.05Å; G115-I119 WeakPolarHBondContact O-CG1 3.23Å; G115-I119 PolarHBondContact O-N 3.1Å; G115-I119 VanDerWaalsContact O-N 3.09Å; I116-I119 HydrophobicContact CD1-CB 4.31Å; I116-I119 HydrophobicContact CD1-CG2 4.38Å; I116-I119 PolarHBondContact O-N 3.28Å; I119-L122 PolarHBondContact O-N 3.07Å; I119-T123 PolarHBondContact O-N 3.39Å; I119-T123 PolarHBondContact O-OG1 3.46Å; I119-I240 HydrophobicContact CD1-CG2 4.09Å; I119-I240 HydrophobicContact CG1-CG2 4.03Å; I119-M241 HydrophobicContact CG2-CE 3.46Å; I119-M241 VanDerWaalsContact CG2-CE 3.46Å; I119-M241 HydrophobicContact CG2-SD 3.68Å; I119-Y244 HydrophobicContact CD1-CD2 3.95Å; I119-Y244 HydrophobicContact CD1-CG 4.2Å
120I96.4Very high93.7Very high13 Ų1316.9 Ų16.97%0.0679%0.088CC..Hα-helixtrans-62-49.2173.4-73.7164.4000110.4I116 F117 L122 T123 I124 L205 P206 V209I116-I120 HydrophobicContact CG1-CD1 4.19Å; I116-I120 WeakPolarHBondContact O-CG1 3.37Å; I116-I120 PolarHBondContact O-N 3.33Å; F117-I120 HydrophobicContact CD1-CD1 4.35Å; F117-I120 WeakPolarHBondContact O-CB 3.17Å; F117-I120 PolarHBondContact O-N 3.24Å; I120-L122 VanDerWaalsContact C-N 3.32Å; I120-L122 PolarHBondContact O-N 2.96Å; I120-T123 WeakPolarHBondContact O-CA 3.36Å; I120-T123 WeakPolarHBondContact O-CB 3.36Å; I120-T123 PolarHBondContact O-N 3.43Å; I120-I124 HydrophobicContact CG2-CD1 3.77Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.38Å; I120-I124 PolarHBondContact O-N 2.85Å; I120-L205 HydrophobicContact CD1-CD2 3.95Å; I120-L205 HydrophobicContact CD1-CG 3.97Å; I120-P206 HydrophobicContact CD1-CB 4Å; I120-P206 HydrophobicContact CG1-CB 3.98Å; I120-V209 HydrophobicContact CG2-CG1 4.22Å; I120-V209 HydrophobicContact CG2-CG2 4.04Å
121L96.2Very high93.2Very high33 Ų3317.5 Ų17.517%0.1739%0.093CC..Hα-helixtrans-61.8-38.3178.3-73.4176.7000112.5Y68 F117 F118 T123 I124 D125 T152Y68-L121 HydrophobicContact CD1-CD1 4.47Å; Y68-L121 HydrophobicContact CD2-CB 4.01Å; Y68-L121 HydrophobicContact CE1-CB 4.44Å; Y68-L121 HydrophobicContact CE1-CD1 4.01Å; Y68-L121 HydrophobicContact CE2-CB 3.81Å; Y68-L121 HydrophobicContact CG-CB 4.39Å; F117-L121 WeakPolarHBondContact O-CG 3.38Å; F117-L121 PolarHBondContact O-N 2.93Å; F118-L121 HydrophobicContact CD1-CD1 4.05Å; F118-L121 HydrophobicContact CE1-CD1 4.19Å; F118-L121 PolarHBondContact O-N 3.42Å; L121-T123 VanDerWaalsContact C-N 3.33Å; L121-T123 PolarHBondContact O-N 2.83Å; L121-I124 PolarHBondContact O-N 3.13Å; L121-D125 VanDerWaalsContact O-CB 3.23Å; L121-D125 WeakPolarHBondContact O-CB 2.98Å; L121-D125 PolarHBondContact O-N 2.84Å; L121-T152 HydrophobicContact CD1-CG2 4.36Å; L121-T152 VanDerWaalsContact CD1-OG1 3.3Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.25Å
122L93.4Very high92.7Very high1 Ų121.2 Ų21.21%0.00511%0.109CC..Hα-helixtrans-61-42.5172.1-77.8167.7000111.5T65 Y68 L69 L72 F118 I119 I120 D125 R126 I237T65-L122 HydrophobicContact CG2-CD2 3.7Å; Y68-L122 HydrophobicContact CD2-CD2 4.38Å; L69-L122 HydrophobicContact CD2-CD1 3.89Å; L69-L122 HydrophobicContact CD2-CD2 4.22Å; L69-L122 HydrophobicContact CG-CD2 4.11Å; L72-L122 HydrophobicContact CD2-CD1 3.94Å; F118-L122 WeakPolarHBondContact O-CB 3.06Å; F118-L122 VanDerWaalsContact O-CG 3.25Å; F118-L122 WeakPolarHBondContact O-CG 3.45Å; F118-L122 PolarHBondContact O-N 3.34Å; I119-L122 PolarHBondContact O-N 3.07Å; I120-L122 VanDerWaalsContact C-N 3.32Å; I120-L122 PolarHBondContact O-N 2.96Å; L122-D125 PolarHBondContact O-N 2.82Å; L122-R126 WeakPolarHBondContact O-CG 3.21Å; L122-R126 PolarHBondContact O-N 2.85Å; L122-I237 HydrophobicContact CB-CD1 4.31Å; L122-I237 HydrophobicContact CB-CG2 4.3Å; L122-I237 HydrophobicContact CD2-CD1 4.37Å
123T93.1Very high92Very high0 Ų023.4 Ų23.40%013%0.129CC..Hα-helixtrans-63.6-45.7177.1-58.20000111.7I119 I120 L121 R126 Y127 V209 C213 Y214 M241I119-T123 PolarHBondContact O-N 3.39Å; I119-T123 PolarHBondContact O-OG1 3.46Å; I120-T123 WeakPolarHBondContact O-CA 3.36Å; I120-T123 WeakPolarHBondContact O-CB 3.36Å; I120-T123 PolarHBondContact O-N 3.43Å; L121-T123 VanDerWaalsContact C-N 3.33Å; L121-T123 PolarHBondContact O-N 2.83Å; T123-R126 PolarHBondContact O-N 3.01Å; T123-Y127 WeakPolarHBondContact O-CB 3.25Å; T123-Y127 PolarHBondContact O-N 3.46Å; T123-V209 HydrophobicContact CG2-CG1 3.98Å; T123-C213 HydrophobicContact CG2-CB 3.72Å; T123-Y214 HydrophobicContact CG2-CE2 3.88Å; T123-M241 HydrophobicContact CG2-CE 4.34Å; T123-M241 WeakPolarHBondContact OG1-CE 3.29Å
124I93.4Very high91.1Very high63 Ų6329.4 Ų29.432%0.32317%0.165SC..Hα-helixtrans-65.1-44.2177.4-65.1169.1000110.8I120 L121 R126 Y127 L128 V209I120-I124 HydrophobicContact CG2-CD1 3.77Å; I120-I124 HydrophobicContact CG2-CG1 4.47Å; I120-I124 WeakPolarHBondContact O-CG1 3.38Å; I120-I124 PolarHBondContact O-N 2.85Å; L121-I124 PolarHBondContact O-N 3.13Å; I124-R126 VanDerWaalsContact C-N 3.29Å; I124-R126 PolarHBondContact O-N 2.69Å; I124-Y127 WeakPolarHBondContact O-CB 3.41Å; I124-Y127 PolarHBondContact O-N 2.91Å; I124-Y127 VanDerWaalsContact O-N 3.15Å; I124-L128 HydrophobicContact CG2-CD1 4.04Å; I124-L128 HydrophobicContact CG2-CG 4.27Å; I124-L128 WeakPolarHBondContact O-CG 3.23Å; I124-L128 PolarHBondContact O-N 3.25Å; I124-V209 HydrophobicContact CG1-CG1 4.14Å
125D91.1Very high90.3Very high4 Ų435.5 Ų35.52%0.02119%0.192CC..Hα-helixtrans-57.4-41.8175.9168.674.8000111.7T65 Y68 L121 L122 A129 R140T65-D125 PolarHBondContact OG1-OD2 3.29Å; Y68-D125 HydrophobicContact CD2-CB 4.31Å; Y68-D125 HydrophobicContact CE2-CB 4.13Å; L121-D125 VanDerWaalsContact O-CB 3.23Å; L121-D125 WeakPolarHBondContact O-CB 2.98Å; L121-D125 PolarHBondContact O-N 2.84Å; L122-D125 PolarHBondContact O-N 2.82Å; D125-A129 WeakPolarHBondContact O-CB 3.42Å; D125-A129 PolarHBondContact O-N 3.4Å; D125-A129 VanDerWaalsContact O-N 3.15Å; D125-R140 IonicContact OD1-CZ 3.87Å; D125-R140 IonicContact OD1-NE 3.85Å; D125-R140 PolarHBondContact OD1-NE 2.61Å; D125-R140 IonicContact OD1-NH2 2.82Å; D125-R140 PolarHBondContact OD1-NH2 2.79Å; D125-R140 IonicContact OD2-NH2 3.16Å; D125-R140 PolarHBondContact OD2-NH2 3.1Å
126R89.3Confident89.3Confident39 Ų3935.6 Ų35.615%0.14719%0.192CC..Hα-helixtrans-68.5-42.9174.3-69.6-54.685.8-168.44.3112.5T65 L122 T123 I124 A129 V130 I237T65-R126 PolarHBondContact OG1-NH2 3.31Å; L122-R126 WeakPolarHBondContact O-CG 3.21Å; L122-R126 PolarHBondContact O-N 2.85Å; T123-R126 PolarHBondContact O-N 3.01Å; I124-R126 VanDerWaalsContact C-N 3.29Å; I124-R126 PolarHBondContact O-N 2.69Å; R126-A129 PolarHBondContact O-N 2.93Å; R126-V130 WeakPolarHBondContact O-CG2 3.48Å; R126-V130 PolarHBondContact O-N 3.31Å; R126-V130 VanDerWaalsContact O-N 3.09Å; R126-I237 HydrophobicContact CG-CB 4.05Å; R126-I237 HydrophobicContact CG-CG1 3.49Å; R126-I237 VanDerWaalsContact CG-CG1 3.49Å; R126-I237 HydrophobicContact CG-CG2 4.29Å
127Y89.9Confident88.4Confident47 Ų4742.8 Ų42.818%0.18423%0.229CC..Hα-helixtrans-57.1-52177.6173-99.3000111.2T123 I124 A129 V130 V131 H132 C213 I217T123-Y127 WeakPolarHBondContact O-CB 3.25Å; T123-Y127 PolarHBondContact O-N 3.46Å; I124-Y127 WeakPolarHBondContact O-CB 3.41Å; I124-Y127 PolarHBondContact O-N 2.91Å; I124-Y127 VanDerWaalsContact O-N 3.15Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.28Å; Y127-V130 PolarHBondContact O-N 3.32Å; Y127-V130 VanDerWaalsContact O-N 3.14Å; Y127-V131 HydrophobicContact CD2-CB 4.33Å; Y127-V131 HydrophobicContact CD2-CG2 3.72Å; Y127-V131 HydrophobicContact CE2-CB 3.99Å; Y127-V131 HydrophobicContact CE2-CG1 4.2Å; Y127-V131 HydrophobicContact CE2-CG2 3.55Å; Y127-V131 HydrophobicContact CG-CG2 4.49Å; Y127-V131 WeakPolarHBondContact O-CB 3.26Å; Y127-V131 PolarHBondContact O-N 3.11Å; Y127-H132 AromaticContact CE1-CD2 3.59Å; Y127-H132 AromaticContact CE1-NE2 3.69Å; Y127-H132 AromaticContact CZ-NE2 3.85Å; Y127-H132 PolarHBondContact OH-NE2 2.85Å; Y127-C213 VanDerWaalsContact CD2-CA 3.49Å; Y127-C213 HydrophobicContact CD2-CB 3.89Å; Y127-C213 VanDerWaalsContact CD2-O 3.31Å; Y127-C213 WeakPolarHBondContact CD2-O 3.19Å; Y127-C213 HydrophobicContact CG-CB 4.11Å; Y127-I217 HydrophobicContact CD2-CG1 4.16Å
128L89.3Confident87.4Confident41 Ų4150.1 Ų50.122%0.21526%0.261CS..Hα-helixtrans-59.6-43.1178.3-67.9176000111.6I124 V130 H132 F135I124-L128 HydrophobicContact CG2-CD1 4.04Å; I124-L128 HydrophobicContact CG2-CG 4.27Å; I124-L128 WeakPolarHBondContact O-CG 3.23Å; I124-L128 PolarHBondContact O-N 3.25Å; L128-V130 VanDerWaalsContact C-N 3.26Å; L128-V130 PolarHBondContact O-N 2.82Å; L128-H132 HydrophobicContact CD2-CB 4.43Å; L128-H132 CarbonylContact O-C 3.59Å; L128-H132 WeakPolarHBondContact O-CA 3Å; L128-H132 PolarHBondContact O-N 3.43Å; L128-F135 HydrophobicContact CD2-CD1 4.34Å
129A86.6Confident86.5Confident26 Ų2651.2 Ų51.222%0.21527%0.271CS..Hα-helixtrans-62.6-30.5178.600000113.9D125 R126 Y127D125-A129 WeakPolarHBondContact O-CB 3.42Å; D125-A129 PolarHBondContact O-N 3.4Å; D125-A129 VanDerWaalsContact O-N 3.15Å; R126-A129 PolarHBondContact O-N 2.93Å; Y127-A129 VanDerWaalsContact C-N 3.32Å; Y127-A129 PolarHBondContact O-N 3.28Å
130V84.3Confident86.1Confident13 Ų1354.2 Ų54.28%0.07928%0.282CS..Hα-helixtrans-93.8-46.8-176.1173.90000112R126 Y127 L128 I217 T220 R230 V234R126-V130 WeakPolarHBondContact O-CG2 3.48Å; R126-V130 PolarHBondContact O-N 3.31Å; R126-V130 VanDerWaalsContact O-N 3.09Å; Y127-V130 PolarHBondContact O-N 3.32Å; Y127-V130 VanDerWaalsContact O-N 3.14Å; L128-V130 VanDerWaalsContact C-N 3.26Å; L128-V130 PolarHBondContact O-N 2.82Å; V130-I217 HydrophobicContact CB-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG1 4.41Å; V130-I217 HydrophobicContact CG1-CG2 4.32Å; V130-T220 HydrophobicContact CG1-CG2 4.17Å; V130-R230 HydrophobicContact CG2-CG 3.88Å; V130-V234 HydrophobicContact CG2-CG2 4.05Å
131V86.5Confident85.7Confident39 Ų3956.2 Ų56.224%0.23629%0.294CS..Hα-helixtrans-90.8-35.4-171.2-176.40000111.7Y127 I217Y127-V131 HydrophobicContact CD2-CB 4.33Å; Y127-V131 HydrophobicContact CD2-CG2 3.72Å; Y127-V131 HydrophobicContact CE2-CB 3.99Å; Y127-V131 HydrophobicContact CE2-CG1 4.2Å; Y127-V131 HydrophobicContact CE2-CG2 3.55Å; Y127-V131 HydrophobicContact CG-CG2 4.49Å; Y127-V131 WeakPolarHBondContact O-CB 3.26Å; Y127-V131 PolarHBondContact O-N 3.11Å; V131-I217 HydrophobicContact CG2-CG1 4.29Å
132H85.1Confident85.4Confident84 Ų8457.4 Ų57.439%0.38930%0.303SS..  trans-121.451.8-175.5-60.8-71.8000111.9Y127 L128 V134 F135 A136Y127-H132 AromaticContact CE1-CD2 3.59Å; Y127-H132 AromaticContact CE1-NE2 3.69Å; Y127-H132 AromaticContact CZ-NE2 3.85Å; Y127-H132 PolarHBondContact OH-NE2 2.85Å; L128-H132 HydrophobicContact CD2-CB 4.43Å; L128-H132 CarbonylContact O-C 3.59Å; L128-H132 WeakPolarHBondContact O-CA 3Å; L128-H132 PolarHBondContact O-N 3.43Å; H132-V134 VanDerWaalsContact C-N 3.28Å; H132-V134 PolarHBondContact O-N 2.93Å; H132-V134 VanDerWaalsContact O-N 3.14Å; H132-F135 HydrophobicContact CB-CB 4.29Å; H132-F135 PolarHBondContact O-N 3.38Å; H132-F135 VanDerWaalsContact O-N 3.12Å; H132-A136 WeakPolarHBondContact O-CB 3.49Å; H132-A136 PolarHBondContact O-N 3.12Å
133A80.3Confident85.3Confident56 Ų5662.3 Ų62.346%0.46333%0.333SS..Hα-helixtrans-54.4-36.2-171.400000114.9A136 L137A133-A136 WeakPolarHBondContact O-CB 3.16Å; A133-L137 PolarHBondContact O-N 3.44Å
134V78.3Confident85.2Confident126 Ų12667.8 Ų67.876%0.76436%0.357SS*.Hα-helixtrans-69.6-45.4178.9-1790000111.5H132 A136 L137H132-V134 VanDerWaalsContact C-N 3.28Å; H132-V134 PolarHBondContact O-N 2.93Å; H132-V134 VanDerWaalsContact O-N 3.14Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 3.19Å; V134-L137 PolarHBondContact O-N 3.28Å
135F79Confident85.2Confident128 Ų12864.8 Ų64.856%0.56134%0.342SS*.Hα-helixtrans-65.7-38.5175.5178.2-100.7000111.6L128 H132 L137 K138 A139L128-F135 HydrophobicContact CD2-CD1 4.34Å; H132-F135 HydrophobicContact CB-CB 4.29Å; H132-F135 PolarHBondContact O-N 3.38Å; H132-F135 VanDerWaalsContact O-N 3.12Å; F135-L137 PolarHBondContact O-N 3.39Å; F135-K138 PolarHBondContact O-N 3.46Å; F135-K138 VanDerWaalsContact O-N 3.08Å; F135-A139 HydrophobicContact CD1-CB 4.05Å; F135-A139 HydrophobicContact CE1-CB 3.59Å; F135-A139 HydrophobicContact CZ-CB 3.85Å; F135-A139 PolarHBondContact O-N 2.9Å
136A76.9Confident85.4Confident8 Ų868 Ų687%0.06636%0.361CS..Hα-helixtrans-58-32.7178.800000113.4H132 A133 V134 K138 R140H132-A136 WeakPolarHBondContact O-CB 3.49Å; H132-A136 PolarHBondContact O-N 3.12Å; A133-A136 WeakPolarHBondContact O-CB 3.16Å; V134-A136 VanDerWaalsContact C-N 3.32Å; V134-A136 PolarHBondContact O-N 3.19Å; A136-K138 VanDerWaalsContact C-N 3.29Å; A136-K138 PolarHBondContact O-N 3.11Å; A136-R140 HydrophobicContact CB-CG 4.26Å; A136-R140 WeakPolarHBondContact O-CB 3.46Å; A136-R140 VanDerWaalsContact O-CG 3.29Å; A136-R140 WeakPolarHBondContact O-CG 3.5Å; A136-R140 PolarHBondContact O-N 3.09Å; A136-R140 VanDerWaalsContact O-N 3.1Å
137L77.2Confident85.8Confident152 Ų15269.8 Ų69.880%0.79638%0.377SS*.Hα-helixtrans-62.3-35.4176.3-76.5159000112.7A133 V134 F135A133-L137 PolarHBondContact O-N 3.44Å; V134-L137 PolarHBondContact O-N 3.28Å; F135-L137 PolarHBondContact O-N 3.39Å
138K77.6Confident86.1Confident176 Ų17669.4 Ų69.477%0.76538%0.379SS*.Hα-helixtrans-87.9-36.9-179.3-170.4176.3179.9178.80112.6F135 A136F135-K138 PolarHBondContact O-N 3.46Å; F135-K138 VanDerWaalsContact O-N 3.08Å; A136-K138 VanDerWaalsContact C-N 3.29Å; A136-K138 PolarHBondContact O-N 3.11Å
139A77.1Confident86.5Confident24 Ų2467.7 Ų67.720%0.19837%0.37CS..Hα-helixtrans-88.2-24-171.600000114.5F135 T141 F144F135-A139 HydrophobicContact CD1-CB 4.05Å; F135-A139 HydrophobicContact CE1-CB 3.59Å; F135-A139 HydrophobicContact CZ-CB 3.85Å; F135-A139 PolarHBondContact O-N 2.9Å; A139-T141 VanDerWaalsContact C-N 3.31Å; A139-T141 PolarHBondContact O-N 3.44Å; A139-F144 WeakPolarHBondContact O-CD2 3.35Å
140R86.4Confident87Confident66 Ų6670.5 Ų70.525%0.24939%0.385CS..  trans-93.848.6-171.4-59.6174.667-121.6-22.8113.4M64 T65 D125 A136M64-R140 HydrophobicContact SD-CB 3.93Å; M64-R140 HydrophobicContact SD-CG 4.11Å; T65-R140 PolarHBondContact OG1-NH2 2.88Å; D125-R140 IonicContact OD1-CZ 3.87Å; D125-R140 IonicContact OD1-NE 3.85Å; D125-R140 PolarHBondContact OD1-NE 2.61Å; D125-R140 IonicContact OD1-NH2 2.82Å; D125-R140 PolarHBondContact OD1-NH2 2.79Å; D125-R140 IonicContact OD2-NH2 3.16Å; D125-R140 PolarHBondContact OD2-NH2 3.1Å; A136-R140 HydrophobicContact CB-CG 4.26Å; A136-R140 WeakPolarHBondContact O-CB 3.46Å; A136-R140 VanDerWaalsContact O-CG 3.29Å; A136-R140 WeakPolarHBondContact O-CG 3.5Å; A136-R140 PolarHBondContact O-N 3.09Å; A136-R140 VanDerWaalsContact O-N 3.1Å
141T88.3Confident87.7Confident54 Ų5474.6 Ų74.633%0.33141%0.405SS..  trans-84.5157.1175.773.60000111.2A139 T143 F144 G145A139-T141 VanDerWaalsContact C-N 3.31Å; A139-T141 PolarHBondContact O-N 3.44Å; T141-T143 PolarHBondContact O-N 2.82Å; T141-F144 HydrophobicContact CG2-CD2 4.38Å; T141-F144 PolarHBondContact O-N 3.03Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.2Å; T141-F144 PolarHBondContact OG1-N 2.98Å; T141-G145 PolarHBondContact O-N 3.45Å
142V90.1Very high88.2Confident58 Ų5873.5 Ų73.535%0.35240%0.399SS..Hα-helixtrans-60.8-37.7176.2175.50000110.9I67 F144 G145 V146I67-V142 HydrophobicContact CD1-CG1 4.23Å; I67-V142 HydrophobicContact CG1-CG1 4.26Å; V142-F144 PolarHBondContact O-N 3.19Å; V142-G145 CarbonylContact O-C 3.58Å; V142-G145 WeakPolarHBondContact O-CA 3.38Å; V142-G145 PolarHBondContact O-N 2.78Å; V142-G145 VanDerWaalsContact O-N 3.12Å; V142-V146 HydrophobicContact CG1-CG2 4.39Å; V142-V146 WeakPolarHBondContact O-CG2 3.25Å; V142-V146 PolarHBondContact O-N 2.78Å
143T91.6Very high88.8Confident104 Ų10471.8 Ų71.864%0.63839%0.389SS*.Hα-helixtrans-59.2-48.2177.4-46.40000111.9T141 G145 V146 V147T141-T143 PolarHBondContact O-N 2.82Å; T143-G145 VanDerWaalsContact C-N 3.3Å; T143-G145 PolarHBondContact O-N 2.97Å; T143-V146 PolarHBondContact O-N 3.01Å; T143-V147 WeakPolarHBondContact O-CG2 3.32Å; T143-V147 PolarHBondContact O-N 3.43Å
144F92Very high89.7Confident115 Ų11572.4 Ų72.450%0.50439%0.387SS..Hα-helixtrans-63.4-37.8174.7-78.4-63.6000111.8A139 T141 V142 V146 V147 T148A139-F144 WeakPolarHBondContact O-CD2 3.35Å; T141-F144 HydrophobicContact CG2-CD2 4.38Å; T141-F144 PolarHBondContact O-N 3.03Å; T141-F144 WeakPolarHBondContact OG1-CD2 3.2Å; T141-F144 PolarHBondContact OG1-N 2.98Å; V142-F144 PolarHBondContact O-N 3.19Å; F144-V146 PolarHBondContact O-N 3.41Å; F144-V147 PolarHBondContact O-N 3.18Å; F144-T148 WeakPolarHBondContact O-CB 3.35Å; F144-T148 VanDerWaalsContact O-CG2 3.29Å; F144-T148 WeakPolarHBondContact O-CG2 3.2Å; F144-T148 PolarHBondContact O-N 3.28Å; F144-T148 PolarHBondContact O-OG1 3.37Å
145G93.1Very high90.6Very high0 Ų069.6 Ų69.60%037%0.37CS..Hα-helixtrans-56.4-45.9172.200000113.1T141 V142 T143 T148 S149T141-G145 PolarHBondContact O-N 3.45Å; V142-G145 CarbonylContact O-C 3.58Å; V142-G145 WeakPolarHBondContact O-CA 3.38Å; V142-G145 PolarHBondContact O-N 2.78Å; V142-G145 VanDerWaalsContact O-N 3.12Å; T143-G145 VanDerWaalsContact C-N 3.3Å; T143-G145 PolarHBondContact O-N 2.97Å; G145-T148 PolarHBondContact O-OG1 3.38Å; G145-S149 WeakPolarHBondContact O-CB 3.43Å; G145-S149 PolarHBondContact O-N 2.98Å; G145-S149 PolarHBondContact O-OG 3.46Å; G145-S149 VanDerWaalsContact O-OG 3.09Å
146V95.3Very high91.5Very high71 Ų7163.5 Ų63.543%0.4334%0.343SS..Hα-helixtrans-67-48.2178.6173.80000111.4V142 T143 F144 T148 S149 V150V142-V146 HydrophobicContact CG1-CG2 4.39Å; V142-V146 WeakPolarHBondContact O-CG2 3.25Å; V142-V146 PolarHBondContact O-N 2.78Å; T143-V146 PolarHBondContact O-N 3.01Å; F144-V146 PolarHBondContact O-N 3.41Å; V146-T148 PolarHBondContact O-N 2.76Å; V146-S149 WeakPolarHBondContact O-CB 3.47Å; V146-S149 PolarHBondContact O-N 3.24Å; V146-V150 WeakPolarHBondContact O-CG2 3.46Å; V146-V150 PolarHBondContact O-N 2.97Å
147V96.3Very high92.5Very high78 Ų7866 Ų6647%0.47336%0.357SS..Hα-helixtrans-60.3-46.7-179.9172.90000111T143 F144 S149 V150 I151T143-V147 WeakPolarHBondContact O-CG2 3.32Å; T143-V147 PolarHBondContact O-N 3.43Å; F144-V147 PolarHBondContact O-N 3.18Å; V147-S149 VanDerWaalsContact C-N 3.34Å; V147-S149 PolarHBondContact O-N 3.33Å; V147-V150 PolarHBondContact O-N 3.13Å; V147-I151 HydrophobicContact CG1-CD1 4.02Å; V147-I151 WeakPolarHBondContact O-CG1 3.17Å; V147-I151 PolarHBondContact O-N 3.49Å; V147-I151 VanDerWaalsContact O-N 3.08Å
148T96.6Very high93.4Very high39 Ų3965.4 Ų65.424%0.23935%0.348CS..Hα-helixtrans-64.2-37.1177.151.90000112.2Y68 F144 G145 V146 I151 T152Y68-T148 WeakPolarHBondContact CE1-OG1 3.49Å; Y68-T148 PolarHBondContact OH-OG1 3.1Å; F144-T148 WeakPolarHBondContact O-CB 3.35Å; F144-T148 VanDerWaalsContact O-CG2 3.29Å; F144-T148 WeakPolarHBondContact O-CG2 3.2Å; F144-T148 PolarHBondContact O-N 3.28Å; F144-T148 PolarHBondContact O-OG1 3.37Å; G145-T148 PolarHBondContact O-OG1 3.38Å; V146-T148 PolarHBondContact O-N 2.76Å; T148-I151 PolarHBondContact O-N 3.28Å; T148-T152 WeakPolarHBondContact O-CB 3Å; T148-T152 PolarHBondContact O-N 3.16Å; T148-T152 PolarHBondContact O-OG1 3.43Å
149S97.5Very high94.3Very high4 Ų457.7 Ų57.73%0.02832%0.317CS..Hα-helixtrans-62-44.6172.7-72.20000112.6N71 F118 G145 V146 V147 I151 T152 W153N71-S149 PolarHBondContact ND2-OG 3.36Å; F118-S149 WeakPolarHBondContact CE1-OG 3.27Å; G145-S149 WeakPolarHBondContact O-CB 3.43Å; G145-S149 PolarHBondContact O-N 2.98Å; G145-S149 PolarHBondContact O-OG 3.46Å; G145-S149 VanDerWaalsContact O-OG 3.09Å; V146-S149 WeakPolarHBondContact O-CB 3.47Å; V146-S149 PolarHBondContact O-N 3.24Å; V147-S149 VanDerWaalsContact C-N 3.34Å; V147-S149 PolarHBondContact O-N 3.33Å; S149-I151 VanDerWaalsContact C-N 3.34Å; S149-I151 PolarHBondContact O-N 3.13Å; S149-T152 WeakPolarHBondContact O-CB 3.47Å; S149-T152 PolarHBondContact O-N 3.41Å; S149-W153 PolarHBondContact O-N 2.9Å
150V98Very high95.2Very high85 Ų8556.5 Ų56.552%0.51531%0.308SS..Hα-helixtrans-60.4-45.5178.31720000110.9V146 V147 T152 W153 V154V146-V150 WeakPolarHBondContact O-CG2 3.46Å; V146-V150 PolarHBondContact O-N 2.97Å; V147-V150 PolarHBondContact O-N 3.13Å; V150-T152 VanDerWaalsContact C-N 3.32Å; V150-T152 PolarHBondContact O-N 3.08Å; V150-W153 PolarHBondContact O-N 2.95Å; V150-V154 WeakPolarHBondContact O-CG2 3.29Å; V150-V154 PolarHBondContact O-N 2.93Å; V150-V154 VanDerWaalsContact O-N 3.1Å
151I98.1Very high95.5Very high99 Ų9956.6 Ų56.651%0.50831%0.313SS..Hα-helixtrans-59.8-45.4176.1-65.5166.7000110.4V147 T148 S149 W153 V154 V155V147-I151 HydrophobicContact CG1-CD1 4.02Å; V147-I151 WeakPolarHBondContact O-CG1 3.17Å; V147-I151 PolarHBondContact O-N 3.49Å; V147-I151 VanDerWaalsContact O-N 3.08Å; T148-I151 PolarHBondContact O-N 3.28Å; S149-I151 VanDerWaalsContact C-N 3.34Å; S149-I151 PolarHBondContact O-N 3.13Å; I151-W153 VanDerWaalsContact C-N 3.33Å; I151-W153 PolarHBondContact O-N 3.33Å; I151-V154 WeakPolarHBondContact O-CB 3.49Å; I151-V154 PolarHBondContact O-N 3.12Å; I151-V155 HydrophobicContact CG2-CG2 4.3Å; I151-V155 WeakPolarHBondContact O-CG2 3.5Å; I151-V155 PolarHBondContact O-N 3.07Å
152T98.1Very high95.7Very high17 Ų1755.1 Ų55.110%0.10431%0.305CS..Hα-helixtrans-60-40.7178.6-62.70000112.7F117 F118 L121 T148 S149 V150 V155 A156F117-T152 HydrophobicContact CB-CG2 3.5Å; F117-T152 HydrophobicContact CD2-CG2 4.15Å; F117-T152 HydrophobicContact CG-CG2 4.31Å; F118-T152 HydrophobicContact CD2-CG2 4.43Å; F118-T152 HydrophobicContact CE1-CG2 4.11Å; F118-T152 HydrophobicContact CE2-CG2 3.99Å; F118-T152 HydrophobicContact CZ-CG2 3.8Å; L121-T152 HydrophobicContact CD1-CG2 4.36Å; L121-T152 VanDerWaalsContact CD1-OG1 3.3Å; L121-T152 WeakPolarHBondContact CD1-OG1 3.25Å; T148-T152 WeakPolarHBondContact O-CB 3Å; T148-T152 PolarHBondContact O-N 3.16Å; T148-T152 PolarHBondContact O-OG1 3.43Å; S149-T152 WeakPolarHBondContact O-CB 3.47Å; S149-T152 PolarHBondContact O-N 3.41Å; V150-T152 VanDerWaalsContact C-N 3.32Å; V150-T152 PolarHBondContact O-N 3.08Å; T152-V155 PolarHBondContact O-N 3.2Å; T152-A156 WeakPolarHBondContact O-CB 3.29Å; T152-A156 PolarHBondContact O-N 3.19Å
153W98.2Very high95.6Very high47 Ų4752.4 Ų52.418%0.17829%0.288CS..Hα-helixtrans-61.7-45.8174.7-80.7111.4000112N71 I74 F78 I110 S114 F118 S149 V150 I151 V155 A156 V157N71-W153 PolarHBondContact OD1-NE1 3.38Å; I74-W153 HydrophobicContact CB-CZ2 4.27Å; I74-W153 HydrophobicContact CG2-CH2 3.99Å; I74-W153 HydrophobicContact CG2-CZ2 3.78Å; F78-W153 AromaticContact CD2-CH2 3.45Å; F78-W153 HydrophobicContact CD2-CH2 3.45Å; F78-W153 VanDerWaalsContact CD2-CH2 3.45Å; F78-W153 AromaticContact CD2-CZ3 3.58Å; F78-W153 HydrophobicContact CD2-CZ3 3.58Å; F78-W153 HydrophobicContact CE2-CE3 4.38Å; F78-W153 AromaticContact CE2-CH2 3.4Å; F78-W153 HydrophobicContact CE2-CH2 3.4Å; F78-W153 HydrophobicContact CE2-CZ2 4.21Å; F78-W153 AromaticContact CE2-CZ3 3.48Å; F78-W153 HydrophobicContact CE2-CZ3 3.48Å; F78-W153 VanDerWaalsContact CE2-CZ3 3.48Å; I110-W153 HydrophobicContact CG2-CE3 4.17Å; I110-W153 HydrophobicContact CG2-CZ3 3.7Å; S114-W153 WeakPolarHBondContact OG-CZ3 3.39Å; F118-W153 AromaticContact CE2-CE2 3.88Å; F118-W153 HydrophobicContact CE2-CZ2 4.02Å; F118-W153 AromaticContact CE2-NE1 3.89Å; F118-W153 AromaticContact CZ-NE1 3.72Å; S149-W153 PolarHBondContact O-N 2.9Å; V150-W153 PolarHBondContact O-N 2.95Å; I151-W153 VanDerWaalsContact C-N 3.33Å; I151-W153 PolarHBondContact O-N 3.33Å; W153-V155 VanDerWaalsContact C-N 3.34Å; W153-V155 PolarHBondContact O-N 2.67Å; W153-A156 PolarHBondContact O-N 3.2Å; W153-V157 WeakPolarHBondContact O-CG2 3.37Å; W153-V157 PolarHBondContact O-N 2.99Å
154V98.1Very high95.7Very high69 Ų6949.4 Ų49.442%0.41827%0.268SS..Hα-helixtrans-59.1-47.5176.81730000110.4V150 I151 A156 V157 F158V150-V154 WeakPolarHBondContact O-CG2 3.29Å; V150-V154 PolarHBondContact O-N 2.93Å; V150-V154 VanDerWaalsContact O-N 3.1Å; I151-V154 WeakPolarHBondContact O-CB 3.49Å; I151-V154 PolarHBondContact O-N 3.12Å; V154-A156 PolarHBondContact O-N 3.39Å; V154-V157 PolarHBondContact O-N 3.41Å; V154-F158 HydrophobicContact CG1-CD2 3.63Å; V154-F158 HydrophobicContact CG1-CE2 3.49Å; V154-F158 VanDerWaalsContact CG1-CE2 3.49Å; V154-F158 WeakPolarHBondContact O-CD2 3.38Å; V154-F158 PolarHBondContact O-N 2.98Å
155V98Very high95.7Very high68 Ų6848.8 Ų48.841%0.41227%0.269SS..Hα-helixtrans-61.1-41.9177.11750000111.8F117 I151 T152 W153 V157 F158 A159F117-V155 HydrophobicContact CD2-CG1 4.48Å; F117-V155 HydrophobicContact CE2-CG1 3.81Å; F117-V155 HydrophobicContact CZ-CG1 4.32Å; I151-V155 HydrophobicContact CG2-CG2 4.3Å; I151-V155 WeakPolarHBondContact O-CG2 3.5Å; I151-V155 PolarHBondContact O-N 3.07Å; T152-V155 PolarHBondContact O-N 3.2Å; W153-V155 VanDerWaalsContact C-N 3.34Å; W153-V155 PolarHBondContact O-N 2.67Å; V155-V157 PolarHBondContact O-N 3.48Å; V155-F158 PolarHBondContact O-N 3.27Å; V155-A159 WeakPolarHBondContact O-CB 3.34Å; V155-A159 PolarHBondContact O-N 3.32Å
156A97.6Very high95.7Very high0 Ų050 Ų500%027%0.274CS..Hα-helixtrans-63.8-40177.500000112.3F113 F117 T152 W153 V154 A159 S160F113-A156 HydrophobicContact CB-CB 4.17Å; F117-A156 HydrophobicContact CD2-CB 4.34Å; F117-A156 HydrophobicContact CE2-CB 4.44Å; T152-A156 WeakPolarHBondContact O-CB 3.29Å; T152-A156 PolarHBondContact O-N 3.19Å; W153-A156 PolarHBondContact O-N 3.2Å; V154-A156 PolarHBondContact O-N 3.39Å; A156-A159 PolarHBondContact O-N 3.01Å; A156-S160 WeakPolarHBondContact O-CB 3.4Å; A156-S160 PolarHBondContact O-N 2.84Å; A156-S160 VanDerWaalsContact O-N 3.13Å; A156-S160 PolarHBondContact O-OG 3.28Å
157V97.2Very high95.5Very high60 Ų6046.7 Ų46.736%0.36425%0.254SS..Hα-helixtrans-62.3-50.4173.6172.10000110.2I110 W153 V154 V155 A159 S160 L161I110-V157 HydrophobicContact CD1-CG2 4.04Å; I110-V157 HydrophobicContact CG1-CG2 4.26Å; W153-V157 WeakPolarHBondContact O-CG2 3.37Å; W153-V157 PolarHBondContact O-N 2.99Å; V154-V157 PolarHBondContact O-N 3.41Å; V155-V157 PolarHBondContact O-N 3.48Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 3.42Å; V157-S160 WeakPolarHBondContact O-CA 3.49Å; V157-S160 WeakPolarHBondContact O-CB 3.48Å; V157-S160 PolarHBondContact O-N 3.17Å; V157-L161 WeakPolarHBondContact O-CG 3.46Å; V157-L161 PolarHBondContact O-N 3.5Å; V157-L161 VanDerWaalsContact O-N 3.1Å
158F96.8Very high95.3Very high139 Ų13950 Ų5061%0.6126%0.258SS*.Hα-helixtrans-58.8-41.8177.9-83.4-70.2000113V154 V155 S160 L161V154-F158 HydrophobicContact CG1-CD2 3.63Å; V154-F158 HydrophobicContact CG1-CE2 3.49Å; V154-F158 VanDerWaalsContact CG1-CE2 3.49Å; V154-F158 WeakPolarHBondContact O-CD2 3.38Å; V154-F158 PolarHBondContact O-N 2.98Å; V155-F158 PolarHBondContact O-N 3.27Å; F158-S160 PolarHBondContact O-N 2.85Å; F158-L161 HydrophobicContact CD1-CD1 3.65Å; F158-L161 HydrophobicContact CE1-CD1 4.12Å; F158-L161 HydrophobicContact CG-CD1 4.47Å; F158-L161 PolarHBondContact O-N 2.88Å
159A95.6Very high95.1Very high14 Ų1449.3 Ų49.312%0.11626%0.255CS..Hα-helixtrans-63.1-27.4175.900000112.9F113 V155 A156 V157 K197 L201F113-A159 HydrophobicContact CD1-CB 4.38Å; F113-A159 HydrophobicContact CD2-CB 3.83Å; F113-A159 HydrophobicContact CE2-CB 4.14Å; F113-A159 HydrophobicContact CG-CB 3.99Å; V155-A159 WeakPolarHBondContact O-CB 3.34Å; V155-A159 PolarHBondContact O-N 3.32Å; A156-A159 PolarHBondContact O-N 3.01Å; V157-A159 VanDerWaalsContact C-N 3.34Å; V157-A159 PolarHBondContact O-N 3.42Å; A159-K197 PolarHBondContact O-NZ 2.9Å; A159-L201 HydrophobicContact CB-CD1 4.35Å
160S95.4Very high94.7Very high0 Ų052.9 Ų52.90%027%0.271CS..Hα-helixtrans-83.5-27-179.3-55.80000113.1F109 I110 A156 V157 F158 G163 I164F109-S160 VanDerWaalsContact C-OG 3.23Å; F109-S160 WeakPolarHBondContact CB-OG 3.29Å; F109-S160 PolarHBondContact O-OG 3.44Å; I110-S160 WeakPolarHBondContact CA-OG 3.25Å; I110-S160 WeakPolarHBondContact CG1-OG 3.25Å; I110-S160 PolarHBondContact N-OG 2.92Å; A156-S160 WeakPolarHBondContact O-CB 3.4Å; A156-S160 PolarHBondContact O-N 2.84Å; A156-S160 VanDerWaalsContact O-N 3.13Å; A156-S160 PolarHBondContact O-OG 3.28Å; V157-S160 WeakPolarHBondContact O-CA 3.49Å; V157-S160 WeakPolarHBondContact O-CB 3.48Å; V157-S160 PolarHBondContact O-N 3.17Å; F158-S160 PolarHBondContact O-N 2.85Å; S160-G163 WeakPolarHBondContact O-CA 3.23Å; S160-G163 PolarHBondContact O-N 3.36Å; S160-I164 PolarHBondContact O-N 2.98Å
161L94.3Very high94.2Very high67 Ų6755 Ų5535%0.35127%0.274SS..Hα-helixtrans-51.2-47.4-174.3-71.8176.2000114.7V157 F158 G163 I164 I165V157-L161 WeakPolarHBondContact O-CG 3.46Å; V157-L161 PolarHBondContact O-N 3.5Å; V157-L161 VanDerWaalsContact O-N 3.1Å; F158-L161 HydrophobicContact CD1-CD1 3.65Å; F158-L161 HydrophobicContact CE1-CD1 4.12Å; F158-L161 HydrophobicContact CG-CD1 4.47Å; F158-L161 PolarHBondContact O-N 2.88Å; L161-G163 VanDerWaalsContact C-N 3.25Å; L161-G163 PolarHBondContact O-N 3.24Å; L161-I164 PolarHBondContact O-N 3.46Å; L161-I165 VanDerWaalsContact O-CG1 3.32Å; L161-I165 WeakPolarHBondContact O-CG1 3.25Å; L161-I165 PolarHBondContact O-N 3.22Å
162P91.4Very high93.4Very high24 Ų2454.3 Ų54.316%0.15627%0.268CS..Hα-helixtrans-58.9-39.5178.6-23.834.5000112.2I164 I165 F166 F193P162-I164 VanDerWaalsContact C-N 3.31Å; P162-I164 PolarHBondContact O-N 3.28Å; P162-I165 PolarHBondContact O-N 3.15Å; P162-F166 HydrophobicContact CB-CD2 4.42Å; P162-F166 HydrophobicContact CB-CE2 4.3Å; P162-F166 WeakPolarHBondContact O-CD2 3.43Å; P162-F166 PolarHBondContact O-N 3.43Å; P162-F166 VanDerWaalsContact O-N 3.12Å; P162-F193 HydrophobicContact CB-CE1 4.47Å; P162-F193 HydrophobicContact CG-CE1 4.25Å
163G89.4Confident92.6Very high1 Ų156.7 Ų56.71%0.0130%0.296CS..Hα-helixtrans-62.4-38.3176.900000112.5S160 L161 T167S160-G163 WeakPolarHBondContact O-CA 3.23Å; S160-G163 PolarHBondContact O-N 3.36Å; L161-G163 VanDerWaalsContact C-N 3.25Å; L161-G163 PolarHBondContact O-N 3.24Å; G163-T167 WeakPolarHBondContact O-CB 3.45Å; G163-T167 PolarHBondContact O-N 2.97Å; G163-T167 PolarHBondContact O-OG1 3.11Å
164I92.6Very high91.8Very high40 Ų4061.7 Ų61.721%0.20533%0.325CS..Hα-helixtrans-70.1-43.5179.2-58.9170.9000110.8Q102 G106 S160 L161 P162 T167Q102-I164 HydrophobicContact CB-CG2 4.2Å; G106-I164 VanDerWaalsContact CA-CG1 3.5Å; S160-I164 PolarHBondContact O-N 2.98Å; L161-I164 PolarHBondContact O-N 3.46Å; P162-I164 VanDerWaalsContact C-N 3.31Å; P162-I164 PolarHBondContact O-N 3.28Å; I164-T167 PolarHBondContact O-N 2.97Å
165I92.9Very high91.2Very high102 Ų10262.2 Ų62.252%0.52332%0.323SS..Hα-helixtrans-66-42.7-176.5-66.8164.4000111.5L161 P162L161-I165 VanDerWaalsContact O-CG1 3.32Å; L161-I165 WeakPolarHBondContact O-CG1 3.25Å; L161-I165 PolarHBondContact O-N 3.22Å; P162-I165 PolarHBondContact O-N 3.15Å
166F92.1Very high90.8Very high25 Ų2564.3 Ų64.311%0.1133%0.325CS..Hα-helixtrans-83-15.7-177.9-64.4-58.4000113.6P162 H181 F182 P183 W190P162-F166 HydrophobicContact CB-CD2 4.42Å; P162-F166 HydrophobicContact CB-CE2 4.3Å; P162-F166 WeakPolarHBondContact O-CD2 3.43Å; P162-F166 PolarHBondContact O-N 3.43Å; P162-F166 VanDerWaalsContact O-N 3.12Å; F166-H181 PolarHBondContact O-N 2.93Å; F166-F182 HydrophobicContact CB-CD1 3.91Å; F166-F182 HydrophobicContact CB-CE1 3.86Å; F166-F182 HydrophobicContact CD1-CD1 4Å; F166-F182 AromaticContact CD2-CD1 3.89Å; F166-F182 HydrophobicContact CD2-CD1 3.89Å; F166-F182 AromaticContact CD2-CE1 3.82Å; F166-F182 HydrophobicContact CD2-CE1 3.82Å; F166-F182 HydrophobicContact CE2-CD1 4.48Å; F166-F182 AromaticContact CG-CD1 3.65Å; F166-F182 HydrophobicContact CG-CD1 3.65Å; F166-F182 AromaticContact CG-CE1 3.87Å; F166-F182 HydrophobicContact CG-CE1 3.87Å; F166-P183 HydrophobicContact CE1-CG 4.05Å; F166-W190 HydrophobicContact CD2-CE3 4.4Å; F166-W190 HydrophobicContact CE1-CD2 4.33Å; F166-W190 AromaticContact CE2-CD2 3.73Å; F166-W190 HydrophobicContact CE2-CD2 3.73Å; F166-W190 AromaticContact CE2-CE3 3.29Å; F166-W190 HydrophobicContact CE2-CE3 3.29Å; F166-W190 HydrophobicContact CE2-CG 4.4Å; F166-W190 HydrophobicContact CE2-CH2 4.18Å; F166-W190 AromaticContact CE2-CZ3 3.55Å; F166-W190 HydrophobicContact CE2-CZ3 3.55Å; F166-W190 AromaticContact CZ-CD2 3.43Å; F166-W190 HydrophobicContact CZ-CD2 3.43Å; F166-W190 VanDerWaalsContact CZ-CD2 3.43Å; F166-W190 AromaticContact CZ-CE2 3.65Å; F166-W190 AromaticContact CZ-CE3 3.47Å; F166-W190 HydrophobicContact CZ-CE3 3.47Å; F166-W190 VanDerWaalsContact CZ-CE3 3.47Å; F166-W190 HydrophobicContact CZ-CG 4.03Å; F166-W190 AromaticContact CZ-CH2 3.91Å; F166-W190 HydrophobicContact CZ-CH2 3.91Å; F166-W190 AromaticContact CZ-CZ2 3.89Å; F166-W190 HydrophobicContact CZ-CZ2 3.89Å; F166-W190 AromaticContact CZ-CZ3 3.71Å; F166-W190 HydrophobicContact CZ-CZ3 3.71Å
167T92.3Very high90.4Very high3 Ų365.2 Ų65.22%0.01833%0.33CS..EExtended strand (participates in β ladder)trans-85.3127.7179.9-60.50000111C101 Q102 T105 G163 I164 S179 S180C101-T167 VanDerWaalsContact SG-CG2 3.5Å; Q102-T167 WeakPolarHBondContact CG-O 3.36Å; Q102-T167 PolarHBondContact NE2-O 3.31Å; T105-T167 HydrophobicContact CG2-CG2 4.12Å; T105-T167 WeakPolarHBondContact OG1-CG2 3.45Å; G163-T167 WeakPolarHBondContact O-CB 3.45Å; G163-T167 PolarHBondContact O-N 2.97Å; G163-T167 PolarHBondContact O-OG1 3.11Å; I164-T167 PolarHBondContact O-N 2.97Å; T167-S179 WeakPolarHBondContact CA-O 3.47Å; T167-S180 PolarHBondContact OG1-OG 3.44Å; T167-S180 VanDerWaalsContact OG1-OG 3.09Å
168R92.1Very high90.2Very high146 Ų14662.9 Ų62.955%0.55132%0.316SS*.EExtended strand (participates in β ladder)trans-139.8154.9179.8-62.7-170.6179.6-161.4-0.5110.5N98 S179N98-R168 VanDerWaalsContact OD1-CA 3.26Å; N98-R168 WeakPolarHBondContact OD1-CA 3.36Å; R168-S179 PolarHBondContact N-O 3.22Å; R168-S179 PolarHBondContact O-N 3.39Å; R168-S179 VanDerWaalsContact O-N 3.07Å
169S92.1Very high89.8Confident25 Ų2558 Ų5818%0.17530%0.299CS..EExtended strand (participates in β ladder)trans-93.8126.1166.8-175.80000110.2N98 T177N98-S169 PolarHBondContact OD1-N 3.06Å; S169-T177 WeakPolarHBondContact CA-O 3.43Å; S169-T177 PolarHBondContact OG-O 3.3Å; S169-T177 VanDerWaalsContact OG-O 3.1Å
170Q89.1Confident89.5Confident79 Ų7959.7 Ų59.737%0.36931%0.31SS..EExtended strand (participates in β ladder)trans-142.5160.617761.2171.731.500111.2E172 Y176 T177 H181Q170-E172 HydrophobicContact CG-CG 4.16Å; Q170-E172 PolarHBondContact NE2-OE1 3.4Å; Q170-Y176 WeakPolarHBondContact O-CA 3.28Å; Q170-T177 PolarHBondContact N-O 2.99Å; Q170-T177 VanDerWaalsContact N-O 3.16Å; Q170-T177 PolarHBondContact O-N 2.89Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.49Å; Q170-H181 PolarHBondContact NE2-CE1 2.69Å; Q170-H181 PolarHBondContact NE2-NE2 2.84Å
171K87.3Confident89.1Confident131 Ų13162.2 Ų62.257%0.5732%0.322SS*.EExtended strand (participates in β ladder)trans-86.2113.4176.4-170.2179179.5-176.60109.2G173 Y176K171-G173 WeakPolarHBondContact CE-O 3.45Å; K171-Y176 HydrophobicContact CB-CD1 4.1Å; K171-Y176 HydrophobicContact CB-CE1 3.87Å; K171-Y176 HydrophobicContact CG-CE1 4.46Å
172E81.6Confident88.9Confident83 Ų8360.4 Ų60.439%0.38831%0.311SS..EExtended strand (participates in β ladder)trans-110103176.4-72.6176.1169.500109Q170 L174 H175 T177 H181Q170-E172 HydrophobicContact CG-CG 4.16Å; Q170-E172 PolarHBondContact NE2-OE1 3.4Å; E172-L174 PolarHBondContact O-N 3.42Å; E172-H175 PolarHBondContact N-O 2.73Å; E172-H175 PolarHBondContact O-N 3.03Å; E172-T177 HydrophobicContact CB-CG2 4.24Å; E172-T177 WeakPolarHBondContact OE2-CG2 3.27Å; E172-T177 PolarHBondContact OE2-OG1 2.78Å; E172-H181 IonicContact OE1-CE1 2.64Å; E172-H181 PolarHBondContact OE1-CE1 3Å; E172-H181 VanDerWaalsContact OE1-CE1 3.29Å; E172-H181 IonicContact OE1-NE2 3.61Å
173G81.2Confident88.8Confident67 Ų6761.8 Ų61.869%0.69132%0.321SS*.THydrogen-bonded Turntrans65.6-118.5-171.800000111.9K171K171-G173 WeakPolarHBondContact CE-O 3.45Å
174L81.7Confident88.7Confident152 Ų15272.3 Ų72.380%0.79636%0.361SS*.THydrogen-bonded Turntrans-89.2-11.8-178.6-73.5161.3000113.8E172E172-L174 PolarHBondContact O-N 3.42Å
175H84.8Confident88.6Confident81 Ų8175.7 Ų75.738%0.37539%0.389SS..EExtended strand (participates in β ladder)trans-121.7150.5-170-63.6-64.3000112.6Q93 E172Q93-H175 HydrophobicContact CB-CB 4.28Å; Q93-H175 PolarHBondContact OE1-ND1 3.46Å; Q93-H175 VanDerWaalsContact OE1-ND1 3.14Å; E172-H175 PolarHBondContact N-O 2.73Å; E172-H175 PolarHBondContact O-N 3.03Å
176Y89.3Confident88.6Confident112 Ų11275.8 Ų75.844%0.43939%0.387SS..EExtended strand (participates in β ladder)trans-83.2132167-73.4-86.3000110.1W94 Q170 K171W94-Y176 WeakPolarHBondContact CB-O 3.39Å; W94-Y176 PolarHBondContact N-O 3.06Å; W94-Y176 WeakPolarHBondContact O-CB 3.24Å; Q170-Y176 WeakPolarHBondContact O-CA 3.28Å; K171-Y176 HydrophobicContact CB-CD1 4.1Å; K171-Y176 HydrophobicContact CB-CE1 3.87Å; K171-Y176 HydrophobicContact CG-CE1 4.46Å
177T89.9Confident88.4Confident19 Ų1979.8 Ų79.812%0.11740%0.402CS..EExtended strand (participates in β ladder)trans-117.5158.1175.961.40000110.2S169 Q170 E172S169-T177 WeakPolarHBondContact CA-O 3.43Å; S169-T177 PolarHBondContact OG-O 3.3Å; S169-T177 VanDerWaalsContact OG-O 3.1Å; Q170-T177 PolarHBondContact N-O 2.99Å; Q170-T177 VanDerWaalsContact N-O 3.16Å; Q170-T177 PolarHBondContact O-N 2.89Å; E172-T177 HydrophobicContact CB-CG2 4.24Å; E172-T177 WeakPolarHBondContact OE2-CG2 3.27Å; E172-T177 PolarHBondContact OE2-OG1 2.78Å
178C92.5Very high88.3Confident11 Ų1183.9 Ų83.97%0.07442%0.421CS..EExtended strand (participates in β ladder)trans-119.5102.3169.3172.60000106.5W94 C101W94-C178 HydrophobicContact CB-CB 4.41Å; W94-C178 HydrophobicContact CD2-CB 3.44Å; W94-C178 VanDerWaalsContact CD2-CB 3.44Å; W94-C178 HydrophobicContact CE3-CB 3.58Å; W94-C178 HydrophobicContact CG-CB 3.79Å; W94-C178 HydrophobicContact CH2-CB 4.35Å; W94-C178 HydrophobicContact CZ2-CB 4.32Å; W94-C178 HydrophobicContact CZ3-CB 4.03Å; C101-C178 VanDerWaalsContact CA-SG 3.57Å; C101-C178 HydrophobicContact CB-CB 3.93Å; C101-C178 WeakPolarHBondContact CB-SG 3.15Å; C101-C178 VanDerWaalsContact SG-CA 3.57Å; C101-C178 WeakPolarHBondContact SG-CB 3.25Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 2.96Å
179S88.8Confident88.3Confident35 Ų3582.8 Ų82.825%0.24542%0.42CS..EExtended strand (participates in β ladder)trans-144162.1-170.399.50000112.2T167 R168 H181T167-S179 WeakPolarHBondContact CA-O 3.47Å; R168-S179 PolarHBondContact N-O 3.22Å; R168-S179 PolarHBondContact O-N 3.39Å; R168-S179 VanDerWaalsContact O-N 3.07Å; S179-H181 PolarHBondContact O-CD2 3.29Å; S179-H181 VanDerWaalsContact O-CD2 3.24Å; S179-H181 PolarHBondContact OG-CE1 2.96Å; S179-H181 PolarHBondContact OG-NE2 3.49Å
180S88.4Confident88.4Confident51 Ų5184.5 Ų84.536%0.35742%0.423SS..EExtended strand (participates in β ladder)trans-83.4119.7179.6-64.30000110.9T167T167-S180 PolarHBondContact OG1-OG 3.44Å; T167-S180 VanDerWaalsContact OG1-OG 3.09Å
181H88.4Confident88.5Confident52 Ų5282.7 Ų82.724%0.24141%0.414CS..  trans-111.2110.9177.3-64.2-71.3000110.3F166 Q170 E172 S179F166-H181 PolarHBondContact O-N 2.93Å; Q170-H181 WeakPolarHBondContact CG-NE2 3.49Å; Q170-H181 PolarHBondContact NE2-CE1 2.69Å; Q170-H181 PolarHBondContact NE2-NE2 2.84Å; E172-H181 IonicContact OE1-CE1 2.64Å; E172-H181 PolarHBondContact OE1-CE1 3Å; E172-H181 VanDerWaalsContact OE1-CE1 3.29Å; E172-H181 IonicContact OE1-NE2 3.61Å; S179-H181 PolarHBondContact O-CD2 3.29Å; S179-H181 VanDerWaalsContact O-CD2 3.24Å; S179-H181 PolarHBondContact OG-CE1 2.96Å; S179-H181 PolarHBondContact OG-NE2 3.49Å
182F89.9Confident88.8Confident29 Ų2978.3 Ų78.313%0.12740%0.397CS..  trans-91.3148.4176.2-55-60.5000111.3F166 Y184 Y187 W190 K191 Q194F166-F182 HydrophobicContact CB-CD1 3.91Å; F166-F182 HydrophobicContact CB-CE1 3.86Å; F166-F182 HydrophobicContact CD1-CD1 4Å; F166-F182 AromaticContact CD2-CD1 3.89Å; F166-F182 HydrophobicContact CD2-CD1 3.89Å; F166-F182 AromaticContact CD2-CE1 3.82Å; F166-F182 HydrophobicContact CD2-CE1 3.82Å; F166-F182 HydrophobicContact CE2-CD1 4.48Å; F166-F182 AromaticContact CG-CD1 3.65Å; F166-F182 HydrophobicContact CG-CD1 3.65Å; F166-F182 AromaticContact CG-CE1 3.87Å; F166-F182 HydrophobicContact CG-CE1 3.87Å; F182-Y184 PolarHBondContact O-N 3.43Å; F182-Y187 HydrophobicContact CB-CD2 3.91Å; F182-Y187 HydrophobicContact CB-CE2 4.41Å; F182-Y187 HydrophobicContact CD2-CD2 4.35Å; F182-Y187 HydrophobicContact CD2-CE2 4.11Å; F182-W190 HydrophobicContact CB-CB 3.96Å; F182-W190 HydrophobicContact CD1-CB 3.55Å; F182-W190 HydrophobicContact CD1-CG 4.46Å; F182-W190 HydrophobicContact CE1-CB 4.22Å; F182-W190 HydrophobicContact CG-CB 3.81Å; F182-K191 HydrophobicContact CD2-CB 4.2Å; F182-K191 HydrophobicContact CE2-CB 4.17Å; F182-K191 HydrophobicContact CE2-CG 4.44Å; F182-Q194 HydrophobicContact CZ-CB 4.18Å; F182-Q194 HydrophobicContact CZ-CG 4.39Å
183P88.8Confident89.4Confident54 Ų5478.6 Ų78.635%0.35140%0.397SS..  trans-58.8130.5176.2-21.531.6000111.7F166 S185 Q186 Y187F166-P183 HydrophobicContact CE1-CG 4.05Å; P183-S185 VanDerWaalsContact C-N 3.26Å; P183-S185 PolarHBondContact O-N 3.24Å; P183-Q186 CarbonylContact O-C 3.5Å; P183-Q186 PolarHBondContact O-N 3.11Å; P183-Y187 WeakPolarHBondContact O-CA 3.47Å; P183-Y187 PolarHBondContact O-N 3.01Å
184Y87.6Confident90Very high221 Ų22176 Ų7687%0.86737%0.367SS*.G310 helixtrans-56-37.4-177.3-66.9-74.6000113.6F182 Q186F182-Y184 PolarHBondContact O-N 3.43Å; Y184-Q186 PolarHBondContact O-N 3.49Å
185S90.8Very high90.5Very high112 Ų11269.1 Ų69.178%0.78333%0.331SS*.G310 helixtrans-63.1-24.2179.455.80000114P183P183-S185 VanDerWaalsContact C-N 3.26Å; P183-S185 PolarHBondContact O-N 3.24Å
186Q91.5Very high91.1Very high103 Ų10368.8 Ų68.848%0.48133%0.332SS..G310 helixtrans-134.828.2-176-66.6-177.4-19.400111.6P183 Y184 Q188 F189 W190P183-Q186 CarbonylContact O-C 3.5Å; P183-Q186 PolarHBondContact O-N 3.11Å; Y184-Q186 PolarHBondContact O-N 3.49Å; Q186-Q188 PolarHBondContact O-N 2.81Å; Q186-F189 HydrophobicContact CB-CB 4.41Å; Q186-F189 WeakPolarHBondContact O-CB 3.35Å; Q186-F189 PolarHBondContact O-N 3.16Å; Q186-F189 VanDerWaalsContact O-N 3.14Å; Q186-W190 VanDerWaalsContact O-CD1 3.32Å; Q186-W190 PolarHBondContact O-N 3.46Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.12Å
187Y89.4Confident91.4Very high110 Ų11064.5 Ų64.543%0.43132%0.315SS..Hα-helixtrans-55.6-50.8-170.8176.7-97.9000112.1F182 P183 F189 W190 K191F182-Y187 HydrophobicContact CB-CD2 3.91Å; F182-Y187 HydrophobicContact CB-CE2 4.41Å; F182-Y187 HydrophobicContact CD2-CD2 4.35Å; F182-Y187 HydrophobicContact CD2-CE2 4.11Å; P183-Y187 WeakPolarHBondContact O-CA 3.47Å; P183-Y187 PolarHBondContact O-N 3.01Å; Y187-F189 VanDerWaalsContact C-N 3.32Å; Y187-F189 PolarHBondContact O-N 2.82Å; Y187-W190 PolarHBondContact O-N 3.17Å; Y187-K191 HydrophobicContact CE1-CD 4.07Å; Y187-K191 VanDerWaalsContact O-CB 3.29Å; Y187-K191 WeakPolarHBondContact O-CB 3.16Å; Y187-K191 PolarHBondContact O-N 2.99Å
188Q89.5Confident91.7Very high88 Ų8864 Ų6441%0.41131%0.312SS..Hα-helixtrans-64.6-37.2-179-167.763.236.800112.4Q186 N192Q186-Q188 PolarHBondContact O-N 2.81Å; Q188-N192 PolarHBondContact NE2-OD1 3.08Å; Q188-N192 VanDerWaalsContact O-CB 3.23Å; Q188-N192 WeakPolarHBondContact O-CB 3.24Å; Q188-N192 PolarHBondContact O-N 3.36Å; Q188-N192 PolarHBondContact O-ND2 3.4Å; Q188-N192 PolarHBondContact O-OD1 2.94Å
189F92.7Very high91.8Very high123 Ų12364.1 Ų64.154%0.53931%0.312SS..Hα-helixtrans-62.8-51.4178.6175.2-93.7000111Q186 Y187 N192 F193Q186-F189 HydrophobicContact CB-CB 4.41Å; Q186-F189 WeakPolarHBondContact O-CB 3.35Å; Q186-F189 PolarHBondContact O-N 3.16Å; Q186-F189 VanDerWaalsContact O-N 3.14Å; Y187-F189 VanDerWaalsContact C-N 3.32Å; Y187-F189 PolarHBondContact O-N 2.82Å; F189-N192 PolarHBondContact O-N 3.45Å; F189-F193 VanDerWaalsContact O-CB 3.26Å; F189-F193 WeakPolarHBondContact O-CB 3.35Å; F189-F193 PolarHBondContact O-N 3.04Å
190W92.9Very high92.2Very high61 Ų6166.6 Ų66.623%0.23132%0.322CS..Hα-helixtrans-69-37.9-178.8-73.6108.4000112.8F166 F182 Q186 Y187 F193 Q194F166-W190 HydrophobicContact CD2-CE3 4.4Å; F166-W190 HydrophobicContact CE1-CD2 4.33Å; F166-W190 AromaticContact CE2-CD2 3.73Å; F166-W190 HydrophobicContact CE2-CD2 3.73Å; F166-W190 AromaticContact CE2-CE3 3.29Å; F166-W190 HydrophobicContact CE2-CE3 3.29Å; F166-W190 HydrophobicContact CE2-CG 4.4Å; F166-W190 HydrophobicContact CE2-CH2 4.18Å; F166-W190 AromaticContact CE2-CZ3 3.55Å; F166-W190 HydrophobicContact CE2-CZ3 3.55Å; F166-W190 AromaticContact CZ-CD2 3.43Å; F166-W190 HydrophobicContact CZ-CD2 3.43Å; F166-W190 VanDerWaalsContact CZ-CD2 3.43Å; F166-W190 AromaticContact CZ-CE2 3.65Å; F166-W190 AromaticContact CZ-CE3 3.47Å; F166-W190 HydrophobicContact CZ-CE3 3.47Å; F166-W190 VanDerWaalsContact CZ-CE3 3.47Å; F166-W190 HydrophobicContact CZ-CG 4.03Å; F166-W190 AromaticContact CZ-CH2 3.91Å; F166-W190 HydrophobicContact CZ-CH2 3.91Å; F166-W190 AromaticContact CZ-CZ2 3.89Å; F166-W190 HydrophobicContact CZ-CZ2 3.89Å; F166-W190 AromaticContact CZ-CZ3 3.71Å; F166-W190 HydrophobicContact CZ-CZ3 3.71Å; F182-W190 HydrophobicContact CB-CB 3.96Å; F182-W190 HydrophobicContact CD1-CB 3.55Å; F182-W190 HydrophobicContact CD1-CG 4.46Å; F182-W190 HydrophobicContact CE1-CB 4.22Å; F182-W190 HydrophobicContact CG-CB 3.81Å; Q186-W190 VanDerWaalsContact O-CD1 3.32Å; Q186-W190 PolarHBondContact O-N 3.46Å; Q186-W190 VanDerWaalsContact OE1-NE1 3.12Å; Y187-W190 PolarHBondContact O-N 3.17Å; W190-F193 HydrophobicContact CE3-CD1 4.09Å; W190-F193 HydrophobicContact CZ3-CD1 4.1Å; W190-F193 HydrophobicContact CZ3-CE1 4.34Å; W190-F193 PolarHBondContact O-N 2.81Å; W190-Q194 WeakPolarHBondContact O-CB 3.49Å; W190-Q194 PolarHBondContact O-N 3.26Å
191K91Very high92.6Very high41 Ų4166.1 Ų66.118%0.17832%0.315CS..Hα-helixtrans-59-50.5172.6-170.3-173.7178.3-168.70110.7F182 Y187 Q194 T195 T259F182-K191 HydrophobicContact CD2-CB 4.2Å; F182-K191 HydrophobicContact CE2-CB 4.17Å; F182-K191 HydrophobicContact CE2-CG 4.44Å; Y187-K191 HydrophobicContact CE1-CD 4.07Å; Y187-K191 VanDerWaalsContact O-CB 3.29Å; Y187-K191 WeakPolarHBondContact O-CB 3.16Å; Y187-K191 PolarHBondContact O-N 2.99Å; K191-Q194 PolarHBondContact O-N 3.21Å; K191-T195 PolarHBondContact O-N 3.26Å; K191-T195 VanDerWaalsContact O-N 3.11Å; K191-T195 PolarHBondContact O-OG1 2.99Å; K191-T259 HydrophobicContact CD-CG2 4.47Å; K191-T259 HydrophobicContact CG-CG2 4.2Å
192N93.4Very high92.9Very high39 Ų3963.7 Ų63.721%0.20930%0.304CS..Hα-helixtrans-62.7-45.7177.8-71.6-7.1000111.8Q188 F189 Q194 T195 L196Q188-N192 PolarHBondContact NE2-OD1 3.08Å; Q188-N192 VanDerWaalsContact O-CB 3.23Å; Q188-N192 WeakPolarHBondContact O-CB 3.24Å; Q188-N192 PolarHBondContact O-N 3.36Å; Q188-N192 PolarHBondContact O-ND2 3.4Å; Q188-N192 PolarHBondContact O-OD1 2.94Å; F189-N192 PolarHBondContact O-N 3.45Å; N192-Q194 PolarHBondContact O-N 3.1Å; N192-T195 PolarHBondContact O-N 3.26Å; N192-L196 VanDerWaalsContact O-CB 3.31Å; N192-L196 WeakPolarHBondContact O-CB 3.42Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.26Å; N192-L196 PolarHBondContact O-N 3.24Å
193F94.8Very high93.1Very high90 Ų9063.8 Ų63.840%0.39531%0.305SS..Hα-helixtrans-58.6-47.2179.3176.6-97.8000111.5P162 F189 W190 K197P162-F193 HydrophobicContact CB-CE1 4.47Å; P162-F193 HydrophobicContact CG-CE1 4.25Å; F189-F193 VanDerWaalsContact O-CB 3.26Å; F189-F193 WeakPolarHBondContact O-CB 3.35Å; F189-F193 PolarHBondContact O-N 3.04Å; W190-F193 HydrophobicContact CE3-CD1 4.09Å; W190-F193 HydrophobicContact CZ3-CD1 4.1Å; W190-F193 HydrophobicContact CZ3-CE1 4.34Å; W190-F193 PolarHBondContact O-N 2.81Å; F193-K197 WeakPolarHBondContact O-CB 3.41Å; F193-K197 PolarHBondContact O-N 3.28Å
194Q93.3Very high93.5Very high13 Ų1364.9 Ų64.96%0.06131%0.311CS..Hα-helixtrans-64.1-44.7-179.6-173.570.5-10.600111.6F182 W190 K191 N192 I198F182-Q194 HydrophobicContact CZ-CB 4.18Å; F182-Q194 HydrophobicContact CZ-CG 4.39Å; W190-Q194 WeakPolarHBondContact O-CB 3.49Å; W190-Q194 PolarHBondContact O-N 3.26Å; K191-Q194 PolarHBondContact O-N 3.21Å; N192-Q194 PolarHBondContact O-N 3.1Å; Q194-I198 HydrophobicContact CG-CD1 4.22Å; Q194-I198 WeakPolarHBondContact O-CG1 3.32Å; Q194-I198 PolarHBondContact O-N 3.33Å; Q194-I198 VanDerWaalsContact O-N 3.12Å
195T94Very high93.9Very high7 Ų757.2 Ų57.24%0.04329%0.285CS..Hα-helixtrans-63.8-50.6177.2-66.40000111.9K191 N192 K197 I198 V199 L255 L256 T259K191-T195 PolarHBondContact O-N 3.26Å; K191-T195 VanDerWaalsContact O-N 3.11Å; K191-T195 PolarHBondContact O-OG1 2.99Å; N192-T195 PolarHBondContact O-N 3.26Å; T195-K197 VanDerWaalsContact C-N 3.29Å; T195-K197 PolarHBondContact O-N 3.22Å; T195-I198 PolarHBondContact O-N 2.91Å; T195-V199 HydrophobicContact CG2-CG2 4.3Å; T195-V199 WeakPolarHBondContact O-CG2 3.19Å; T195-V199 PolarHBondContact O-N 2.87Å; T195-L255 HydrophobicContact CG2-CD2 4.41Å; T195-L255 HydrophobicContact CG2-CG 4.06Å; T195-L256 HydrophobicContact CG2-CD1 4.34Å; T195-T259 WeakPolarHBondContact CB-OG1 3.5Å; T195-T259 HydrophobicContact CG2-CG2 4.14Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.4Å; T195-T259 PolarHBondContact OG1-OG1 3.29Å
196L95.9Very high94Very high73 Ų7351.9 Ų51.938%0.38225%0.248SC..Hα-helixtrans-61.5-39.8-180-71175000111.2N192 I198 V199 I200 F260N192-L196 VanDerWaalsContact O-CB 3.31Å; N192-L196 WeakPolarHBondContact O-CB 3.42Å; N192-L196 VanDerWaalsContact O-CG 3.26Å; N192-L196 WeakPolarHBondContact O-CG 3.26Å; N192-L196 PolarHBondContact O-N 3.24Å; L196-I198 PolarHBondContact O-N 3.13Å; L196-V199 PolarHBondContact O-N 3.46Å; L196-I200 HydrophobicContact CB-CD1 4.23Å; L196-I200 WeakPolarHBondContact O-CB 3.47Å; L196-I200 WeakPolarHBondContact O-CD1 3.45Å; L196-I200 WeakPolarHBondContact O-CG1 3.48Å; L196-I200 PolarHBondContact O-N 3.39Å; L196-F260 HydrophobicContact CD2-CE2 4.41Å; L196-F260 HydrophobicContact CD2-CZ 4.45Å
197K96.1Very high94.2Very high22 Ų2251 Ų5110%0.09625%0.245CC..Hα-helixtrans-57.8-49.5174.6-178.4-159.173.5177.70111.6F113 A159 F193 T195 L201F113-K197 HydrophobicContact CZ-CD 4.48Å; A159-K197 PolarHBondContact O-NZ 2.9Å; F193-K197 WeakPolarHBondContact O-CB 3.41Å; F193-K197 PolarHBondContact O-N 3.28Å; T195-K197 VanDerWaalsContact C-N 3.29Å; T195-K197 PolarHBondContact O-N 3.22Å; K197-L201 HydrophobicContact CG-CD1 3.88Å; K197-L201 WeakPolarHBondContact O-CB 3.44Å; K197-L201 WeakPolarHBondContact O-CG 3.48Å; K197-L201 PolarHBondContact O-N 3.44Å
198I95.3Very high94.5Very high9 Ų950.5 Ų50.55%0.04625%0.25CC..Hα-helixtrans-62.5-47.1179.7-68.1165.8000110.3F109 F112 F113 Q194 T195 L196 G202 N252 L255F109-I198 HydrophobicContact CE1-CD1 4.06Å; F112-I198 HydrophobicContact CE1-CG2 4.21Å; F112-I198 HydrophobicContact CZ-CG2 4.28Å; F113-I198 HydrophobicContact CZ-CG1 4.22Å; Q194-I198 HydrophobicContact CG-CD1 4.22Å; Q194-I198 WeakPolarHBondContact O-CG1 3.32Å; Q194-I198 PolarHBondContact O-N 3.33Å; Q194-I198 VanDerWaalsContact O-N 3.12Å; T195-I198 PolarHBondContact O-N 2.91Å; L196-I198 PolarHBondContact O-N 3.13Å; I198-G202 VanDerWaalsContact O-CA 3.25Å; I198-G202 WeakPolarHBondContact O-CA 3.5Å; I198-G202 PolarHBondContact O-N 3.32Å; I198-N252 WeakPolarHBondContact CG2-OD1 3.35Å; I198-N252 PolarHBondContact O-OD1 3.04Å; I198-L255 HydrophobicContact CB-CD2 4.04Å; I198-L255 HydrophobicContact CD1-CD2 3.98Å; I198-L255 HydrophobicContact CG2-CD2 3.79Å
199V96.1Very high94.8Very high14 Ų1447.3 Ų47.39%0.08524%0.236CC..Hα-helixtrans-67.3-43.9-178.9173.40000112T195 L196 L203 V204 N252 L256T195-V199 HydrophobicContact CG2-CG2 4.3Å; T195-V199 WeakPolarHBondContact O-CG2 3.19Å; T195-V199 PolarHBondContact O-N 2.87Å; L196-V199 PolarHBondContact O-N 3.46Å; V199-L203 WeakPolarHBondContact O-CA 3.42Å; V199-L203 VanDerWaalsContact O-CB 3.28Å; V199-L203 WeakPolarHBondContact O-CB 3.4Å; V199-L203 PolarHBondContact O-N 3.06Å; V199-V204 HydrophobicContact CG1-CG2 4.25Å; V199-V204 PolarHBondContact O-N 3.07Å; V199-N252 HydrophobicContact CG2-CB 4.45Å; V199-L256 HydrophobicContact CG2-CB 4.46Å; V199-L256 HydrophobicContact CG2-CD1 4.41Å
200I96.9Very high94.7Very high86 Ų8643 Ų4344%0.44122%0.218SC..Iπ-helixtrans-65.3-50.7-179-69.5166.5000110.1L196 V204 L205L196-I200 HydrophobicContact CB-CD1 4.23Å; L196-I200 WeakPolarHBondContact O-CB 3.47Å; L196-I200 WeakPolarHBondContact O-CD1 3.45Å; L196-I200 WeakPolarHBondContact O-CG1 3.48Å; L196-I200 PolarHBondContact O-N 3.39Å; I200-V204 PolarHBondContact O-N 3.13Å; I200-L205 VanDerWaalsContact O-CB 3.24Å; I200-L205 WeakPolarHBondContact O-CB 3.25Å; I200-L205 PolarHBondContact O-N 3.26Å
201L96.8Very high94.7Very high42 Ų4244.2 Ų44.222%0.2223%0.232CC..Iπ-helixtrans-77.2-34.4-175.9-61.4178000112.7F113 F117 A159 K197 L205 P206F113-L201 HydrophobicContact CD1-CB 4.27Å; F113-L201 HydrophobicContact CD1-CD1 4.3Å; F113-L201 HydrophobicContact CE1-CB 4.03Å; F113-L201 HydrophobicContact CE1-CD1 4.02Å; F117-L201 HydrophobicContact CE1-CB 4.37Å; F117-L201 HydrophobicContact CE1-CD2 4.45Å; F117-L201 HydrophobicContact CZ-CD1 4.32Å; F117-L201 HydrophobicContact CZ-CD2 4.48Å; A159-L201 HydrophobicContact CB-CD1 4.35Å; K197-L201 HydrophobicContact CG-CD1 3.88Å; K197-L201 WeakPolarHBondContact O-CB 3.44Å; K197-L201 WeakPolarHBondContact O-CG 3.48Å; K197-L201 PolarHBondContact O-N 3.44Å; L201-L205 HydrophobicContact CD2-CD2 4.26Å; L201-P206 WeakPolarHBondContact O-CD 3.42Å
202G93.6Very high94.8Very high0 Ų046.9 Ų46.90%025%0.247CC..Iπ-helixtrans-91.6-19.4-174.700000115I198 P206 Y244I198-G202 VanDerWaalsContact O-CA 3.25Å; I198-G202 WeakPolarHBondContact O-CA 3.5Å; I198-G202 PolarHBondContact O-N 3.32Å; G202-P206 WeakPolarHBondContact O-CG 3.33Å; G202-Y244 VanDerWaalsContact O-CE1 3.29Å; G202-Y244 WeakPolarHBondContact O-CE1 3.3Å; G202-Y244 PolarHBondContact O-OH 3.28Å
203L94.9Very high94.8Very high31 Ų3145.4 Ų45.416%0.16224%0.24CC..Iπ-helixtrans-129.9-56.2-177.9-177.964.1000112.9V199 P206 L207 F245 A249 N252V199-L203 WeakPolarHBondContact O-CA 3.42Å; V199-L203 VanDerWaalsContact O-CB 3.28Å; V199-L203 WeakPolarHBondContact O-CB 3.4Å; V199-L203 PolarHBondContact O-N 3.06Å; L203-P206 WeakPolarHBondContact O-CD 3.4Å; L203-P206 WeakPolarHBondContact O-CG 3.27Å; L203-L207 WeakPolarHBondContact O-CB 3.4Å; L203-L207 PolarHBondContact O-N 3.38Å; L203-L207 VanDerWaalsContact O-N 3.09Å; L203-F245 HydrophobicContact CD1-CD1 3.8Å; L203-F245 HydrophobicContact CD1-CE1 3.88Å; L203-A249 HydrophobicContact CD1-CB 3.76Å; L203-N252 HydrophobicContact CB-CB 4.22Å; L203-N252 HydrophobicContact CD2-CB 4Å
204V96.7Very high94.4Very high77 Ų7742.5 Ų42.547%0.46723%0.227SC..Iπ-helixtrans-67.9-49.3-172.1-179.20000111.8V199 I200 L207 L208V199-V204 HydrophobicContact CG1-CG2 4.25Å; V199-V204 PolarHBondContact O-N 3.07Å; I200-V204 PolarHBondContact O-N 3.13Å; V204-L207 PolarHBondContact O-N 2.98Å; V204-L208 WeakPolarHBondContact O-CB 2.86Å; V204-L208 PolarHBondContact O-N 3.32Å
205L96.1Very high94.2Very high61 Ų6145.5 Ų45.532%0.31925%0.249SC..Hα-helixtrans-59-53.8179.1178.566.4000112.6F117 I120 I200 L201 L207 L208 V209F117-L205 HydrophobicContact CE1-CD2 4.37Å; I120-L205 HydrophobicContact CD1-CD2 3.95Å; I120-L205 HydrophobicContact CD1-CG 3.97Å; I200-L205 VanDerWaalsContact O-CB 3.24Å; I200-L205 WeakPolarHBondContact O-CB 3.25Å; I200-L205 PolarHBondContact O-N 3.26Å; L201-L205 HydrophobicContact CD2-CD2 4.26Å; L205-L207 VanDerWaalsContact C-N 3.27Å; L205-L207 PolarHBondContact O-N 2.82Å; L205-L208 PolarHBondContact O-N 3.45Å; L205-V209 WeakPolarHBondContact O-CG2 3.37Å; L205-V209 PolarHBondContact O-N 2.93Å
206P94.2Very high93.9Very high0 Ų045.9 Ų45.90%026%0.255CS..Hα-helixtrans-64-32.6178.324.2-33.9000112.4I116 I120 L201 G202 L203 V209 M210 M241 Y244 F245I116-P206 HydrophobicContact CD1-CB 3.56Å; I116-P206 HydrophobicContact CD1-CG 3.82Å; I116-P206 HydrophobicContact CG1-CB 3.99Å; I116-P206 HydrophobicContact CG1-CG 3.85Å; I120-P206 HydrophobicContact CD1-CB 4Å; I120-P206 HydrophobicContact CG1-CB 3.98Å; L201-P206 WeakPolarHBondContact O-CD 3.42Å; G202-P206 WeakPolarHBondContact O-CG 3.33Å; L203-P206 WeakPolarHBondContact O-CD 3.4Å; L203-P206 WeakPolarHBondContact O-CG 3.27Å; P206-V209 PolarHBondContact O-N 2.92Å; P206-M210 VanDerWaalsContact O-CB 3.28Å; P206-M210 WeakPolarHBondContact O-CB 3.29Å; P206-M210 PolarHBondContact O-N 3.13Å; P206-M241 HydrophobicContact CB-SD 4.33Å; P206-Y244 HydrophobicContact CG-CE1 4.49Å; P206-F245 HydrophobicContact CB-CE1 4.26Å; P206-F245 HydrophobicContact CB-CZ 3.84Å; P206-F245 HydrophobicContact CG-CE1 4.02Å; P206-F245 HydrophobicContact CG-CZ 4.09Å
207L94.8Very high93.4Very high83 Ų8342.6 Ų42.644%0.43524%0.238SC..Hα-helixtrans-67-43.5177.1-172.572.5000111.1L203 V204 L205 M210 V211 F245L203-L207 WeakPolarHBondContact O-CB 3.4Å; L203-L207 PolarHBondContact O-N 3.38Å; L203-L207 VanDerWaalsContact O-N 3.09Å; V204-L207 PolarHBondContact O-N 2.98Å; L205-L207 VanDerWaalsContact C-N 3.27Å; L205-L207 PolarHBondContact O-N 2.82Å; L207-M210 WeakPolarHBondContact O-CB 3.32Å; L207-M210 PolarHBondContact O-N 3.42Å; L207-V211 WeakPolarHBondContact O-CG2 3.24Å; L207-V211 PolarHBondContact O-N 3.42Å; L207-F245 HydrophobicContact CB-CE1 4.34Å; L207-F245 HydrophobicContact CB-CZ 4.09Å; L207-F245 HydrophobicContact CD1-CE2 4.49Å; L207-F245 HydrophobicContact CD1-CZ 4.25Å
208L96.1Very high92.9Very high101 Ų10146.5 Ų46.553%0.52926%0.259SS..Hα-helixtrans-60.3-47.5175.1-179.763.8000111.2V204 L205 M210 V211 I212V204-L208 WeakPolarHBondContact O-CB 2.86Å; V204-L208 PolarHBondContact O-N 3.32Å; L205-L208 PolarHBondContact O-N 3.45Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.35Å; L208-V211 PolarHBondContact O-N 2.77Å; L208-I212 HydrophobicContact CD1-CD1 3.8Å; L208-I212 HydrophobicContact CD1-CG1 4.33Å; L208-I212 HydrophobicContact CG-CD1 3.87Å; L208-I212 WeakPolarHBondContact O-CG1 3.34Å; L208-I212 PolarHBondContact O-N 3.47Å
209V94.8Very high92.5Very high20 Ų2054 Ų5412%0.12129%0.291CS..Hα-helixtrans-59.1-43.3175.8171.70000110.6I120 T123 I124 L205 P206 C213I120-V209 HydrophobicContact CG2-CG1 4.22Å; I120-V209 HydrophobicContact CG2-CG2 4.04Å; T123-V209 HydrophobicContact CG2-CG1 3.98Å; I124-V209 HydrophobicContact CG1-CG1 4.14Å; L205-V209 WeakPolarHBondContact O-CG2 3.37Å; L205-V209 PolarHBondContact O-N 2.93Å; P206-V209 PolarHBondContact O-N 2.92Å; V209-C213 WeakPolarHBondContact O-CB 3.47Å; V209-C213 PolarHBondContact O-N 3.47Å; V209-C213 PolarHBondContact O-SG 3.35Å
210M91.1Very high91.8Very high32 Ų3254.9 Ų54.916%0.15830%0.296CS..Hα-helixtrans-59.2-52.6178.1-175-174.2-174.300110.9P206 L207 L208 I212 C213 Y214 F238 M241 I242 F245P206-M210 VanDerWaalsContact O-CB 3.28Å; P206-M210 WeakPolarHBondContact O-CB 3.29Å; P206-M210 PolarHBondContact O-N 3.13Å; L207-M210 WeakPolarHBondContact O-CB 3.32Å; L207-M210 PolarHBondContact O-N 3.42Å; L208-M210 VanDerWaalsContact C-N 3.29Å; L208-M210 PolarHBondContact O-N 3.35Å; M210-I212 PolarHBondContact O-N 3.14Å; M210-C213 PolarHBondContact O-N 2.97Å; M210-Y214 HydrophobicContact CB-CD2 4.33Å; M210-Y214 HydrophobicContact CG-CD2 3.58Å; M210-Y214 HydrophobicContact CG-CE2 4Å; M210-Y214 VanDerWaalsContact O-CB 3.32Å; M210-Y214 WeakPolarHBondContact O-CB 3.33Å; M210-Y214 VanDerWaalsContact O-CD2 3.28Å; M210-Y214 WeakPolarHBondContact O-CD2 3.23Å; M210-Y214 PolarHBondContact O-N 3.48Å; M210-F238 HydrophobicContact CE-CD2 4.1Å; M210-F238 HydrophobicContact CE-CE2 3.57Å; M210-F238 HydrophobicContact CE-CZ 4.39Å; M210-M241 HydrophobicContact CB-CG 4.44Å; M210-M241 HydrophobicContact CE-CG 4.48Å; M210-M241 HydrophobicContact CG-CG 4.18Å; M210-M241 HydrophobicContact SD-CG 3.98Å; M210-I242 HydrophobicContact CE-CG1 3.88Å; M210-F245 HydrophobicContact SD-CD2 4.04Å; M210-F245 HydrophobicContact SD-CE2 3.55Å; M210-F245 VanDerWaalsContact SD-CE2 3.55Å
211V92.9Very high90.8Very high87 Ų8751.8 Ų51.853%0.52728%0.281SS..Hα-helixtrans-59-48.4-178.8171.90000111.2L207 L208 S215L207-V211 WeakPolarHBondContact O-CG2 3.24Å; L207-V211 PolarHBondContact O-N 3.42Å; L208-V211 PolarHBondContact O-N 2.77Å; V211-S215 WeakPolarHBondContact O-CB 3.42Å; V211-S215 PolarHBondContact O-N 2.98Å; V211-S215 VanDerWaalsContact O-N 3.16Å; V211-S215 PolarHBondContact O-OG 3.23Å
212I93.8Very high90Very high97 Ų9756.4 Ų56.450%0.49731%0.305SS..Hα-helixtrans-64.8-51.8-178.5-64.6169000110.6L208 M210 G216L208-I212 HydrophobicContact CD1-CD1 3.8Å; L208-I212 HydrophobicContact CD1-CG1 4.33Å; L208-I212 HydrophobicContact CG-CD1 3.87Å; L208-I212 WeakPolarHBondContact O-CG1 3.34Å; L208-I212 PolarHBondContact O-N 3.47Å; M210-I212 PolarHBondContact O-N 3.14Å; I212-G216 PolarHBondContact O-N 2.94Å
213C91.8Very high89.3Confident8 Ų867.1 Ų67.15%0.05435%0.345CS..Hα-helixtrans-67.9-46.6-173.4-680000111.7T123 Y127 V209 M210 G216 I217T123-C213 HydrophobicContact CG2-CB 3.72Å; Y127-C213 VanDerWaalsContact CD2-CA 3.49Å; Y127-C213 HydrophobicContact CD2-CB 3.89Å; Y127-C213 VanDerWaalsContact CD2-O 3.31Å; Y127-C213 WeakPolarHBondContact CD2-O 3.19Å; Y127-C213 HydrophobicContact CG-CB 4.11Å; V209-C213 WeakPolarHBondContact O-CB 3.47Å; V209-C213 PolarHBondContact O-N 3.47Å; V209-C213 PolarHBondContact O-SG 3.35Å; M210-C213 PolarHBondContact O-N 2.97Å; C213-G216 PolarHBondContact O-N 2.89Å; C213-I217 WeakPolarHBondContact O-CB 3.48Å; C213-I217 VanDerWaalsContact O-CG1 3.24Å; C213-I217 WeakPolarHBondContact O-CG1 3.23Å; C213-I217 PolarHBondContact O-N 3.46Å
214Y87.8Confident87.9Confident29 Ų2968.7 Ų68.711%0.11436%0.358CS..Hα-helixtrans-72.4-31.2-177-76.1-77.2000112.9T123 M210 I217 L218 V234 I237 F238T123-Y214 HydrophobicContact CG2-CE2 3.88Å; M210-Y214 HydrophobicContact CB-CD2 4.33Å; M210-Y214 HydrophobicContact CG-CD2 3.58Å; M210-Y214 HydrophobicContact CG-CE2 4Å; M210-Y214 VanDerWaalsContact O-CB 3.32Å; M210-Y214 WeakPolarHBondContact O-CB 3.33Å; M210-Y214 VanDerWaalsContact O-CD2 3.28Å; M210-Y214 WeakPolarHBondContact O-CD2 3.23Å; M210-Y214 PolarHBondContact O-N 3.48Å; Y214-I217 HydrophobicContact CD1-CD1 4.21Å; Y214-I217 HydrophobicContact CE1-CD1 4.31Å; Y214-I217 PolarHBondContact O-N 3.35Å; Y214-L218 VanDerWaalsContact O-CB 3.23Å; Y214-L218 WeakPolarHBondContact O-CB 3.1Å; Y214-L218 PolarHBondContact O-N 3.39Å; Y214-V234 HydrophobicContact CE1-CG1 4.12Å; Y214-I237 VanDerWaalsContact OH-C 3.27Å; Y214-F238 AromaticContact CD1-CD2 3.69Å; Y214-F238 HydrophobicContact CD1-CD2 3.69Å; Y214-F238 HydrophobicContact CD1-CE2 4.24Å; Y214-F238 HydrophobicContact CD2-CD2 4.2Å; Y214-F238 HydrophobicContact CE1-CB 3.68Å; Y214-F238 AromaticContact CE1-CD2 3.43Å; Y214-F238 HydrophobicContact CE1-CD2 3.43Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.43Å; Y214-F238 HydrophobicContact CE1-CE2 4.4Å; Y214-F238 AromaticContact CE1-CG 3.95Å; Y214-F238 HydrophobicContact CE1-CG 3.95Å; Y214-F238 AromaticContact CE2-CD2 3.98Å; Y214-F238 HydrophobicContact CE2-CD2 3.98Å; Y214-F238 HydrophobicContact CG-CD2 4.09Å; Y214-F238 HydrophobicContact CG-CE2 4.36Å; Y214-F238 AromaticContact CZ-CD2 3.6Å; Y214-F238 WeakPolarHBondContact OH-CA 3.45Å; Y214-F238 PolarHBondContact OH-N 3.09Å
215S88.8Confident86.3Confident76 Ų7675.8 Ų75.853%0.53138%0.377SS..Hα-helixtrans-60.3-46170.5-71.90000111.9V211 L218 K219V211-S215 WeakPolarHBondContact O-CB 3.42Å; V211-S215 PolarHBondContact O-N 2.98Å; V211-S215 VanDerWaalsContact O-N 3.16Å; V211-S215 PolarHBondContact O-OG 3.23Å; S215-L218 PolarHBondContact O-N 3.46Å; S215-K219 WeakPolarHBondContact O-CB 3.49Å; S215-K219 PolarHBondContact O-N 2.88Å
216G87.5Confident84.4Confident16 Ų1679.9 Ų79.917%0.16540%0.399CS..Hα-helixtrans-68.9-38.1177.500000113.5I212 C213 T220I212-G216 PolarHBondContact O-N 2.94Å; C213-G216 PolarHBondContact O-N 2.89Å; G216-T220 WeakPolarHBondContact O-CB 3.43Å; G216-T220 PolarHBondContact O-N 2.87Å; G216-T220 VanDerWaalsContact O-N 3.11Å; G216-T220 PolarHBondContact O-OG1 3.01Å
217I86.2Confident83Confident4 Ų485.4 Ų85.42%0.02143%0.425CS..Hα-helixtrans-61.5-49.6173.4-70.8164.4000110.1Y127 V130 V131 C213 Y214 K219 T220 L221 V234Y127-I217 HydrophobicContact CD2-CG1 4.16Å; V130-I217 HydrophobicContact CB-CG1 4.37Å; V130-I217 HydrophobicContact CG1-CG1 4.41Å; V130-I217 HydrophobicContact CG1-CG2 4.32Å; V131-I217 HydrophobicContact CG2-CG1 4.29Å; C213-I217 WeakPolarHBondContact O-CB 3.48Å; C213-I217 VanDerWaalsContact O-CG1 3.24Å; C213-I217 WeakPolarHBondContact O-CG1 3.23Å; C213-I217 PolarHBondContact O-N 3.46Å; Y214-I217 HydrophobicContact CD1-CD1 4.21Å; Y214-I217 HydrophobicContact CE1-CD1 4.31Å; Y214-I217 PolarHBondContact O-N 3.35Å; I217-K219 PolarHBondContact O-N 2.92Å; I217-T220 PolarHBondContact O-N 2.97Å; I217-T220 VanDerWaalsContact O-N 3.15Å; I217-L221 HydrophobicContact CG2-CD1 3.68Å; I217-L221 HydrophobicContact CG2-CG 4.04Å; I217-L221 WeakPolarHBondContact O-CB 3.33Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.28Å; I217-L221 PolarHBondContact O-N 3.45Å; I217-V234 HydrophobicContact CG2-CG1 3.79Å; I217-V234 HydrophobicContact CG2-CG2 4.01Å
218L84.9Confident81.4Confident103 Ų10389.8 Ų89.854%0.53944%0.44SS..Hα-helixtrans-61.4-45.9-178-174.361.9000111.1Y214 S215 T220 L221 L222Y214-L218 VanDerWaalsContact O-CB 3.23Å; Y214-L218 WeakPolarHBondContact O-CB 3.1Å; Y214-L218 PolarHBondContact O-N 3.39Å; S215-L218 PolarHBondContact O-N 3.46Å; L218-T220 VanDerWaalsContact C-N 3.26Å; L218-T220 PolarHBondContact O-N 2.93Å; L218-L221 PolarHBondContact O-N 2.98Å; L218-L222 HydrophobicContact CD1-CD1 4.44Å; L218-L222 HydrophobicContact CD1-CG 4.36Å; L218-L222 HydrophobicContact CG-CD1 4.1Å; L218-L222 HydrophobicContact CG-CG 4.45Å; L218-L222 WeakPolarHBondContact O-CB 3.29Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.46Å; L218-L222 PolarHBondContact O-N 3.29Å
219K86.3Confident79.7Confident166 Ų16692.1 Ų92.172%0.72245%0.446SS*.Hα-helixtrans-55.2-42.2174.6-173.8176.7-178.7176.60112.2S215 I217 R223S215-K219 WeakPolarHBondContact O-CB 3.49Å; S215-K219 PolarHBondContact O-N 2.88Å; I217-K219 PolarHBondContact O-N 2.92Å; K219-R223 PolarHBondContact O-N 2.95Å
220T81.4Confident78.3Confident33 Ų3393.9 Ų93.920%0.20245%0.45CS..Hα-helixtrans-75.7-33.3-179.3-53.60000112.7V130 G216 I217 L218 C224 R230V130-T220 HydrophobicContact CG1-CG2 4.17Å; G216-T220 WeakPolarHBondContact O-CB 3.43Å; G216-T220 PolarHBondContact O-N 2.87Å; G216-T220 VanDerWaalsContact O-N 3.11Å; G216-T220 PolarHBondContact O-OG1 3.01Å; I217-T220 PolarHBondContact O-N 2.97Å; I217-T220 VanDerWaalsContact O-N 3.15Å; L218-T220 VanDerWaalsContact C-N 3.26Å; L218-T220 PolarHBondContact O-N 2.93Å; T220-C224 PolarHBondContact O-N 3.47Å; T220-R230 PolarHBondContact O-NH2 3.22Å
221L77.3Confident77.3Confident22 Ų2296.1 Ų96.112%0.11546%0.46CS..Hα-helixtrans-69.6-40.8175-72.4-179.9000111.6I217 L218 R223 C224 R230 V234I217-L221 HydrophobicContact CG2-CD1 3.68Å; I217-L221 HydrophobicContact CG2-CG 4.04Å; I217-L221 WeakPolarHBondContact O-CB 3.33Å; I217-L221 VanDerWaalsContact O-CG 3.3Å; I217-L221 WeakPolarHBondContact O-CG 3.28Å; I217-L221 PolarHBondContact O-N 3.45Å; L218-L221 PolarHBondContact O-N 2.98Å; L221-R223 VanDerWaalsContact C-N 3.28Å; L221-R223 PolarHBondContact O-N 2.97Å; L221-C224 CarbonylContact O-C 3.55Å; L221-C224 PolarHBondContact O-N 3.38Å; L221-R230 HydrophobicContact CD2-CG 4.3Å; L221-V234 HydrophobicContact CD1-CG1 4.48Å
222L78.6Confident76.2Confident138 Ų13898 Ų9872%0.72346%0.458SS*.Hα-helixtrans-63.8-34.7176-69.8171.6000112L218L218-L222 HydrophobicContact CD1-CD1 4.44Å; L218-L222 HydrophobicContact CD1-CG 4.36Å; L218-L222 HydrophobicContact CG-CD1 4.1Å; L218-L222 HydrophobicContact CG-CG 4.45Å; L218-L222 WeakPolarHBondContact O-CB 3.29Å; L218-L222 VanDerWaalsContact O-CG 3.28Å; L218-L222 WeakPolarHBondContact O-CG 3.46Å; L218-L222 PolarHBondContact O-N 3.29Å
223R78.4Confident75Confident226 Ų22695 Ų9585%0.85345%0.448SS*.Hα-helixtrans-77.1-28.3179-165.6173.7-178.4-177.31113.9K219 L221K219-R223 PolarHBondContact O-N 2.95Å; L221-R223 VanDerWaalsContact C-N 3.28Å; L221-R223 PolarHBondContact O-N 2.97Å
224C66.6Low74.4Confident63 Ų6395.4 Ų95.443%0.42645%0.45SS..  trans-125.992.2-175.4-600000110.7T220 L221 N226 R230T220-C224 PolarHBondContact O-N 3.47Å; L221-C224 CarbonylContact O-C 3.55Å; L221-C224 PolarHBondContact O-N 3.38Å; C224-N226 VanDerWaalsContact C-N 3.35Å; C224-N226 PolarHBondContact O-N 3.18Å; C224-R230 PolarHBondContact O-NH2 3.12Å; C224-R230 VanDerWaalsContact O-NH2 3.12Å
225R62.6Low74.1Confident227 Ų227100 Ų10086%0.85747%0.467SS*.THydrogen-bonded Turntrans-74.8-8.4-169.5-159165.490.6164.43.9116
226N56Low73.7Confident146 Ų14697.8 Ų97.878%0.78145%0.449SS*.THydrogen-bonded Turntrans-104.35.8-157.7-72.4-7.1000117.8C224C224-N226 VanDerWaalsContact C-N 3.35Å; C224-N226 PolarHBondContact O-N 3.18Å
227E65Low73.5Confident117 Ų11797.2 Ų97.255%0.54744%0.442SS..  trans-11781.3-173-76.5-68.3160.900114K229 R230 H231E227-K229 PolarHBondContact O-N 2.85Å; E227-K229 VanDerWaalsContact O-N 3.09Å; E227-R230 HydrophobicContact CB-CB 4.05Å; E227-R230 WeakPolarHBondContact O-CB 3.26Å; E227-R230 PolarHBondContact O-N 3.21Å; E227-H231 PolarHBondContact O-CD2 3.43Å
228K62.5Low73.5Confident174 Ų174101 Ų10176%0.75746%0.458SS*.Hα-helixtrans-52.1-33178.9-70.5-178.5-179.6176.40113.7
229K59.4Low73.7Confident151 Ų15197.9 Ų97.966%0.65744%0.444SS*.Hα-helixtrans-70.3-30.7-179-165.1175.8-179.41800112.6E227E227-K229 PolarHBondContact O-N 2.85Å; E227-K229 VanDerWaalsContact O-N 3.09Å
230R66Low73.9Confident56 Ų5690 Ų9021%0.21141%0.41CS..Hα-helixtrans-70.1-40.9178.7-167.9169.366.7161.73111.5V130 T220 L221 C224 E227 R232 A233 V234V130-R230 HydrophobicContact CG2-CG 3.88Å; T220-R230 PolarHBondContact O-NH2 3.22Å; L221-R230 HydrophobicContact CD2-CG 4.3Å; C224-R230 PolarHBondContact O-NH2 3.12Å; C224-R230 VanDerWaalsContact O-NH2 3.12Å; E227-R230 HydrophobicContact CB-CB 4.05Å; E227-R230 WeakPolarHBondContact O-CB 3.26Å; E227-R230 PolarHBondContact O-N 3.21Å; R230-R232 VanDerWaalsContact C-N 3.32Å; R230-R232 PolarHBondContact O-N 3.43Å; R230-A233 PolarHBondContact O-N 3.41Å; R230-V234 WeakPolarHBondContact O-CG2 3.49Å; R230-V234 PolarHBondContact O-N 3.04Å
231H69.1Low74.3Confident79 Ų7988.4 Ų88.437%0.36640%0.4SS..Hα-helixtrans-60.9-37.2177.1-67.4-79.9000113E227 R235E227-H231 PolarHBondContact O-CD2 3.43Å; H231-R235 WeakPolarHBondContact O-CB 3.46Å; H231-R235 PolarHBondContact O-N 3.28Å
232R70.9Confident75Confident127 Ų12790.1 Ų90.148%0.47941%0.409SS..Hα-helixtrans-65.9-43.2-178.1-66.4-177.5-173.6173.93.1113R230 R235 L236 E302R230-R232 VanDerWaalsContact C-N 3.32Å; R230-R232 PolarHBondContact O-N 3.43Å; R232-R235 PolarHBondContact O-N 3.09Å; R232-L236 PolarHBondContact O-N 3.34Å; R232-L236 VanDerWaalsContact O-N 3.14Å; R232-E302 WeakPolarHBondContact CD-OE2 3.45Å; R232-E302 IonicContact CZ-OE1 2.72Å; R232-E302 IonicContact CZ-OE2 2.75Å; R232-E302 VanDerWaalsContact CZ-OE2 3.23Å; R232-E302 IonicContact NE-OE1 3.23Å; R232-E302 IonicContact NE-OE2 3.32Å; R232-E302 IonicContact NH1-OE1 3.53Å; R232-E302 IonicContact NH1-OE2 3.7Å; R232-E302 PolarHBondContact NH1-OE2 2.82Å
233A68.8Low75.8Confident35 Ų3584.6 Ų84.629%0.28938%0.381SS..Hα-helixtrans-70.4-37.9179.600000112.1R230 L236 I237R230-A233 PolarHBondContact O-N 3.41Å; A233-L236 PolarHBondContact O-N 3.3Å; A233-I237 PolarHBondContact O-N 3.09Å
234V77.5Confident76.5Confident15 Ų1574 Ų749%0.09134%0.341CS..Hα-helixtrans-62.7-44.3173.31730000110.5V130 Y214 I217 L221 R230 L236 I237 F238V130-V234 HydrophobicContact CG2-CG2 4.05Å; Y214-V234 HydrophobicContact CE1-CG1 4.12Å; I217-V234 HydrophobicContact CG2-CG1 3.79Å; I217-V234 HydrophobicContact CG2-CG2 4.01Å; L221-V234 HydrophobicContact CD1-CG1 4.48Å; R230-V234 WeakPolarHBondContact O-CG2 3.49Å; R230-V234 PolarHBondContact O-N 3.04Å; V234-L236 VanDerWaalsContact C-N 3.34Å; V234-L236 PolarHBondContact O-N 3.35Å; V234-I237 PolarHBondContact O-N 3.28Å; V234-F238 VanDerWaalsContact O-CB 3.25Å; V234-F238 WeakPolarHBondContact O-CB 3.42Å; V234-F238 PolarHBondContact O-N 3.45Å
235R81.8Confident77.9Confident125 Ų12572.2 Ų72.247%0.47233%0.326SS..Hα-helixtrans-57.3-45.3177.2-172.9177.369.9-1722.3111.9H231 R232 F238 T239H231-R235 WeakPolarHBondContact O-CB 3.46Å; H231-R235 PolarHBondContact O-N 3.28Å; R232-R235 PolarHBondContact O-N 3.09Å; R235-F238 PolarHBondContact O-N 3.09Å; R235-T239 PolarHBondContact O-N 3.18Å; R235-T239 PolarHBondContact O-OG1 3.12Å
236L81.6Confident79.5Confident30 Ų3066.7 Ų66.716%0.15731%0.312CS..Hα-helixtrans-59.5-52.7179.4179.764.4000112.1R232 A233 V234 F238 T239 I240 I296 Y297 V300R232-L236 PolarHBondContact O-N 3.34Å; R232-L236 VanDerWaalsContact O-N 3.14Å; A233-L236 PolarHBondContact O-N 3.3Å; V234-L236 VanDerWaalsContact C-N 3.34Å; V234-L236 PolarHBondContact O-N 3.35Å; L236-F238 VanDerWaalsContact C-N 3.31Å; L236-F238 PolarHBondContact O-N 2.83Å; L236-T239 PolarHBondContact O-N 2.95Å; L236-I240 HydrophobicContact CD1-CD1 4.42Å; L236-I240 HydrophobicContact CG-CD1 4.19Å; L236-I240 WeakPolarHBondContact O-CG1 3.31Å; L236-I240 PolarHBondContact O-N 3.35Å; L236-I240 VanDerWaalsContact O-N 3.08Å; L236-I296 HydrophobicContact CD1-CG2 3.93Å; L236-Y297 HydrophobicContact CD1-CD1 4.24Å; L236-V300 HydrophobicContact CB-CG1 4.37Å; L236-V300 HydrophobicContact CD1-CB 3.86Å; L236-V300 HydrophobicContact CD1-CG1 3.87Å
237I82.3Confident81.4Confident5 Ų561.6 Ų61.63%0.02628%0.283CS..Hα-helixtrans-68.1-34.2-177.3-57.9-49000111.3L122 R126 Y214 A233 V234 I240 M241L122-I237 HydrophobicContact CB-CD1 4.31Å; L122-I237 HydrophobicContact CB-CG2 4.3Å; L122-I237 HydrophobicContact CD2-CD1 4.37Å; R126-I237 HydrophobicContact CG-CB 4.05Å; R126-I237 HydrophobicContact CG-CG1 3.49Å; R126-I237 VanDerWaalsContact CG-CG1 3.49Å; R126-I237 HydrophobicContact CG-CG2 4.29Å; Y214-I237 VanDerWaalsContact OH-C 3.27Å; A233-I237 PolarHBondContact O-N 3.09Å; V234-I237 PolarHBondContact O-N 3.28Å; I237-I240 HydrophobicContact CD1-CD1 3.89Å; I237-I240 PolarHBondContact O-N 3.16Å; I237-M241 PolarHBondContact O-N 3.12Å
238F86.8Confident82.8Confident82 Ų8256.5 Ų56.536%0.3626%0.259SS..Hα-helixtrans-63.5-42.7174.3-174.6-113.4000112.2M210 Y214 V234 R235 L236 M241 I242M210-F238 HydrophobicContact CE-CD2 4.1Å; M210-F238 HydrophobicContact CE-CE2 3.57Å; M210-F238 HydrophobicContact CE-CZ 4.39Å; Y214-F238 AromaticContact CD1-CD2 3.69Å; Y214-F238 HydrophobicContact CD1-CD2 3.69Å; Y214-F238 HydrophobicContact CD1-CE2 4.24Å; Y214-F238 HydrophobicContact CD2-CD2 4.2Å; Y214-F238 HydrophobicContact CE1-CB 3.68Å; Y214-F238 AromaticContact CE1-CD2 3.43Å; Y214-F238 HydrophobicContact CE1-CD2 3.43Å; Y214-F238 VanDerWaalsContact CE1-CD2 3.43Å; Y214-F238 HydrophobicContact CE1-CE2 4.4Å; Y214-F238 AromaticContact CE1-CG 3.95Å; Y214-F238 HydrophobicContact CE1-CG 3.95Å; Y214-F238 AromaticContact CE2-CD2 3.98Å; Y214-F238 HydrophobicContact CE2-CD2 3.98Å; Y214-F238 HydrophobicContact CG-CD2 4.09Å; Y214-F238 HydrophobicContact CG-CE2 4.36Å; Y214-F238 AromaticContact CZ-CD2 3.6Å; Y214-F238 WeakPolarHBondContact OH-CA 3.45Å; Y214-F238 PolarHBondContact OH-N 3.09Å; V234-F238 VanDerWaalsContact O-CB 3.25Å; V234-F238 WeakPolarHBondContact O-CB 3.42Å; V234-F238 PolarHBondContact O-N 3.45Å; R235-F238 PolarHBondContact O-N 3.09Å; L236-F238 VanDerWaalsContact C-N 3.31Å; L236-F238 PolarHBondContact O-N 2.83Å; F238-M241 PolarHBondContact O-N 3.35Å; F238-I242 HydrophobicContact CD1-CD1 3.65Å; F238-I242 HydrophobicContact CD2-CD1 4.26Å; F238-I242 HydrophobicContact CE1-CD1 3.19Å; F238-I242 HydrophobicContact CE1-CG1 4.39Å; F238-I242 HydrophobicContact CE2-CD1 3.88Å; F238-I242 HydrophobicContact CE2-CG1 4.4Å; F238-I242 HydrophobicContact CG-CD1 4.19Å; F238-I242 HydrophobicContact CZ-CD1 3.35Å; F238-I242 HydrophobicContact CZ-CG1 4.31Å; F238-I242 WeakPolarHBondContact O-CG1 3.26Å; F238-I242 PolarHBondContact O-N 3.3Å
239T89.8Confident84.4Confident38 Ų3849 Ų4923%0.23323%0.23CC..Hα-helixtrans-61.8-45.1174.8-58.70000111.6R235 L236 M241 I242 V243 I296 V300R235-T239 PolarHBondContact O-N 3.18Å; R235-T239 PolarHBondContact O-OG1 3.12Å; L236-T239 PolarHBondContact O-N 2.95Å; T239-M241 VanDerWaalsContact C-N 3.32Å; T239-M241 PolarHBondContact O-N 2.9Å; T239-I242 PolarHBondContact O-N 2.81Å; T239-V243 HydrophobicContact CG2-CG2 4.15Å; T239-V243 WeakPolarHBondContact O-CB 3.46Å; T239-V243 VanDerWaalsContact O-CG2 3.25Å; T239-V243 WeakPolarHBondContact O-CG2 3.25Å; T239-V243 PolarHBondContact O-N 3.44Å; T239-I296 HydrophobicContact CG2-CG2 4.05Å; T239-V300 HydrophobicContact CG2-CG2 4.2Å
240I89.4Confident86.1Confident1 Ų143.9 Ų43.91%0.00521%0.212CC..Hα-helixtrans-58.1-46.3177.5-63.5164.6000110.6I119 L236 I237 V243 Y244 I296 Y297I119-I240 HydrophobicContact CD1-CG2 4.09Å; I119-I240 HydrophobicContact CG1-CG2 4.03Å; L236-I240 HydrophobicContact CD1-CD1 4.42Å; L236-I240 HydrophobicContact CG-CD1 4.19Å; L236-I240 WeakPolarHBondContact O-CG1 3.31Å; L236-I240 PolarHBondContact O-N 3.35Å; L236-I240 VanDerWaalsContact O-N 3.08Å; I237-I240 HydrophobicContact CD1-CD1 3.89Å; I237-I240 PolarHBondContact O-N 3.16Å; I240-V243 PolarHBondContact O-N 3.38Å; I240-Y244 WeakPolarHBondContact O-CB 3.3Å; I240-Y244 PolarHBondContact O-N 3.03Å; I240-I296 HydrophobicContact CG1-CD1 4.3Å; I240-I296 HydrophobicContact CG1-CG2 3.88Å; I240-Y297 HydrophobicContact CD1-CE1 3.62Å; I240-Y297 HydrophobicContact CG1-CE1 4.41Å
241M89.6Confident87.5Confident0 Ų042.3 Ų42.30%021%0.206CC..Hα-helixtrans-64.1-45.4-179.7-174.567.177.200112.7I119 T123 P206 M210 I237 F238 T239 Y244 F245I119-M241 HydrophobicContact CG2-CE 3.46Å; I119-M241 VanDerWaalsContact CG2-CE 3.46Å; I119-M241 HydrophobicContact CG2-SD 3.68Å; T123-M241 HydrophobicContact CG2-CE 4.34Å; T123-M241 WeakPolarHBondContact OG1-CE 3.29Å; P206-M241 HydrophobicContact CB-SD 4.33Å; M210-M241 HydrophobicContact CB-CG 4.44Å; M210-M241 HydrophobicContact CE-CG 4.48Å; M210-M241 HydrophobicContact CG-CG 4.18Å; M210-M241 HydrophobicContact SD-CG 3.98Å; I237-M241 PolarHBondContact O-N 3.12Å; F238-M241 PolarHBondContact O-N 3.35Å; T239-M241 VanDerWaalsContact C-N 3.32Å; T239-M241 PolarHBondContact O-N 2.9Å; M241-Y244 WeakPolarHBondContact O-CB 3.32Å; M241-Y244 PolarHBondContact O-N 2.85Å; M241-F245 HydrophobicContact CG-CD2 4.1Å; M241-F245 HydrophobicContact CG-CE2 3.61Å; M241-F245 WeakPolarHBondContact O-CD2 3.46Å; M241-F245 PolarHBondContact O-N 3.46Å; M241-F245 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact SD-CD2 4.39Å; M241-F245 HydrophobicContact SD-CE2 3.61Å; M241-F245 HydrophobicContact SD-CZ 4.05Å
242I93.1Very high88.8Confident57 Ų5738.6 Ų38.629%0.29219%0.189SC..Hα-helixtrans-63.9-45.3178.1-71.2172.8000110.8M210 F238 T239 Y244 F245 L246M210-I242 HydrophobicContact CE-CG1 3.88Å; F238-I242 HydrophobicContact CD1-CD1 3.65Å; F238-I242 HydrophobicContact CD2-CD1 4.26Å; F238-I242 HydrophobicContact CE1-CD1 3.19Å; F238-I242 HydrophobicContact CE1-CG1 4.39Å; F238-I242 HydrophobicContact CE2-CD1 3.88Å; F238-I242 HydrophobicContact CE2-CG1 4.4Å; F238-I242 HydrophobicContact CG-CD1 4.19Å; F238-I242 HydrophobicContact CZ-CD1 3.35Å; F238-I242 HydrophobicContact CZ-CG1 4.31Å; F238-I242 WeakPolarHBondContact O-CG1 3.26Å; F238-I242 PolarHBondContact O-N 3.3Å; T239-I242 PolarHBondContact O-N 2.81Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 2.85Å; I242-F245 PolarHBondContact O-N 2.78Å; I242-F245 VanDerWaalsContact O-N 3.1Å; I242-L246 HydrophobicContact CG2-CD1 3.92Å; I242-L246 HydrophobicContact CG2-CG 4.14Å; I242-L246 WeakPolarHBondContact O-CG 3.48Å; I242-L246 PolarHBondContact O-N 2.9Å
243V94.9Very high89.9Confident23 Ų2336.9 Ų36.914%0.13919%0.188CC..Hα-helixtrans-62-38.9179.8172.10000110.7T239 I240 F245 L246 F247 I292 I296T239-V243 HydrophobicContact CG2-CG2 4.15Å; T239-V243 WeakPolarHBondContact O-CB 3.46Å; T239-V243 VanDerWaalsContact O-CG2 3.25Å; T239-V243 WeakPolarHBondContact O-CG2 3.25Å; T239-V243 PolarHBondContact O-N 3.44Å; I240-V243 PolarHBondContact O-N 3.38Å; V243-F245 PolarHBondContact O-N 3.4Å; V243-L246 PolarHBondContact O-N 3.26Å; V243-F247 HydrophobicContact CG1-CD2 3.89Å; V243-F247 HydrophobicContact CG1-CE2 3.85Å; V243-F247 WeakPolarHBondContact O-CD2 3.25Å; V243-F247 PolarHBondContact O-N 3.27Å; V243-F247 VanDerWaalsContact O-N 3.13Å; V243-I292 HydrophobicContact CG1-CG2 3.69Å; V243-I296 HydrophobicContact CB-CD1 3.92Å; V243-I296 HydrophobicContact CG1-CD1 3.95Å; V243-I296 HydrophobicContact CG2-CD1 4.02Å
244Y93.8Very high91.2Very high4 Ų436 Ų362%0.01618%0.179CC..Hα-helixtrans-55.5-49.6171.4172.9-90.4000111.9I116 I119 G202 P206 I240 M241 I242 L246 F247 W248 H289I116-Y244 HydrophobicContact CB-CE2 4.05Å; I116-Y244 HydrophobicContact CD1-CD1 3.68Å; I116-Y244 HydrophobicContact CD1-CD2 4.18Å; I116-Y244 HydrophobicContact CD1-CE1 3.32Å; I116-Y244 HydrophobicContact CD1-CE2 3.84Å; I116-Y244 HydrophobicContact CD1-CG 4.11Å; I116-Y244 HydrophobicContact CG1-CE1 3.98Å; I116-Y244 HydrophobicContact CG1-CE2 4.25Å; I119-Y244 HydrophobicContact CD1-CD2 3.95Å; I119-Y244 HydrophobicContact CD1-CG 4.2Å; G202-Y244 VanDerWaalsContact O-CE1 3.29Å; G202-Y244 WeakPolarHBondContact O-CE1 3.3Å; G202-Y244 PolarHBondContact O-OH 3.28Å; P206-Y244 HydrophobicContact CG-CE1 4.49Å; I240-Y244 WeakPolarHBondContact O-CB 3.3Å; I240-Y244 PolarHBondContact O-N 3.03Å; M241-Y244 WeakPolarHBondContact O-CB 3.32Å; M241-Y244 PolarHBondContact O-N 2.85Å; I242-Y244 VanDerWaalsContact C-N 3.27Å; I242-Y244 PolarHBondContact O-N 2.85Å; Y244-L246 PolarHBondContact O-N 2.93Å; Y244-F247 PolarHBondContact O-N 3.5Å; Y244-W248 AromaticContact CD2-CD1 3.52Å; Y244-W248 HydrophobicContact CD2-CG 4.29Å; Y244-W248 HydrophobicContact CE1-CB 4.29Å; Y244-W248 HydrophobicContact CE2-CB 4.13Å; Y244-W248 AromaticContact CE2-CD1 3.39Å; Y244-W248 AromaticContact CE2-CG 3.83Å; Y244-W248 HydrophobicContact CE2-CG 3.83Å; Y244-W248 WeakPolarHBondContact O-CB 3.4Å; Y244-W248 PolarHBondContact O-N 2.69Å; Y244-H289 WeakPolarHBondContact CA-NE2 3.34Å; Y244-H289 AromaticContact CD2-CE1 3.9Å
245F94.9Very high91.9Very high25 Ų2536.1 Ų36.111%0.1118%0.179CC..Hα-helixtrans-64.2-39.3178.4-71.9-58.6000113.1L203 P206 L207 M210 M241 I242 V243 F247 A249L203-F245 HydrophobicContact CD1-CD1 3.8Å; L203-F245 HydrophobicContact CD1-CE1 3.88Å; P206-F245 HydrophobicContact CB-CE1 4.26Å; P206-F245 HydrophobicContact CB-CZ 3.84Å; P206-F245 HydrophobicContact CG-CE1 4.02Å; P206-F245 HydrophobicContact CG-CZ 4.09Å; L207-F245 HydrophobicContact CB-CE1 4.34Å; L207-F245 HydrophobicContact CB-CZ 4.09Å; L207-F245 HydrophobicContact CD1-CE2 4.49Å; L207-F245 HydrophobicContact CD1-CZ 4.25Å; M210-F245 HydrophobicContact SD-CD2 4.04Å; M210-F245 HydrophobicContact SD-CE2 3.55Å; M210-F245 VanDerWaalsContact SD-CE2 3.55Å; M241-F245 HydrophobicContact CG-CD2 4.1Å; M241-F245 HydrophobicContact CG-CE2 3.61Å; M241-F245 WeakPolarHBondContact O-CD2 3.46Å; M241-F245 PolarHBondContact O-N 3.46Å; M241-F245 VanDerWaalsContact O-N 3.16Å; M241-F245 HydrophobicContact SD-CD2 4.39Å; M241-F245 HydrophobicContact SD-CE2 3.61Å; M241-F245 HydrophobicContact SD-CZ 4.05Å; I242-F245 PolarHBondContact O-N 2.78Å; I242-F245 VanDerWaalsContact O-N 3.1Å; V243-F245 PolarHBondContact O-N 3.4Å; F245-F247 PolarHBondContact O-N 3.29Å; F245-A249 WeakPolarHBondContact O-CA 3.38Å; F245-A249 WeakPolarHBondContact O-CB 3.46Å; F245-A249 PolarHBondContact O-N 2.89Å
246L96Very high92.5Very high110 Ų11032.7 Ų32.758%0.57617%0.17SC*.Hα-helixtrans-60-34.4177.3-70.8174.7000112.2I242 V243 Y244 P250I242-L246 HydrophobicContact CG2-CD1 3.92Å; I242-L246 HydrophobicContact CG2-CG 4.14Å; I242-L246 WeakPolarHBondContact O-CG 3.48Å; I242-L246 PolarHBondContact O-N 2.9Å; V243-L246 PolarHBondContact O-N 3.26Å; Y244-L246 PolarHBondContact O-N 2.93Å; L246-P250 WeakPolarHBondContact O-CG 3.06Å
247F95.6Very high93Very high39 Ų3933.6 Ų33.617%0.17118%0.175CC..Hα-helixtrans-90-39.1-177.1-78.5-116.4000112.6V243 Y244 F245 L285 T288 H289 I292V243-F247 HydrophobicContact CG1-CD2 3.89Å; V243-F247 HydrophobicContact CG1-CE2 3.85Å; V243-F247 WeakPolarHBondContact O-CD2 3.25Å; V243-F247 PolarHBondContact O-N 3.27Å; V243-F247 VanDerWaalsContact O-N 3.13Å; Y244-F247 PolarHBondContact O-N 3.5Å; F245-F247 PolarHBondContact O-N 3.29Å; F247-L285 HydrophobicContact CD1-CD1 3.93Å; F247-L285 HydrophobicContact CD1-CG 4.21Å; F247-L285 VanDerWaalsContact CD1-O 3.3Å; F247-L285 WeakPolarHBondContact CD1-O 3.29Å; F247-L285 HydrophobicContact CE1-CD1 4.01Å; F247-L285 HydrophobicContact CG-CD1 4.42Å; F247-L285 HydrophobicContact CG-CG 4.44Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.4Å; F247-T288 VanDerWaalsContact CE1-OG1 3.26Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.26Å; F247-H289 HydrophobicContact CB-CB 3.94Å; F247-H289 HydrophobicContact CD1-CB 3.93Å; F247-H289 HydrophobicContact CG-CB 4.17Å; F247-I292 HydrophobicContact CE1-CD1 4.21Å; F247-I292 HydrophobicContact CE1-CG1 3.77Å; F247-I292 HydrophobicContact CZ-CD1 4.11Å; F247-I292 HydrophobicContact CZ-CG1 3.85Å
248W95.8Very high93.3Very high10 Ų1034.6 Ų34.64%0.03818%0.181CC..Hα-helixtrans-102-27.9-172.5-76.1103.8000115.1F79 F112 Y244 P250 Y251 N252 G286 H289F79-W248 HydrophobicContact CE2-CH2 4.31Å; F79-W248 HydrophobicContact CE2-CZ2 4.37Å; F79-W248 HydrophobicContact CZ-CH2 4.26Å; F79-W248 HydrophobicContact CZ-CZ2 4.25Å; F112-W248 HydrophobicContact CD2-CD2 4.14Å; F112-W248 AromaticContact CD2-CE3 3.99Å; F112-W248 HydrophobicContact CD2-CE3 3.99Å; F112-W248 AromaticContact CD2-CH2 3.61Å; F112-W248 HydrophobicContact CD2-CH2 3.61Å; F112-W248 AromaticContact CD2-CZ2 3.78Å; F112-W248 HydrophobicContact CD2-CZ2 3.78Å; F112-W248 AromaticContact CD2-CZ3 3.73Å; F112-W248 HydrophobicContact CD2-CZ3 3.73Å; F112-W248 AromaticContact CE2-CD2 3.69Å; F112-W248 HydrophobicContact CE2-CD2 3.69Å; F112-W248 AromaticContact CE2-CE3 3.46Å; F112-W248 HydrophobicContact CE2-CE3 3.46Å; F112-W248 VanDerWaalsContact CE2-CE3 3.46Å; F112-W248 HydrophobicContact CE2-CG 4.36Å; F112-W248 AromaticContact CE2-CH2 3.98Å; F112-W248 HydrophobicContact CE2-CH2 3.98Å; F112-W248 HydrophobicContact CE2-CZ2 4.2Å; F112-W248 AromaticContact CE2-CZ3 3.61Å; F112-W248 HydrophobicContact CE2-CZ3 3.61Å; F112-W248 HydrophobicContact CZ-CE3 4.47Å; Y244-W248 AromaticContact CD2-CD1 3.52Å; Y244-W248 HydrophobicContact CD2-CG 4.29Å; Y244-W248 HydrophobicContact CE1-CB 4.29Å; Y244-W248 HydrophobicContact CE2-CB 4.13Å; Y244-W248 AromaticContact CE2-CD1 3.39Å; Y244-W248 AromaticContact CE2-CG 3.83Å; Y244-W248 HydrophobicContact CE2-CG 3.83Å; Y244-W248 WeakPolarHBondContact O-CB 3.4Å; Y244-W248 PolarHBondContact O-N 2.69Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; W248-Y251 HydrophobicContact CE3-CD1 4.11Å; W248-Y251 HydrophobicContact CZ3-CD1 4.11Å; W248-Y251 PolarHBondContact O-N 3.45Å; W248-N252 PolarHBondContact O-N 3.38Å; W248-N252 VanDerWaalsContact O-N 3.1Å; W248-N252 PolarHBondContact O-ND2 3.03Å; W248-G286 VanDerWaalsContact CZ2-O 3.24Å; W248-G286 WeakPolarHBondContact CZ2-O 3.26Å; W248-H289 AromaticContact CD1-CG 3.87Å; W248-H289 AromaticContact NE1-CG 3.54Å; W248-H289 AromaticContact NE1-ND1 3.59Å
249A94.8Very high93.5Very high18 Ų1831.1 Ų31.115%0.14917%0.166CC..Hα-helixtrans-60.4-40.3178.900000112.9L203 F245 Y251 N252 I253L203-A249 HydrophobicContact CD1-CB 3.76Å; F245-A249 WeakPolarHBondContact O-CA 3.38Å; F245-A249 WeakPolarHBondContact O-CB 3.46Å; F245-A249 PolarHBondContact O-N 2.89Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 2.94Å; A249-N252 PolarHBondContact O-N 2.63Å; A249-I253 WeakPolarHBondContact O-CD1 3.45Å; A249-I253 VanDerWaalsContact O-CG1 3.26Å; A249-I253 WeakPolarHBondContact O-CG1 3.07Å; A249-I253 PolarHBondContact O-N 2.91Å
250P96.8Very high93.5Very high42 Ų4232 Ų3227%0.27317%0.166SC..Hα-helixtrans-55.3-45.4176-26.936.2000112.5L246 W248 I253 V254 T282 L285L246-P250 WeakPolarHBondContact O-CG 3.06Å; W248-P250 VanDerWaalsContact C-CD 3.48Å; P250-I253 PolarHBondContact O-N 2.87Å; P250-V254 VanDerWaalsContact O-CG2 3.32Å; P250-V254 WeakPolarHBondContact O-CG2 3.17Å; P250-V254 PolarHBondContact O-N 3.24Å; P250-T282 HydrophobicContact CB-CG2 3.57Å; P250-L285 HydrophobicContact CG-CD2 4.31Å
251Y95.3Very high93.3Very high24 Ų2433.4 Ų33.49%0.09417%0.173CC..Hα-helixtrans-63.8-46.1178174-103.5000111.9W248 A249 I253 V254 L255 M279 E283W248-Y251 HydrophobicContact CE3-CD1 4.11Å; W248-Y251 HydrophobicContact CZ3-CD1 4.11Å; W248-Y251 PolarHBondContact O-N 3.45Å; A249-Y251 VanDerWaalsContact C-N 3.31Å; A249-Y251 PolarHBondContact O-N 2.94Å; Y251-I253 VanDerWaalsContact C-N 3.3Å; Y251-I253 PolarHBondContact O-N 3.04Å; Y251-V254 PolarHBondContact O-N 3.49Å; Y251-L255 HydrophobicContact CE1-CD2 4.24Å; Y251-L255 VanDerWaalsContact O-CB 3.27Å; Y251-L255 WeakPolarHBondContact O-CB 3.24Å; Y251-L255 PolarHBondContact O-N 3.04Å; Y251-M279 HydrophobicContact CE2-CG 4.29Å; Y251-E283 HydrophobicContact CD2-CB 3.67Å; Y251-E283 HydrophobicContact CD2-CG 4.34Å; Y251-E283 HydrophobicContact CE2-CB 3.71Å; Y251-E283 HydrophobicContact CE2-CG 4.02Å
252N95.1Very high93Very high1 Ų141.3 Ų41.31%0.00521%0.21CC..Hα-helixtrans-61.5-38.5179.1-77.3-86.7000112.3I198 V199 L203 W248 A249 L256I198-N252 WeakPolarHBondContact CG2-OD1 3.35Å; I198-N252 PolarHBondContact O-OD1 3.04Å; V199-N252 HydrophobicContact CG2-CB 4.45Å; L203-N252 HydrophobicContact CB-CB 4.22Å; L203-N252 HydrophobicContact CD2-CB 4Å; W248-N252 PolarHBondContact O-N 3.38Å; W248-N252 VanDerWaalsContact O-N 3.1Å; W248-N252 PolarHBondContact O-ND2 3.03Å; A249-N252 PolarHBondContact O-N 2.63Å; N252-L256 PolarHBondContact O-N 2.88Å; N252-L256 VanDerWaalsContact O-N 3.11Å
253I95Very high92.6Very high90 Ų9046.8 Ų46.846%0.46223%0.232SC..Hα-helixtrans-67.2-47.3176.5-66.4163.8000110.3A249 P250 Y251 L255 L256 L257A249-I253 WeakPolarHBondContact O-CD1 3.45Å; A249-I253 VanDerWaalsContact O-CG1 3.26Å; A249-I253 WeakPolarHBondContact O-CG1 3.07Å; A249-I253 PolarHBondContact O-N 2.91Å; P250-I253 PolarHBondContact O-N 2.87Å; Y251-I253 VanDerWaalsContact C-N 3.3Å; Y251-I253 PolarHBondContact O-N 3.04Å; I253-L255 VanDerWaalsContact C-N 3.33Å; I253-L255 PolarHBondContact O-N 3.45Å; I253-L256 WeakPolarHBondContact O-CB 3.32Å; I253-L256 PolarHBondContact O-N 3.24Å; I253-L257 HydrophobicContact CG2-CD1 4.23Å; I253-L257 WeakPolarHBondContact O-CG 3.31Å; I253-L257 PolarHBondContact O-N 3.49Å
254V94.6Very high92.1Very high16 Ų1650.2 Ų50.210%0.09725%0.245CC..Hα-helixtrans-65.2-38.1178.9175.90000111.4P250 Y251 L256 L257 N258 A278 M279 T282P250-V254 VanDerWaalsContact O-CG2 3.32Å; P250-V254 WeakPolarHBondContact O-CG2 3.17Å; P250-V254 PolarHBondContact O-N 3.24Å; Y251-V254 PolarHBondContact O-N 3.49Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 2.86Å; V254-L257 PolarHBondContact O-N 2.87Å; V254-N258 VanDerWaalsContact O-CB 3.28Å; V254-N258 WeakPolarHBondContact O-CB 3.45Å; V254-N258 PolarHBondContact O-N 2.96Å; V254-A278 HydrophobicContact CG1-CB 4.08Å; V254-A278 HydrophobicContact CG2-CB 4.15Å; V254-M279 HydrophobicContact CG1-CB 3.87Å; V254-T282 HydrophobicContact CG2-CG2 4.1Å
255L93.4Very high91.5Very high18 Ų1852.2 Ų52.29%0.09427%0.267CS..Hα-helixtrans-60.8-40.6174.8-177.966.7000111.8T195 I198 Y251 I253 N258 T259T195-L255 HydrophobicContact CG2-CD2 4.41Å; T195-L255 HydrophobicContact CG2-CG 4.06Å; I198-L255 HydrophobicContact CB-CD2 4.04Å; I198-L255 HydrophobicContact CD1-CD2 3.98Å; I198-L255 HydrophobicContact CG2-CD2 3.79Å; Y251-L255 HydrophobicContact CE1-CD2 4.24Å; Y251-L255 VanDerWaalsContact O-CB 3.27Å; Y251-L255 WeakPolarHBondContact O-CB 3.24Å; Y251-L255 PolarHBondContact O-N 3.04Å; I253-L255 VanDerWaalsContact C-N 3.33Å; I253-L255 PolarHBondContact O-N 3.45Å; L255-N258 PolarHBondContact O-N 3.33Å; L255-T259 WeakPolarHBondContact O-CB 3.42Å; L255-T259 PolarHBondContact O-N 3.29Å; L255-T259 PolarHBondContact O-OG1 3.28Å
256L93.8Very high90.8Very high53 Ų5353.3 Ų53.328%0.27727%0.274SS..Hα-helixtrans-63.6-48.8174.6-169.875.4000111T195 V199 N252 I253 V254 N258 T259 F260T195-L256 HydrophobicContact CG2-CD1 4.34Å; V199-L256 HydrophobicContact CG2-CB 4.46Å; V199-L256 HydrophobicContact CG2-CD1 4.41Å; N252-L256 PolarHBondContact O-N 2.88Å; N252-L256 VanDerWaalsContact O-N 3.11Å; I253-L256 WeakPolarHBondContact O-CB 3.32Å; I253-L256 PolarHBondContact O-N 3.24Å; V254-L256 VanDerWaalsContact C-N 3.31Å; V254-L256 PolarHBondContact O-N 2.86Å; L256-N258 VanDerWaalsContact C-N 3.32Å; L256-N258 PolarHBondContact O-N 2.81Å; L256-T259 PolarHBondContact O-N 3.07Å; L256-F260 HydrophobicContact CD1-CD2 3.71Å; L256-F260 HydrophobicContact CD1-CE2 3.58Å; L256-F260 HydrophobicContact CG-CD2 4.09Å; L256-F260 HydrophobicContact CG-CE2 4.46Å; L256-F260 WeakPolarHBondContact O-CD2 3.48Å; L256-F260 PolarHBondContact O-N 2.03Å
257L92.3Very high89.9Confident50 Ų5053.1 Ų53.126%0.26227%0.274SS..Hα-helixtrans-60.3-40.7177.1-68.8173.2000112.1I253 V254 T259 F260 Q261 F264 L266 L275I253-L257 HydrophobicContact CG2-CD1 4.23Å; I253-L257 WeakPolarHBondContact O-CG 3.31Å; I253-L257 PolarHBondContact O-N 3.49Å; V254-L257 PolarHBondContact O-N 2.87Å; L257-T259 VanDerWaalsContact C-N 3.32Å; L257-T259 PolarHBondContact O-N 3.15Å; L257-F260 CarbonylContact O-C 3.54Å; L257-Q261 WeakPolarHBondContact O-CA 3.2Å; L257-Q261 VanDerWaalsContact O-CG 3.24Å; L257-Q261 WeakPolarHBondContact O-CG 3.36Å; L257-Q261 PolarHBondContact O-N 3.07Å; L257-F264 HydrophobicContact CD2-CD1 4.43Å; L257-F264 HydrophobicContact CD2-CD2 3.73Å; L257-F264 HydrophobicContact CD2-CE2 3.84Å; L257-F264 HydrophobicContact CD2-CG 4.05Å; L257-F264 HydrophobicContact CD2-CZ 4.24Å; L257-L266 HydrophobicContact CD2-CD1 4.47Å; L257-L275 HydrophobicContact CB-CD2 3.97Å; L257-L275 HydrophobicContact CD1-CD2 4.44Å
258N89.6Confident89.3Confident26 Ų2655.8 Ų55.814%0.13929%0.289CS..Hα-helixtrans-68.6-30178.1-172.454000112.8V254 L255 L256 Q261V254-N258 VanDerWaalsContact O-CB 3.28Å; V254-N258 WeakPolarHBondContact O-CB 3.45Å; V254-N258 PolarHBondContact O-N 2.96Å; L255-N258 PolarHBondContact O-N 3.33Å; L256-N258 VanDerWaalsContact C-N 3.32Å; L256-N258 PolarHBondContact O-N 2.81Å; N258-Q261 WeakPolarHBondContact O-CG 3.41Å; N258-Q261 PolarHBondContact OD1-NE2 3.23Å
259T89.5Confident88.5Confident9 Ų958.9 Ų58.96%0.05531%0.312CS..Hα-helixtrans-78.9-39.4178.3-58.70000111.7K191 T195 L255 L256 L257K191-T259 HydrophobicContact CD-CG2 4.47Å; K191-T259 HydrophobicContact CG-CG2 4.2Å; T195-T259 WeakPolarHBondContact CB-OG1 3.5Å; T195-T259 HydrophobicContact CG2-CG2 4.14Å; T195-T259 WeakPolarHBondContact CG2-OG1 3.4Å; T195-T259 PolarHBondContact OG1-OG1 3.29Å; L255-T259 WeakPolarHBondContact O-CB 3.42Å; L255-T259 PolarHBondContact O-N 3.29Å; L255-T259 PolarHBondContact O-OG1 3.28Å; L256-T259 PolarHBondContact O-N 3.07Å; L257-T259 VanDerWaalsContact C-N 3.32Å; L257-T259 PolarHBondContact O-N 3.15Å
260F89.5Confident87.9Confident55 Ų5561.7 Ų61.724%0.24133%0.33CS..SBendtrans-106.637.2-175.9-60.7-71.8000112.6L196 L256 L257 E262 F263 F264L196-F260 HydrophobicContact CD2-CE2 4.41Å; L196-F260 HydrophobicContact CD2-CZ 4.45Å; L256-F260 HydrophobicContact CD1-CD2 3.71Å; L256-F260 HydrophobicContact CD1-CE2 3.58Å; L256-F260 HydrophobicContact CG-CD2 4.09Å; L256-F260 HydrophobicContact CG-CE2 4.46Å; L256-F260 WeakPolarHBondContact O-CD2 3.48Å; L256-F260 PolarHBondContact O-N 2.03Å; L257-F260 CarbonylContact O-C 3.54Å; F260-E262 VanDerWaalsContact C-N 3.29Å; F260-E262 PolarHBondContact O-N 2.67Å; F260-F263 HydrophobicContact CB-CB 4.24Å; F260-F263 WeakPolarHBondContact O-CB 3.31Å; F260-F263 PolarHBondContact O-N 3.11Å; F260-F263 VanDerWaalsContact O-N 3.13Å; F260-F264 HydrophobicContact CB-CD2 4.09Å; F260-F264 HydrophobicContact CB-CE2 3.97Å; F260-F264 VanDerWaalsContact O-CD2 3.23Å; F260-F264 WeakPolarHBondContact O-CD2 3.23Å; F260-F264 PolarHBondContact O-N 3.09Å
261Q86.1Confident87.2Confident32 Ų3261.1 Ų61.115%0.1533%0.328CS..THydrogen-bonded Turntrans-55.7-41.4-178-73.6174.1-35.100112.8L257 N258 F263 F264 G265 L266 L275L257-Q261 WeakPolarHBondContact O-CA 3.2Å; L257-Q261 VanDerWaalsContact O-CG 3.24Å; L257-Q261 WeakPolarHBondContact O-CG 3.36Å; L257-Q261 PolarHBondContact O-N 3.07Å; N258-Q261 WeakPolarHBondContact O-CG 3.41Å; N258-Q261 PolarHBondContact OD1-NE2 3.23Å; Q261-F263 VanDerWaalsContact C-N 3.35Å; Q261-F263 PolarHBondContact O-N 3.04Å; Q261-F264 CarbonylContact O-C 3.58Å; Q261-F264 PolarHBondContact O-N 3.45Å; Q261-G265 PolarHBondContact O-N 2.84Å; Q261-L266 HydrophobicContact CB-CB 4.35Å; Q261-L266 HydrophobicContact CG-CB 4.47Å; Q261-L266 PolarHBondContact O-N 2.95Å; Q261-L275 HydrophobicContact CG-CD1 3.78Å; Q261-L275 VanDerWaalsContact NE2-CD1 3.34Å
262E82.6Confident86.6Confident165 Ų16561.2 Ų61.277%0.77133%0.331SS*.THydrogen-bonded Turntrans-62.6-41.7178.7-67.5176.5-172.800111.8F260 F264 G265F260-E262 VanDerWaalsContact C-N 3.29Å; F260-E262 PolarHBondContact O-N 2.67Å; E262-F264 VanDerWaalsContact C-N 3.32Å; E262-F264 PolarHBondContact O-N 3.11Å; E262-G265 PolarHBondContact O-N 3.07Å
263F85.8Confident86Confident172 Ų17263 Ų6375%0.75434%0.341SS*.THydrogen-bonded Turntrans-65.5-35.9178.9-174.9-95.7000112.2F260 Q261F260-F263 HydrophobicContact CB-CB 4.24Å; F260-F263 WeakPolarHBondContact O-CB 3.31Å; F260-F263 PolarHBondContact O-N 3.11Å; F260-F263 VanDerWaalsContact O-N 3.13Å; Q261-F263 VanDerWaalsContact C-N 3.35Å; Q261-F263 PolarHBondContact O-N 3.04Å
264F84.5Confident85.5Confident96 Ų9667.7 Ų67.742%0.42135%0.353SS..THydrogen-bonded Turntrans-89.32178.1-67.4-67.3000114.1L257 F260 Q261 E262 L266L257-F264 HydrophobicContact CD2-CD1 4.43Å; L257-F264 HydrophobicContact CD2-CD2 3.73Å; L257-F264 HydrophobicContact CD2-CE2 3.84Å; L257-F264 HydrophobicContact CD2-CG 4.05Å; L257-F264 HydrophobicContact CD2-CZ 4.24Å; F260-F264 HydrophobicContact CB-CD2 4.09Å; F260-F264 HydrophobicContact CB-CE2 3.97Å; F260-F264 VanDerWaalsContact O-CD2 3.23Å; F260-F264 WeakPolarHBondContact O-CD2 3.23Å; F260-F264 PolarHBondContact O-N 3.09Å; Q261-F264 CarbonylContact O-C 3.58Å; Q261-F264 PolarHBondContact O-N 3.45Å; E262-F264 VanDerWaalsContact C-N 3.32Å; E262-F264 PolarHBondContact O-N 3.11Å; F264-L266 VanDerWaalsContact C-N 3.31Å; F264-L266 HydrophobicContact CB-CD1 3.95Å; F264-L266 HydrophobicContact CB-CG 4.02Å; F264-L266 PolarHBondContact O-N 2.9Å
265G80.2Confident85.1Confident46 Ų4667.8 Ų67.847%0.47435%0.353SS..THydrogen-bonded Turntrans66.628.5-177.700000114.3Q261 E262Q261-G265 PolarHBondContact O-N 2.84Å; E262-G265 PolarHBondContact O-N 3.07Å
266L80.9Confident84.6Confident48 Ų4868.1 Ų68.125%0.25136%0.355SS..  trans-10218.1-177-61.6175000113.4L257 Q261 F264 N268 S271 L275L257-L266 HydrophobicContact CD2-CD1 4.47Å; Q261-L266 HydrophobicContact CB-CB 4.35Å; Q261-L266 HydrophobicContact CG-CB 4.47Å; Q261-L266 PolarHBondContact O-N 2.95Å; F264-L266 VanDerWaalsContact C-N 3.31Å; F264-L266 HydrophobicContact CB-CD1 3.95Å; F264-L266 HydrophobicContact CB-CG 4.02Å; F264-L266 PolarHBondContact O-N 2.9Å; L266-N268 PolarHBondContact O-N 2.62Å; L266-S271 WeakPolarHBondContact O-CB 3.48Å; L266-L275 HydrophobicContact CB-CD1 3.98Å; L266-L275 HydrophobicContact CD1-CD1 3.93Å; L266-L275 HydrophobicContact CD1-CD2 4.5Å
267N76.3Confident84.2Confident106 Ų10669.5 Ų69.557%0.56736%0.36SS*.  trans-760.1-175.963.6-20.9000115
268N83.2Confident84.1Confident94 Ų9468.9 Ų68.950%0.50336%0.362SS..SBendtrans-72.6142.3174.6-64-33.6000111.3L266 S270 S271 S272L266-N268 PolarHBondContact O-N 2.62Å; N268-S270 VanDerWaalsContact C-N 3.26Å; N268-S270 PolarHBondContact O-N 3.01Å; N268-S271 PolarHBondContact O-N 3.5Å; N268-S272 PolarHBondContact O-N 3.49Å
269C79.9Confident84.1Confident75 Ų7569.7 Ų69.751%0.50737%0.365SS..Hα-helixtrans-57.5-35.7-179.3164.10000112.8C20 N273C20-C269 HydrophobicContact CB-CB 4.09Å; C20-C269 WeakPolarHBondContact CB-SG 3.49Å; C20-C269 WeakPolarHBondContact SG-CB 3.34Å; C20-C269 PolarHBondContact SG-O 3.22Å; C20-C269 CovalentContact SG-SG 2.07Å; C20-C269 PolarHBondContact SG-SG 3.35Å; C269-N273 VanDerWaalsContact O-CB 3.31Å; C269-N273 WeakPolarHBondContact O-CB 3.32Å; C269-N273 PolarHBondContact O-N 2.69Å
270S81.8Confident84Confident77 Ų7772.3 Ų72.354%0.53838%0.377SS..Hα-helixtrans-64.5-42.8174.558.60000112.8N268 R274N268-S270 VanDerWaalsContact C-N 3.26Å; N268-S270 PolarHBondContact O-N 3.01Å; S270-R274 WeakPolarHBondContact O-CG 3.25Å; S270-R274 PolarHBondContact O-N 2.83Å
271S83Confident84Confident31 Ų3174.5 Ų74.522%0.21740%0.395CS..Hα-helixtrans-69-43.3176.7-63.20000111.9L266 N268 N273 R274 L275L266-S271 WeakPolarHBondContact O-CB 3.48Å; N268-S271 PolarHBondContact O-N 3.5Å; S271-N273 VanDerWaalsContact C-N 3.35Å; S271-N273 PolarHBondContact O-N 2.8Å; S271-R274 PolarHBondContact O-N 2.87Å; S271-L275 WeakPolarHBondContact O-CG 3.44Å; S271-L275 PolarHBondContact O-N 3.33Å
272S81.3Confident84.4Confident25 Ų2573.9 Ų73.918%0.17539%0.393CS..Hα-helixtrans-59.9-44.5175-174.90000111.3N268 R274 L275 D276N268-S272 PolarHBondContact O-N 3.49Å; S272-R274 VanDerWaalsContact C-N 3.33Å; S272-R274 PolarHBondContact O-N 3.2Å; S272-L275 WeakPolarHBondContact O-CB 3.45Å; S272-L275 PolarHBondContact O-N 3.44Å; S272-L275 VanDerWaalsContact O-N 3.13Å; S272-D276 VanDerWaalsContact O-CG 3.31Å; S272-D276 PolarHBondContact O-N 3.45Å
273N82.6Confident84.9Confident38 Ų3868.2 Ų68.220%0.20337%0.366CS..Hα-helixtrans-63.9-38.5179.3-167.121.9000111.9C269 S271 D276 Q277C269-N273 VanDerWaalsContact O-CB 3.31Å; C269-N273 WeakPolarHBondContact O-CB 3.32Å; C269-N273 PolarHBondContact O-N 2.69Å; S271-N273 VanDerWaalsContact C-N 3.35Å; S271-N273 PolarHBondContact O-N 2.8Å; N273-D276 PolarHBondContact O-N 2.88Å; N273-Q277 WeakPolarHBondContact O-CG 3.12Å; N273-Q277 PolarHBondContact O-N 3.5Å; N273-Q277 VanDerWaalsContact O-N 3.09Å
274R85.6Confident85.1Confident189 Ų18960.6 Ų60.671%0.71333%0.334SS*.Hα-helixtrans-65.4-38.8172.7-70.8179.3-172-157.23.2112.1S270 S271 S272 Q277 A278S270-R274 WeakPolarHBondContact O-CG 3.25Å; S270-R274 PolarHBondContact O-N 2.83Å; S271-R274 PolarHBondContact O-N 2.87Å; S272-R274 VanDerWaalsContact C-N 3.33Å; S272-R274 PolarHBondContact O-N 3.2Å; R274-Q277 PolarHBondContact O-N 3.09Å; R274-A278 WeakPolarHBondContact O-CB 3.05Å; R274-A278 PolarHBondContact O-N 3.34Å
275L86.3Confident85.6Confident18 Ų1859.1 Ų59.19%0.09433%0.33CS..Hα-helixtrans-65.5-40.9175.9-79.2171.5000111.9L257 Q261 L266 S271 S272 Q277 A278 M279L257-L275 HydrophobicContact CB-CD2 3.97Å; L257-L275 HydrophobicContact CD1-CD2 4.44Å; Q261-L275 HydrophobicContact CG-CD1 3.78Å; Q261-L275 VanDerWaalsContact NE2-CD1 3.34Å; L266-L275 HydrophobicContact CB-CD1 3.98Å; L266-L275 HydrophobicContact CD1-CD1 3.93Å; L266-L275 HydrophobicContact CD1-CD2 4.5Å; S271-L275 WeakPolarHBondContact O-CG 3.44Å; S271-L275 PolarHBondContact O-N 3.33Å; S272-L275 WeakPolarHBondContact O-CB 3.45Å; S272-L275 PolarHBondContact O-N 3.44Å; S272-L275 VanDerWaalsContact O-N 3.13Å; L275-Q277 PolarHBondContact O-N 2.95Å; L275-A278 PolarHBondContact O-N 3.02Å; L275-M279 WeakPolarHBondContact O-CB 3.19Å; L275-M279 PolarHBondContact O-N 2.97Å
276D83.2Confident86.3Confident26 Ų2657 Ų5714%0.13931%0.308CS..Hα-helixtrans-63.4-41.4175.7-68-54000111.8K22 S272 N273 M279 Q280K22-D276 WeakPolarHBondContact CE-OD2 3.43Å; K22-D276 VanDerWaalsContact NZ-CG 3.26Å; K22-D276 IonicContact NZ-OD1 3.5Å; K22-D276 PolarHBondContact NZ-OD1 3.41Å; K22-D276 IonicContact NZ-OD2 2.62Å; K22-D276 PolarHBondContact NZ-OD2 3.19Å; S272-D276 VanDerWaalsContact O-CG 3.31Å; S272-D276 PolarHBondContact O-N 3.45Å; N273-D276 PolarHBondContact O-N 2.88Å; D276-M279 PolarHBondContact O-N 2.93Å; D276-Q280 PolarHBondContact O-N 3.13Å
277Q84.8Confident86.8Confident82 Ų8254.9 Ų54.938%0.38330%0.297SS..Hα-helixtrans-60.5-47.8172.7-72.1173.511.900111.5V25 N273 R274 L275 M279 Q280 V281V25-Q277 HydrophobicContact CB-CG 4.22Å; V25-Q277 HydrophobicContact CG1-CG 3.78Å; V25-Q277 HydrophobicContact CG2-CG 3.35Å; N273-Q277 WeakPolarHBondContact O-CG 3.12Å; N273-Q277 PolarHBondContact O-N 3.5Å; N273-Q277 VanDerWaalsContact O-N 3.09Å; R274-Q277 PolarHBondContact O-N 3.09Å; L275-Q277 PolarHBondContact O-N 2.95Å; Q277-M279 VanDerWaalsContact C-N 3.27Å; Q277-M279 PolarHBondContact O-N 2.86Å; Q277-Q280 PolarHBondContact O-N 2.94Å; Q277-V281 WeakPolarHBondContact O-CG2 3.35Å; Q277-V281 PolarHBondContact O-N 3.02Å
278A89.9Confident87.6Confident36 Ų3650.8 Ų50.830%0.29828%0.275SS..Hα-helixtrans-60.8-39.1176.900000111.2V254 R274 L275 V281 T282V254-A278 HydrophobicContact CG1-CB 4.08Å; V254-A278 HydrophobicContact CG2-CB 4.15Å; R274-A278 WeakPolarHBondContact O-CB 3.05Å; R274-A278 PolarHBondContact O-N 3.34Å; L275-A278 PolarHBondContact O-N 3.02Å; A278-V281 PolarHBondContact O-N 3.44Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.33Å; A278-T282 VanDerWaalsContact O-CG2 3.25Å; A278-T282 WeakPolarHBondContact O-CG2 3.34Å; A278-T282 PolarHBondContact O-N 2.82Å; A278-T282 PolarHBondContact O-OG1 2.88Å
279M89.6Confident88.1Confident43 Ų4346.7 Ų46.721%0.21225%0.254CS..Hα-helixtrans-63.7-48178.6-170.7168.866.100110.5Y251 V254 L275 D276 Q277 V281 T282 E283Y251-M279 HydrophobicContact CE2-CG 4.29Å; V254-M279 HydrophobicContact CG1-CB 3.87Å; L275-M279 WeakPolarHBondContact O-CB 3.19Å; L275-M279 PolarHBondContact O-N 2.97Å; D276-M279 PolarHBondContact O-N 2.93Å; Q277-M279 VanDerWaalsContact C-N 3.27Å; Q277-M279 PolarHBondContact O-N 2.86Å; M279-V281 PolarHBondContact O-N 3.16Å; M279-T282 PolarHBondContact O-N 3.1Å; M279-T282 PolarHBondContact O-OG1 2.92Å; M279-E283 WeakPolarHBondContact O-CB 3.35Å; M279-E283 PolarHBondContact O-N 2.84Å
280Q87.3Confident88.6Confident65 Ų6543.3 Ų43.330%0.30423%0.23SC..Hα-helixtrans-60.4-45177.5-171.466.652.400112.3A29 L33 D276 Q277 T284A29-Q280 HydrophobicContact CB-CG 4.48Å; L33-Q280 HydrophobicContact CD1-CG 4.45Å; L33-Q280 VanDerWaalsContact CD1-NE2 3.31Å; D276-Q280 PolarHBondContact O-N 3.13Å; Q277-Q280 PolarHBondContact O-N 2.94Å; Q280-T284 VanDerWaalsContact O-CB 3.29Å; Q280-T284 WeakPolarHBondContact O-CB 3.49Å; Q280-T284 PolarHBondContact O-N 3.04Å; Q280-T284 PolarHBondContact O-OG1 3.35Å
281V90.6Very high89.1Confident101 Ų10140.2 Ų40.261%0.61221%0.209SC*.Hα-helixtrans-66.9-45.8-179.3171.80000111Q277 A278 M279 T284 L285Q277-V281 WeakPolarHBondContact O-CG2 3.35Å; Q277-V281 PolarHBondContact O-N 3.02Å; A278-V281 PolarHBondContact O-N 3.44Å; M279-V281 PolarHBondContact O-N 3.16Å; V281-T284 WeakPolarHBondContact O-CB 3.31Å; V281-T284 PolarHBondContact O-N 3.4Å; V281-L285 PolarHBondContact O-N 3.35Å
282T94Very high89.6Confident18 Ų1840.4 Ų40.411%0.1121%0.207CC..Hα-helixtrans-71.8-34-178.655.10000112.6P250 V254 A278 M279 L285 G286P250-T282 HydrophobicContact CB-CG2 3.57Å; V254-T282 HydrophobicContact CG2-CG2 4.1Å; A278-T282 VanDerWaalsContact O-CB 3.31Å; A278-T282 WeakPolarHBondContact O-CB 3.33Å; A278-T282 VanDerWaalsContact O-CG2 3.25Å; A278-T282 WeakPolarHBondContact O-CG2 3.34Å; A278-T282 PolarHBondContact O-N 2.82Å; A278-T282 PolarHBondContact O-OG1 2.88Å; M279-T282 PolarHBondContact O-N 3.1Å; M279-T282 PolarHBondContact O-OG1 2.92Å; T282-L285 WeakPolarHBondContact O-CB 3.34Å; T282-L285 PolarHBondContact O-N 3.28Å; T282-G286 PolarHBondContact O-N 3.38Å
283E91.9Very high90Very high46 Ų4639.2 Ų39.222%0.21520%0.198CC..Hα-helixtrans-64-44.3170.9-176.4172.1-158.300110.9Y251 M279 L285 G286 M287Y251-E283 HydrophobicContact CD2-CB 3.67Å; Y251-E283 HydrophobicContact CD2-CG 4.34Å; Y251-E283 HydrophobicContact CE2-CB 3.71Å; Y251-E283 HydrophobicContact CE2-CG 4.02Å; M279-E283 WeakPolarHBondContact O-CB 3.35Å; M279-E283 PolarHBondContact O-N 2.84Å; E283-L285 VanDerWaalsContact C-N 3.3Å; E283-L285 PolarHBondContact O-N 3.33Å; E283-G286 CarbonylContact O-C 3.36Å; E283-G286 WeakPolarHBondContact O-CA 3.32Å; E283-G286 PolarHBondContact O-N 3.46Å; E283-G286 VanDerWaalsContact O-N 3.12Å; E283-M287 HydrophobicContact CG-CE 4.25Å; E283-M287 HydrophobicContact CG-CG 4.47Å; E283-M287 VanDerWaalsContact O-CG 3.23Å; E283-M287 WeakPolarHBondContact O-CG 3.38Å; E283-M287 PolarHBondContact O-N 3.35Å
284T91.5Very high90.3Very high13 Ų1338 Ų388%0.0819%0.193CC..Hα-helixtrans-59.9-41.9175.5-61.40000111.5L33 L36 Y37 Q280 V281 M287 T288L33-T284 HydrophobicContact CD2-CG2 3.44Å; L33-T284 VanDerWaalsContact CD2-CG2 3.44Å; L33-T284 WeakPolarHBondContact CD2-OG1 3.34Å; L36-T284 HydrophobicContact CD2-CG2 3.53Å; Y37-T284 HydrophobicContact CE1-CG2 3.84Å; Y37-T284 PolarHBondContact OH-OG1 3.29Å; Q280-T284 VanDerWaalsContact O-CB 3.29Å; Q280-T284 WeakPolarHBondContact O-CB 3.49Å; Q280-T284 PolarHBondContact O-N 3.04Å; Q280-T284 PolarHBondContact O-OG1 3.35Å; V281-T284 WeakPolarHBondContact O-CB 3.31Å; V281-T284 PolarHBondContact O-N 3.4Å; T284-M287 WeakPolarHBondContact O-CB 3.46Å; T284-M287 PolarHBondContact O-N 2.94Å; T284-T288 WeakPolarHBondContact O-CG2 3.25Å; T284-T288 PolarHBondContact O-N 3.37Å
285L94.2Very high90.5Very high65 Ų6532.8 Ų32.834%0.3418%0.178SC..Hα-helixtrans-59.5-49.9172.4-178.165.3000110.6F247 P250 V281 T282 E283 M287 T288F247-L285 HydrophobicContact CD1-CD1 3.93Å; F247-L285 HydrophobicContact CD1-CG 4.21Å; F247-L285 VanDerWaalsContact CD1-O 3.3Å; F247-L285 WeakPolarHBondContact CD1-O 3.29Å; F247-L285 HydrophobicContact CE1-CD1 4.01Å; F247-L285 HydrophobicContact CG-CD1 4.42Å; F247-L285 HydrophobicContact CG-CG 4.44Å; P250-L285 HydrophobicContact CG-CD2 4.31Å; V281-L285 PolarHBondContact O-N 3.35Å; T282-L285 WeakPolarHBondContact O-CB 3.34Å; T282-L285 PolarHBondContact O-N 3.28Å; E283-L285 VanDerWaalsContact C-N 3.3Å; E283-L285 PolarHBondContact O-N 3.33Å; L285-M287 VanDerWaalsContact C-N 3.32Å; L285-M287 PolarHBondContact O-N 2.89Å; L285-T288 PolarHBondContact O-N 3.02Å; L285-T288 VanDerWaalsContact O-N 3.09Å; L285-T288 PolarHBondContact O-OG1 3.39Å
286G94.1Very high90.6Very high0 Ų032.4 Ų32.40%018%0.176CC..Hα-helixtrans-55.2-43.9175.300000113.1W248 T282 E283 T288 H289W248-G286 VanDerWaalsContact CZ2-O 3.24Å; W248-G286 WeakPolarHBondContact CZ2-O 3.26Å; T282-G286 PolarHBondContact O-N 3.38Å; E283-G286 CarbonylContact O-C 3.36Å; E283-G286 WeakPolarHBondContact O-CA 3.32Å; E283-G286 PolarHBondContact O-N 3.46Å; E283-G286 VanDerWaalsContact O-N 3.12Å; G286-T288 VanDerWaalsContact C-N 3.27Å; G286-T288 PolarHBondContact O-N 3.47Å; G286-H289 WeakPolarHBondContact O-CB 3.5Å; G286-H289 PolarHBondContact O-N 3.05Å
287M91.2Very high90.6Very high4 Ų431.6 Ų31.62%0.0217%0.171CC..Hα-helixtrans-58.2-37.1177.1-68.5-86.3-171.600112.4Y37 F79 W86 Y108 E283 T284 L285 H289 C290Y37-M287 HydrophobicContact CE1-CB 4.04Å; Y37-M287 HydrophobicContact CE1-CG 4.4Å; F79-M287 HydrophobicContact CE1-CB 4.33Å; F79-M287 HydrophobicContact CE1-CG 4.48Å; F79-M287 HydrophobicContact CE1-SD 3.56Å; F79-M287 VanDerWaalsContact CE1-SD 3.56Å; F79-M287 HydrophobicContact CE2-SD 4.32Å; F79-M287 HydrophobicContact CZ-CB 4.44Å; F79-M287 HydrophobicContact CZ-CE 4.47Å; F79-M287 HydrophobicContact CZ-CG 4.21Å; F79-M287 HydrophobicContact CZ-SD 3.27Å; F79-M287 WeakPolarHBondContact CZ-SD 3.43Å; W86-M287 HydrophobicContact CG-CE 4.5Å; Y108-M287 HydrophobicContact CD2-CE 3.85Å; Y108-M287 HydrophobicContact CD2-SD 4.24Å; Y108-M287 HydrophobicContact CE2-CE 3.24Å; Y108-M287 HydrophobicContact CE2-SD 3.73Å; E283-M287 HydrophobicContact CG-CE 4.25Å; E283-M287 HydrophobicContact CG-CG 4.47Å; E283-M287 VanDerWaalsContact O-CG 3.23Å; E283-M287 WeakPolarHBondContact O-CG 3.38Å; E283-M287 PolarHBondContact O-N 3.35Å; T284-M287 WeakPolarHBondContact O-CB 3.46Å; T284-M287 PolarHBondContact O-N 2.94Å; L285-M287 VanDerWaalsContact C-N 3.32Å; L285-M287 PolarHBondContact O-N 2.89Å; M287-H289 PolarHBondContact O-N 3.33Å; M287-C290 PolarHBondContact O-SG 3.46Å
288T93.6Very high90.5Very high20 Ų2029.2 Ų29.212%0.12317%0.165CC..Hα-helixtrans-69-18.9179660000113.2L36 V40 F247 T284 L285 G286 C290 C291L36-T288 HydrophobicContact CD1-CG2 4.46Å; L36-T288 HydrophobicContact CD2-CG2 4.44Å; L36-T288 HydrophobicContact CG-CG2 4.49Å; V40-T288 HydrophobicContact CG2-CG2 3.66Å; F247-T288 WeakPolarHBondContact CD1-OG1 3.4Å; F247-T288 VanDerWaalsContact CE1-OG1 3.26Å; F247-T288 WeakPolarHBondContact CE1-OG1 3.26Å; T284-T288 WeakPolarHBondContact O-CG2 3.25Å; T284-T288 PolarHBondContact O-N 3.37Å; L285-T288 PolarHBondContact O-N 3.02Å; L285-T288 VanDerWaalsContact O-N 3.09Å; L285-T288 PolarHBondContact O-OG1 3.39Å; G286-T288 VanDerWaalsContact C-N 3.27Å; G286-T288 PolarHBondContact O-N 3.47Å; T288-C290 PolarHBondContact O-N 3.14Å; T288-C290 VanDerWaalsContact O-N 3.16Å; T288-C291 PolarHBondContact O-N 2.93Å; T288-C291 PolarHBondContact O-SG 2.83Å
289H94.1Very high89.9Confident9 Ų935.6 Ų35.64%0.04219%0.187CC..G310 helixtrans-56.3-34.5-179.1177.4-96.8000113.4Y244 F247 W248 G286 M287 C291 I292Y244-H289 WeakPolarHBondContact CA-NE2 3.34Å; Y244-H289 AromaticContact CD2-CE1 3.9Å; F247-H289 HydrophobicContact CB-CB 3.94Å; F247-H289 HydrophobicContact CD1-CB 3.93Å; F247-H289 HydrophobicContact CG-CB 4.17Å; W248-H289 AromaticContact CD1-CG 3.87Å; W248-H289 AromaticContact NE1-CG 3.54Å; W248-H289 AromaticContact NE1-ND1 3.59Å; G286-H289 WeakPolarHBondContact O-CB 3.5Å; G286-H289 PolarHBondContact O-N 3.05Å; M287-H289 PolarHBondContact O-N 3.33Å; H289-C291 PolarHBondContact O-N 3.44Å; H289-C291 VanDerWaalsContact O-N 3.09Å; H289-I292 WeakPolarHBondContact O-CB 3.43Å; H289-I292 PolarHBondContact O-N 3.46Å
290C91.3Very high89.2Confident3 Ų335.1 Ų35.12%0.0219%0.186CC..G310 helixtrans-61.1-20.9-175.965.30000114.3V40 N48 D76 F79 L80 M287 T288V40-C290 VanDerWaalsContact CG1-SG 3.56Å; N48-C290 PolarHBondContact ND2-O 3.34Å; D76-C290 HydrophobicContact CB-CB 4.41Å; F79-C290 HydrophobicContact CD1-CB 3.91Å; F79-C290 HydrophobicContact CE1-CB 4.41Å; L80-C290 HydrophobicContact CD2-CB 4.49Å; L80-C290 WeakPolarHBondContact CD2-SG 3.19Å; L80-C290 HydrophobicContact CG-CB 4.4Å; M287-C290 PolarHBondContact O-SG 3.46Å; T288-C290 PolarHBondContact O-N 3.14Å; T288-C290 VanDerWaalsContact O-N 3.16Å
291C92.1Very high88.6Confident12 Ų1232.4 Ų32.48%0.08118%0.176CC..G310 helixtrans-95.8-7.7175.373.40000113.9V40 F43 T288 H289V40-C291 HydrophobicContact CG1-CB 4.49Å; F43-C291 HydrophobicContact CB-CB 4.38Å; T288-C291 PolarHBondContact O-N 2.93Å; T288-C291 PolarHBondContact O-SG 2.83Å; H289-C291 PolarHBondContact O-N 3.44Å; H289-C291 VanDerWaalsContact O-N 3.09Å
292I92.6Very high87.8Confident35 Ų3531 Ų3118%0.17916%0.163CC..Hα-helixtrans-81.9-30.1-175.6-54-60.5000112.1V243 F247 H289 I295 I296V243-I292 HydrophobicContact CG1-CG2 3.69Å; F247-I292 HydrophobicContact CE1-CD1 4.21Å; F247-I292 HydrophobicContact CE1-CG1 3.77Å; F247-I292 HydrophobicContact CZ-CD1 4.11Å; F247-I292 HydrophobicContact CZ-CG1 3.85Å; H289-I292 WeakPolarHBondContact O-CB 3.43Å; H289-I292 PolarHBondContact O-N 3.46Å; I292-I295 HydrophobicContact CD1-CD1 4.24Å; I292-I295 WeakPolarHBondContact O-CA 3.37Å; I292-I295 VanDerWaalsContact O-CB 3.32Å; I292-I295 WeakPolarHBondContact O-CB 3.4Å; I292-I295 PolarHBondContact O-N 2.86Å; I292-I296 HydrophobicContact CG2-CD1 3.99Å; I292-I296 HydrophobicContact CG2-CG1 4Å; I292-I296 WeakPolarHBondContact O-CG1 3.31Å; I292-I296 PolarHBondContact O-N 2.82Å
293N89.2Confident86.7Confident0 Ų036.3 Ų36.30%018%0.184CC..Hα-helixtrans-54.5-51.5-179.6-75.3-29.6000113.2D76 I295 I296 Y297D76-N293 PolarHBondContact OD2-ND2 3.47Å; N293-I295 VanDerWaalsContact C-N 3.28Å; N293-I295 PolarHBondContact O-N 3.45Å; N293-I296 PolarHBondContact O-N 2.92Å; N293-Y297 HydrophobicContact CB-CE2 4.16Å; N293-Y297 WeakPolarHBondContact O-CD2 3.31Å; N293-Y297 WeakPolarHBondContact O-CE2 3.13Å; N293-Y297 VanDerWaalsContact O-CG 3.29Å; N293-Y297 PolarHBondContact O-N 2.97Å
294P89.4Confident85.8Confident13 Ų1334.9 Ų34.98%0.08418%0.177CC..Hα-helixtrans-56.9-38.1173.2-26.134.7000114.2V51 Y297 A298V51-P294 HydrophobicContact CG2-CB 4.1Å; V51-P294 HydrophobicContact CG2-CG 4.18Å; P294-Y297 PolarHBondContact O-N 3.47Å; P294-A298 PolarHBondContact O-N 3.02Å
295I89.2Confident85.1Confident80 Ų8040.5 Ų40.541%0.4120%0.197SC..Hα-helixtrans-63.5-47.3178.1-62175.6000109.5I292 N293 Y297 A298 F299I292-I295 HydrophobicContact CD1-CD1 4.24Å; I292-I295 WeakPolarHBondContact O-CA 3.37Å; I292-I295 VanDerWaalsContact O-CB 3.32Å; I292-I295 WeakPolarHBondContact O-CB 3.4Å; I292-I295 PolarHBondContact O-N 2.86Å; N293-I295 VanDerWaalsContact C-N 3.28Å; N293-I295 PolarHBondContact O-N 3.45Å; I295-Y297 VanDerWaalsContact C-N 3.28Å; I295-Y297 PolarHBondContact O-N 3.36Å; I295-A298 PolarHBondContact O-N 3.05Å; I295-A298 VanDerWaalsContact O-N 3.13Å; I295-F299 HydrophobicContact CG2-CD2 3.64Å; I295-F299 HydrophobicContact CG2-CE2 3.75Å; I295-F299 VanDerWaalsContact O-CD2 3.25Å; I295-F299 WeakPolarHBondContact O-CD2 3.39Å; I295-F299 PolarHBondContact O-N 3.38Å
296I88.2Confident84.5Confident10 Ų1041.9 Ų41.95%0.05121%0.205CC..Hα-helixtrans-57-44175.4-63.5169000110.4L236 T239 I240 V243 I292 N293 A298 F299 V300L236-I296 HydrophobicContact CD1-CG2 3.93Å; T239-I296 HydrophobicContact CG2-CG2 4.05Å; I240-I296 HydrophobicContact CG1-CD1 4.3Å; I240-I296 HydrophobicContact CG1-CG2 3.88Å; V243-I296 HydrophobicContact CB-CD1 3.92Å; V243-I296 HydrophobicContact CG1-CD1 3.95Å; V243-I296 HydrophobicContact CG2-CD1 4.02Å; I292-I296 HydrophobicContact CG2-CD1 3.99Å; I292-I296 HydrophobicContact CG2-CG1 4Å; I292-I296 WeakPolarHBondContact O-CG1 3.31Å; I292-I296 PolarHBondContact O-N 2.82Å; N293-I296 PolarHBondContact O-N 2.92Å; I296-A298 VanDerWaalsContact C-N 3.34Å; I296-A298 PolarHBondContact O-N 3.33Å; I296-F299 PolarHBondContact O-N 3.18Å; I296-V300 HydrophobicContact CG2-CB 4.24Å; I296-V300 HydrophobicContact CG2-CG2 4.06Å; I296-V300 WeakPolarHBondContact O-CA 3.47Å; I296-V300 VanDerWaalsContact O-CB 3.26Å; I296-V300 WeakPolarHBondContact O-CB 3.37Å; I296-V300 PolarHBondContact O-N 3.3Å
297Y84.9Confident83.7Confident9 Ų946 Ų464%0.03522%0.221CC..Hα-helixtrans-63.7-38.5178.6-55.9-38.2000112.8V51 L69 L72 L236 I240 N293 P294 I295 G301V51-Y297 HydrophobicContact CG1-CD2 4.28Å; V51-Y297 HydrophobicContact CG1-CE2 4.17Å; V51-Y297 HydrophobicContact CG2-CD2 3.67Å; V51-Y297 HydrophobicContact CG2-CE2 4.12Å; L69-Y297 HydrophobicContact CD2-CE1 3.81Å; L69-Y297 WeakPolarHBondContact CD2-OH 3.33Å; L72-Y297 WeakPolarHBondContact CD2-OH 3.23Å; L236-Y297 HydrophobicContact CD1-CD1 4.24Å; I240-Y297 HydrophobicContact CD1-CE1 3.62Å; I240-Y297 HydrophobicContact CG1-CE1 4.41Å; N293-Y297 HydrophobicContact CB-CE2 4.16Å; N293-Y297 WeakPolarHBondContact O-CD2 3.31Å; N293-Y297 WeakPolarHBondContact O-CE2 3.13Å; N293-Y297 VanDerWaalsContact O-CG 3.29Å; N293-Y297 PolarHBondContact O-N 2.97Å; P294-Y297 PolarHBondContact O-N 3.47Å; I295-Y297 VanDerWaalsContact C-N 3.28Å; I295-Y297 PolarHBondContact O-N 3.36Å; Y297-G301 WeakPolarHBondContact O-CA 3.25Å; Y297-G301 PolarHBondContact O-N 2.78Å; Y297-G301 VanDerWaalsContact O-N 3.07Å
298A81.3Confident83.1Confident31 Ų3147.4 Ų47.426%0.25623%0.229SC..Hα-helixtrans-67.4-40.8178.900000112.9P294 I295 I296P294-A298 PolarHBondContact O-N 3.02Å; I295-A298 PolarHBondContact O-N 3.05Å; I295-A298 VanDerWaalsContact O-N 3.13Å; I296-A298 VanDerWaalsContact C-N 3.34Å; I296-A298 PolarHBondContact O-N 3.33Å
299F78.1Confident82.3Confident171 Ų17150.8 Ų50.875%0.7525%0.245SC*.Hα-helixtrans-89.9-40.6-175.8-73.1-74.3000113.8I295 I296I295-F299 HydrophobicContact CG2-CD2 3.64Å; I295-F299 HydrophobicContact CG2-CE2 3.75Å; I295-F299 VanDerWaalsContact O-CD2 3.25Å; I295-F299 WeakPolarHBondContact O-CD2 3.39Å; I295-F299 PolarHBondContact O-N 3.38Å; I296-F299 PolarHBondContact O-N 3.18Å
300V75.6Confident81.7Confident32 Ų3254 Ų5419%0.19427%0.265CS..Hα-helixtrans-95.4-28.8-174.4-172.40000111.7L236 T239 I296 E302L236-V300 HydrophobicContact CB-CG1 4.37Å; L236-V300 HydrophobicContact CD1-CB 3.86Å; L236-V300 HydrophobicContact CD1-CG1 3.87Å; T239-V300 HydrophobicContact CG2-CG2 4.2Å; I296-V300 HydrophobicContact CG2-CB 4.24Å; I296-V300 HydrophobicContact CG2-CG2 4.06Å; I296-V300 WeakPolarHBondContact O-CA 3.47Å; I296-V300 VanDerWaalsContact O-CB 3.26Å; I296-V300 WeakPolarHBondContact O-CB 3.37Å; I296-V300 PolarHBondContact O-N 3.3Å; V300-E302 PolarHBondContact O-N 3.34Å
301G73.8Confident81Confident9 Ų955 Ų559%0.09327%0.27CS..  trans-89.285.4-17600000113.9Y297 K303 F304 R305Y297-G301 WeakPolarHBondContact O-CA 3.25Å; Y297-G301 PolarHBondContact O-N 2.78Å; Y297-G301 VanDerWaalsContact O-N 3.07Å; G301-K303 PolarHBondContact O-N 2.07Å; G301-K303 VanDerWaalsContact O-N 3.13Å; G301-F304 WeakPolarHBondContact O-CA 3.25Å; G301-F304 WeakPolarHBondContact O-CB 3.38Å; G301-F304 PolarHBondContact O-N 2.85Å; G301-R305 PolarHBondContact O-N 3.31Å
302E73.6Confident80.4Confident72 Ų7258.9 Ų58.934%0.33629%0.285SS..Hα-helixtrans-51.1-41.3177.5-69.7174.2-168.200113.6R232 V300 N306R232-E302 WeakPolarHBondContact CD-OE2 3.45Å; R232-E302 IonicContact CZ-OE1 2.72Å; R232-E302 IonicContact CZ-OE2 2.75Å; R232-E302 VanDerWaalsContact CZ-OE2 3.23Å; R232-E302 IonicContact NE-OE1 3.23Å; R232-E302 IonicContact NE-OE2 3.32Å; R232-E302 IonicContact NH1-OE1 3.53Å; R232-E302 IonicContact NH1-OE2 3.7Å; R232-E302 PolarHBondContact NH1-OE2 2.82Å; V300-E302 PolarHBondContact O-N 3.34Å; E302-N306 PolarHBondContact O-N 3.45Å; E302-N306 VanDerWaalsContact O-N 3.13Å
303K71.5Confident79.7Confident129 Ų12963.5 Ų63.556%0.56131%0.306SS*.Hα-helixtrans-64.8-43176.7-69-174.2-179.8-178.80111.8G301 N306 Y307G301-K303 PolarHBondContact O-N 2.07Å; G301-K303 VanDerWaalsContact O-N 3.13Å; K303-N306 PolarHBondContact O-N 3.35Å; K303-Y307 HydrophobicContact CB-CE2 4.44Å; K303-Y307 WeakPolarHBondContact O-CD2 3.41Å; K303-Y307 PolarHBondContact O-N 2.91Å; K303-Y307 VanDerWaalsContact O-N 3.08Å
304F71.8Confident78.9Confident16 Ų1670.1 Ų70.17%0.0734%0.335CS..Hα-helixtrans-65.4-43-179.3-174.6-95.2000110.4V51 I54 G301 N306 Y307 L308V51-F304 HydrophobicContact CB-CE2 4.38Å; V51-F304 HydrophobicContact CB-CZ 4.38Å; V51-F304 HydrophobicContact CG1-CE2 4.45Å; V51-F304 HydrophobicContact CG2-CE2 3.99Å; V51-F304 HydrophobicContact CG2-CZ 3.64Å; I54-F304 HydrophobicContact CB-CE2 4.06Å; I54-F304 HydrophobicContact CD1-CD2 4.49Å; I54-F304 HydrophobicContact CD1-CE1 4.21Å; I54-F304 HydrophobicContact CD1-CE2 3.74Å; I54-F304 HydrophobicContact CD1-CZ 3.57Å; I54-F304 HydrophobicContact CG2-CD2 4.07Å; I54-F304 HydrophobicContact CG2-CE2 3.89Å; G301-F304 WeakPolarHBondContact O-CA 3.25Å; G301-F304 WeakPolarHBondContact O-CB 3.38Å; G301-F304 PolarHBondContact O-N 2.85Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 2.86Å; F304-Y307 PolarHBondContact O-N 2.84Å; F304-Y307 VanDerWaalsContact O-N 3.16Å; F304-L308 HydrophobicContact CD1-CD1 4.43Å; F304-L308 HydrophobicContact CE1-CD1 3.83Å; F304-L308 WeakPolarHBondContact O-CB 3.4Å; F304-L308 PolarHBondContact O-N 3.03Å
305R78.4Confident77.9Confident130 Ų13073.8 Ų73.849%0.49135%0.351SS..Hα-helixtrans-56.8-43.9173.8-169.3177.669.3-173.63.1112.7G301 L308 L309G301-R305 PolarHBondContact O-N 3.31Å; R305-L308 WeakPolarHBondContact O-CB 3.21Å; R305-L308 PolarHBondContact O-N 2.8Å; R305-L309 WeakPolarHBondContact O-CG 3.19Å; R305-L309 PolarHBondContact O-N 3.1Å
306N79.9Confident76.9Confident94 Ų9472.7 Ų72.750%0.50335%0.345SS..Hα-helixtrans-64.9-41.1177-71.5-2.7000112.1E302 K303 F304 L308 L309 V310E302-N306 PolarHBondContact O-N 3.45Å; E302-N306 VanDerWaalsContact O-N 3.13Å; K303-N306 PolarHBondContact O-N 3.35Å; F304-N306 VanDerWaalsContact C-N 3.33Å; F304-N306 PolarHBondContact O-N 2.86Å; N306-L308 VanDerWaalsContact C-N 3.34Å; N306-L309 PolarHBondContact O-N 3.29Å; N306-V310 WeakPolarHBondContact O-CG2 3.28Å; N306-V310 PolarHBondContact O-N 3.05Å
307Y78.1Confident75.6Confident86 Ų8674.5 Ų74.534%0.33736%0.361SS..Hα-helixtrans-66.7-37174.8-72.5-61.4000112.7I54 C58 K59 K303 F304 V310 F311I54-Y307 HydrophobicContact CG2-CG 4.36Å; C58-Y307 HydrophobicContact CB-CD1 3.64Å; C58-Y307 HydrophobicContact CB-CE1 4.23Å; C58-Y307 HydrophobicContact CB-CG 4.16Å; K59-Y307 HydrophobicContact CD-CE2 4.23Å; K59-Y307 HydrophobicContact CG-CD2 3.98Å; K59-Y307 HydrophobicContact CG-CE2 3.64Å; K303-Y307 HydrophobicContact CB-CE2 4.44Å; K303-Y307 WeakPolarHBondContact O-CD2 3.41Å; K303-Y307 PolarHBondContact O-N 2.91Å; K303-Y307 VanDerWaalsContact O-N 3.08Å; F304-Y307 PolarHBondContact O-N 2.84Å; F304-Y307 VanDerWaalsContact O-N 3.16Å; Y307-V310 PolarHBondContact O-N 3.11Å; Y307-F311 VanDerWaalsContact O-CB 3.28Å; Y307-F311 WeakPolarHBondContact O-CB 3.32Å; Y307-F311 PolarHBondContact O-N 3.26Å
308L77.7Confident74.2Confident35 Ų3581.2 Ų81.218%0.18339%0.391CS..Hα-helixtrans-60.8-50.3174.5-170.7149.1000109.4L50 I54 F304 R305 N306 V310 F311 F312L50-L308 HydrophobicContact CD2-CD1 3.78Å; L50-L308 HydrophobicContact CD2-CG 4.33Å; I54-L308 HydrophobicContact CD1-CB 4.05Å; I54-L308 HydrophobicContact CD1-CD1 4.48Å; I54-L308 HydrophobicContact CD1-CG 4.39Å; F304-L308 HydrophobicContact CD1-CD1 4.43Å; F304-L308 HydrophobicContact CE1-CD1 3.83Å; F304-L308 WeakPolarHBondContact O-CB 3.4Å; F304-L308 PolarHBondContact O-N 3.03Å; R305-L308 WeakPolarHBondContact O-CB 3.21Å; R305-L308 PolarHBondContact O-N 2.8Å; N306-L308 VanDerWaalsContact C-N 3.34Å; L308-V310 PolarHBondContact O-N 3.2Å; L308-F311 WeakPolarHBondContact O-CB 3.48Å; L308-F311 PolarHBondContact O-N 3.46Å; L308-F311 VanDerWaalsContact O-N 3.09Å; L308-F312 HydrophobicContact CD1-CE2 4.42Å; L308-F312 HydrophobicContact CD2-CD2 3.39Å; L308-F312 HydrophobicContact CD2-CE2 3.34Å; L308-F312 HydrophobicContact CD2-CZ 4.49Å; L308-F312 HydrophobicContact CG-CD2 3.84Å; L308-F312 HydrophobicContact CG-CE2 3.68Å; L308-F312 VanDerWaalsContact O-CD2 3.26Å; L308-F312 WeakPolarHBondContact O-CD2 3.4Å; L308-F312 PolarHBondContact O-N 2.93Å
309L78.6Confident73Confident91 Ų9189 Ų8948%0.47641%0.414SS..Hα-helixtrans-55.8-46.5175.1-71.9170.2000112.9R305 N306 F311 F312 Q313R305-L309 WeakPolarHBondContact O-CG 3.19Å; R305-L309 PolarHBondContact O-N 3.1Å; N306-L309 PolarHBondContact O-N 3.29Å; L309-F311 VanDerWaalsContact C-N 3.33Å; L309-F311 PolarHBondContact O-N 3.41Å; L309-F312 PolarHBondContact O-N 3.13Å; L309-Q313 WeakPolarHBondContact O-CB 3.37Å; L309-Q313 VanDerWaalsContact O-CG 3.29Å; L309-Q313 WeakPolarHBondContact O-CG 3.16Å; L309-Q313 PolarHBondContact O-N 2.73Å
310V79.7Confident71.8Confident76 Ų7687.8 Ų87.846%0.46141%0.408SS..Hα-helixtrans-63.4-39.5176.8171.80000111.5N306 Y307 L308 Q313 K314N306-V310 WeakPolarHBondContact O-CG2 3.28Å; N306-V310 PolarHBondContact O-N 3.05Å; Y307-V310 PolarHBondContact O-N 3.11Å; L308-V310 PolarHBondContact O-N 3.2Å; V310-Q313 PolarHBondContact O-N 3.35Å; V310-K314 VanDerWaalsContact O-CB 3.23Å; V310-K314 WeakPolarHBondContact O-CB 3.28Å; V310-K314 PolarHBondContact O-N 3.25Å
311F77.2Confident70.6Confident25 Ų2590.7 Ų90.711%0.1143%0.429CS..Hα-helixtrans-64.1-46.6176.7-178.4-93.2000111.3L50 L53 Y307 L308 L309 Q313 K314 H315L50-F311 HydrophobicContact CD1-CD1 3.86Å; L50-F311 HydrophobicContact CD1-CE1 3.73Å; L50-F311 HydrophobicContact CD1-CZ 4.44Å; L53-F311 HydrophobicContact CD1-CZ 4.38Å; Y307-F311 VanDerWaalsContact O-CB 3.28Å; Y307-F311 WeakPolarHBondContact O-CB 3.32Å; Y307-F311 PolarHBondContact O-N 3.26Å; L308-F311 WeakPolarHBondContact O-CB 3.48Å; L308-F311 PolarHBondContact O-N 3.46Å; L308-F311 VanDerWaalsContact O-N 3.09Å; L309-F311 VanDerWaalsContact C-N 3.33Å; L309-F311 PolarHBondContact O-N 3.41Å; F311-Q313 PolarHBondContact O-N 3.37Å; F311-K314 PolarHBondContact O-N 3.18Å; F311-H315 AromaticContact CD2-CD2 3.65Å; F311-H315 AromaticContact CE2-CD2 3.66Å; F311-H315 HydrophobicContact CZ-CB 4.39Å; F311-H315 WeakPolarHBondContact O-CB 3.39Å; F311-H315 PolarHBondContact O-N 2.9Å
312F79.9Confident69.4Low92 Ų9298.8 Ų98.840%0.40446%0.462SS..Iπ-helixtrans-60-45.2175-88-89000111.4L50 L308 L309 K314 I316 A317L50-F312 HydrophobicContact CD2-CE2 4.43Å; L308-F312 HydrophobicContact CD1-CE2 4.42Å; L308-F312 HydrophobicContact CD2-CD2 3.39Å; L308-F312 HydrophobicContact CD2-CE2 3.34Å; L308-F312 HydrophobicContact CD2-CZ 4.49Å; L308-F312 HydrophobicContact CG-CD2 3.84Å; L308-F312 HydrophobicContact CG-CE2 3.68Å; L308-F312 VanDerWaalsContact O-CD2 3.26Å; L308-F312 WeakPolarHBondContact O-CD2 3.4Å; L308-F312 PolarHBondContact O-N 2.93Å; L309-F312 PolarHBondContact O-N 3.13Å; F312-K314 PolarHBondContact O-N 3.22Å; F312-I316 HydrophobicContact CD1-CB 4.1Å; F312-I316 HydrophobicContact CD1-CD1 3.27Å; F312-I316 HydrophobicContact CD1-CG1 4.23Å; F312-I316 HydrophobicContact CD1-CG2 4.18Å; F312-I316 HydrophobicContact CE1-CD1 3.31Å; F312-I316 HydrophobicContact CG-CD1 3.94Å; F312-I316 HydrophobicContact CZ-CD1 4.01Å; F312-I316 CarbonylContact O-C 3.52Å; F312-I316 WeakPolarHBondContact O-CA 3.27Å; F312-I316 WeakPolarHBondContact O-CB 3.25Å; F312-I316 PolarHBondContact O-N 3.43Å; F312-A317 PolarHBondContact O-N 3.38Å
313Q77.1Confident68Low133 Ų133100.6 Ų100.662%0.62148%0.481SS*.Iπ-helixtrans-62.8-43.6176.7-73.1171.7-8.700112.6L309 V310 F311L309-Q313 WeakPolarHBondContact O-CB 3.37Å; L309-Q313 VanDerWaalsContact O-CG 3.29Å; L309-Q313 WeakPolarHBondContact O-CG 3.16Å; L309-Q313 PolarHBondContact O-N 2.73Å; V310-Q313 PolarHBondContact O-N 3.35Å; F311-Q313 PolarHBondContact O-N 3.37Å
314K72.7Confident66.6Low139 Ų13998.4 Ų98.460%0.60448%0.481SS*.Iπ-helixtrans-76.5-38.4-174.4-170.7177.4179.8-176.50113.4V310 F311 F312 K318V310-K314 VanDerWaalsContact O-CB 3.23Å; V310-K314 WeakPolarHBondContact O-CB 3.28Å; V310-K314 PolarHBondContact O-N 3.25Å; F311-K314 PolarHBondContact O-N 3.18Å; F312-K314 PolarHBondContact O-N 3.22Å; K314-K318 WeakPolarHBondContact O-CB 3.37Å
315H69.6Low64.9Low90 Ų90102.4 Ų102.442%0.41751%0.511SS..Iπ-helixtrans-110.9-28.8-170.1-70.9-78.9000114.5F311 R319F311-H315 AromaticContact CD2-CD2 3.65Å; F311-H315 AromaticContact CE2-CD2 3.66Å; F311-H315 HydrophobicContact CZ-CB 4.39Å; F311-H315 WeakPolarHBondContact O-CB 3.39Å; F311-H315 PolarHBondContact O-N 2.9Å; H315-R319 WeakPolarHBondContact O-CB 3.35Å
316I66.9Low63.2Low57 Ų57103.6 Ų103.629%0.29253%0.525SS..Iπ-helixtrans-101.5-53.6-175.6-65.8169.9000109.4F312 K318 R319 F320F312-I316 HydrophobicContact CD1-CB 4.1Å; F312-I316 HydrophobicContact CD1-CD1 3.27Å; F312-I316 HydrophobicContact CD1-CG1 4.23Å; F312-I316 HydrophobicContact CD1-CG2 4.18Å; F312-I316 HydrophobicContact CE1-CD1 3.31Å; F312-I316 HydrophobicContact CG-CD1 3.94Å; F312-I316 HydrophobicContact CZ-CD1 4.01Å; F312-I316 CarbonylContact O-C 3.52Å; F312-I316 WeakPolarHBondContact O-CA 3.27Å; F312-I316 WeakPolarHBondContact O-CB 3.25Å; F312-I316 PolarHBondContact O-N 3.43Å; I316-K318 VanDerWaalsContact C-N 3.31Å; I316-K318 PolarHBondContact O-N 3.34Å; I316-R319 PolarHBondContact O-N 2.85Å; I316-F320 HydrophobicContact CG2-CD2 3.63Å; I316-F320 HydrophobicContact CG2-CE2 3.81Å; I316-F320 WeakPolarHBondContact O-CD2 3.45Å; I316-F320 PolarHBondContact O-N 3.36Å
317A61.7Low61.1Low48 Ų48108.6 Ų108.640%0.39754%0.543SS..Iπ-helixtrans-60.9-39.217700000112F312 R319 F320 C321F312-A317 PolarHBondContact O-N 3.38Å; A317-R319 VanDerWaalsContact C-N 3.31Å; A317-R319 PolarHBondContact O-N 2.9Å; A317-F320 PolarHBondContact O-N 3.39Å; A317-C321 WeakPolarHBondContact O-CB 3.4Å; A317-C321 PolarHBondContact O-N 3.5Å; A317-C321 PolarHBondContact O-SG 2.92Å; A317-C321 VanDerWaalsContact O-SG 3.34Å
318K55.9Low59.4Low150 Ų150113.4 Ų113.465%0.65257%0.568SS**Hα-helixtrans-68.5-25.9175.7-155.4174.6-175.1177.20113.9K314 I316 K322K314-K318 WeakPolarHBondContact O-CB 3.37Å; I316-K318 VanDerWaalsContact C-N 3.31Å; I316-K318 PolarHBondContact O-N 3.34Å; K318-K322 PolarHBondContact O-N 3.44Å
319R55.1Low57.4Low195 Ų195119.4 Ų119.474%0.73660%0.596SS**Hα-helixtrans-82.6-41.6175.2-122175.5176.6178.7-2.1111.3H315 I316 A317 K322 C323H315-R319 WeakPolarHBondContact O-CB 3.35Å; I316-R319 PolarHBondContact O-N 2.85Å; A317-R319 VanDerWaalsContact C-N 3.31Å; A317-R319 PolarHBondContact O-N 2.9Å; R319-K322 WeakPolarHBondContact O-CB 3.41Å; R319-K322 PolarHBondContact O-N 2.98Å; R319-C323 PolarHBondContact O-N 3.14Å
320F53.8Low55.3Low144 Ų144122.8 Ų122.863%0.63261%0.609SS**Hα-helixtrans-67.3-40.1173.8-86.9-83.8000112I316 A317 K322 C323 C324I316-F320 HydrophobicContact CG2-CD2 3.63Å; I316-F320 HydrophobicContact CG2-CE2 3.81Å; I316-F320 WeakPolarHBondContact O-CD2 3.45Å; I316-F320 PolarHBondContact O-N 3.36Å; A317-F320 PolarHBondContact O-N 3.39Å; F320-K322 VanDerWaalsContact C-N 3.26Å; F320-K322 PolarHBondContact O-N 3.08Å; F320-C323 CarbonylContact O-C 3.54Å; F320-C323 PolarHBondContact O-N 2.88Å; F320-C323 VanDerWaalsContact O-N 3.11Å; F320-C324 PolarHBondContact O-N 3.05Å
321C49.3Very low53.1Low94 Ų94123.8 Ų123.864%0.63563%0.626SS**Hα-helixtrans-66.2-23.8170.6-74.30000113.3A317A317-C321 WeakPolarHBondContact O-CB 3.4Å; A317-C321 PolarHBondContact O-N 3.5Å; A317-C321 PolarHBondContact O-SG 2.92Å; A317-C321 VanDerWaalsContact O-SG 3.34Å
322K47.9Very low51.2Low178 Ų178128.5 Ų128.577%0.77466%0.658SS**Hα-helixtrans-77-28.8169.9-98.3-171.4172.5-168.10113.1K318 R319 F320K318-K322 PolarHBondContact O-N 3.44Å; R319-K322 WeakPolarHBondContact O-CB 3.41Å; R319-K322 PolarHBondContact O-N 2.98Å; F320-K322 VanDerWaalsContact C-N 3.26Å; F320-K322 PolarHBondContact O-N 3.08Å
323C45.5Very low49.1Very low111 Ų111132.9 Ų132.975%0.7568%0.68SS**Hα-helixtrans-82.9-20.2172.4-82.70000113.2R319 F320R319-C323 PolarHBondContact O-N 3.14Å; F320-C323 CarbonylContact O-C 3.54Å; F320-C323 PolarHBondContact O-N 2.88Å; F320-C323 VanDerWaalsContact O-N 3.11Å
324C41.1Very low47.4Very low82 Ų82138.8 Ų138.855%0.55470%0.697SS**  trans-98.172.6171.3-70.20000110.7F320 I326F320-C324 PolarHBondContact O-N 3.05Å; C324-I326 PolarHBondContact O-N 3.38Å
325S37Very low45.6Very low100 Ų100136.6 Ų136.670%0.69970%0.704SS**THydrogen-bonded Turntrans-73.446.3165.559.30000112
326I43.4Very low44.3Very low155 Ų155136.1 Ų136.180%0.79572%0.724SS**THydrogen-bonded Turntrans-121.8-9174.6-70.4-178.7000111.3C324C324-I326 PolarHBondContact O-N 3.38Å
327F36Very low42.9Very low200 Ų200139 Ų13988%0.87775%0.75SS**SBendtrans-115.332.9177-121.2-84.7000113.7
328Q41.4Very low41.9Very low186 Ų186142.9 Ų142.987%0.86977%0.768SS**  trans-108.763.1166.2-155.6172.1-5.200108.5
329Q35.4Very low40.9Very low161 Ų161145.8 Ų145.875%0.75278%0.776SS**  trans-115.6105.1163.7-157.5160.26.200108.2
330E34.1Very low39.9Very low162 Ų162141.7 Ų141.776%0.75777%0.773SS**  trans56.197.2151.4-66.3169.9176.900118.2
331A34.3Very low38.8Very low98 Ų98146.6 Ų146.681%0.8179%0.787SS**PPolyproline II helixtrans-77.5120141.800000107.1E333A331-E333 PolarHBondContact O-N 3.48Å
332P37.5Very low38Very low123 Ų123147.6 Ų147.680%0.79980%0.796SS**PPolyproline II helixtrans-67.7134.7173.8-13.427.9000109.5
333E35Very low37.5Very low185 Ų185145.3 Ų145.386%0.86480%0.796SS**PPolyproline II helixtrans-51.6142.4176.2-63.4175.2147.600111.6A331 A335A331-E333 PolarHBondContact O-N 3.48Å; E333-A335 VanDerWaalsContact C-N 3.27Å; E333-A335 PolarHBondContact O-N 3.31Å
334R40.8Very low37Very low257 Ų257143.2 Ų143.297%0.9779%0.794SS**  trans-62.790.3165.1-80177.5174.2168.6-3108.8
335A35.4Very low36.6Very low92 Ų92148.9 Ų148.976%0.7681%0.812SS**  trans-79.7119.3159.600000108.1E333E333-A335 VanDerWaalsContact C-N 3.27Å; E333-A335 PolarHBondContact O-N 3.31Å
336G42.8Very low36.6Very low81 Ų81152.6 Ų152.684%0.83582%0.819SS**  trans-62.7140.3169.900000110.6
337S37.5Very low36.2Very low118 Ų118154.1 Ų154.183%0.82582%0.822SS**  trans-133.4112.9162.771.30000110.1
338V40.1Very low36.3Very low129 Ų129151.4 Ų151.478%0.78282%0.815SS**  trans-67.7126.2163.9174.70000109
339Y34.8Very low35.9Very low210 Ų210147.5 Ų147.582%0.82481%0.808SS**  175108.9129.4-120.4-102.2000110.4
340T35.1Very low36Very low109 Ų109146.6 Ų146.667%0.66981%0.814SS**  71.1118.491.4-23.40000116.1
341R31.3Very low36.1Very low247 Ų247142.2 Ų142.293%0.93281%0.812SS**  175.4104.8113.4-157.7170.7-170.5166.70.7110.2
342S31.2Very low36.1Very low116 Ų116149.6 Ų149.681%0.81184%0.836SS**  trans-120.9134.4160.2-177.60000107.5
343T38.8Very low36Very low129 Ų129151 Ų15179%0.79184%0.838SS**  trans-41.6133.2-176.739.60000116
344G33.7Very low36.1Very low67 Ų67149.2 Ų149.269%0.69184%0.837SS**  trans-65.6159.214700000109.4
345E33.7Very low35.8Very low202 Ų202143.2 Ų143.294%0.94483%0.83SS**  -146.6154.651.4-77.8160.4146.600112.6
346Q37.1Very low35.9Very low178 Ų178146.2 Ų146.283%0.83283%0.834SS**  trans-86.9152.4166.6-71.1168.9-66.500110.4
347E35.1Very low35.4Very low186 Ų186150.3 Ų150.387%0.86983%0.834SS**  trans-172.5107.3138.4-104172.6-167.200107.1
348I36.6Very low35.3Very low143 Ų143152.4 Ų152.473%0.73383%0.834SS**  68.3105.181.8-61.6179.3000114.4
349S33.6Very low35Very low104 Ų104154.1 Ų154.173%0.72784%0.838SS**  trans58.9134.1137.4-52.50000123.3
350V36.8Very low35Very low143 Ų143149.8 Ų149.887%0.86784%0.839SS**  145.1128.8113.4175.80000112.1
351G36.5Very low35Very low69 Ų69153.2 Ų153.271%0.71185%0.853SS**  trans77.2134.915000000116.1
352L35.2Very low35.3Very low254 Ų254144.6 Ų144.6100%1.3385%0.846SS**  cis-155.1021.1-143.5117.4000108.5

Retrieved 352 of 352 residues in 642.9 ms (Link to these results)

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