A0A067XMK2_RAT Loading...

FMRP isoform 1

AlphaFold DB , UniProt , Accession A0A067XMK2, Species RAT (Rattus norvegicus, Rat), Gene Fmr1, Length 136 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
1P40.9Very low47.3Very low173 Ų173140.7 Ų140.7100%1.12383%0.826SS**  0153029.7-38.2000109.1
2P53.8Low47.4Very low123 Ų123141.3 Ų141.380%0.79983%0.832SS**  cis-67.2-136.1-22.636.8-38.4000108.9
3S39.8Very low47.1Very low97 Ų97134.6 Ų134.668%0.67881%0.811SS**  cis-153.6161-8.1380000107.5
4S49.4Very low46.8Very low116 Ų116133.2 Ų133.281%0.81181%0.811SS**  cis93.5119.814.8-50.90000116
5L51.8Low46.8Very low151 Ų151135 Ų13579%0.79181%0.814SS**  trans-64.3172.6-170.4-57.8167.7000114.9
6P54.4Low46.3Very low131 Ų131134.3 Ų134.385%0.85182%0.817SS**  -114.7125.8119.332.9-32.8000112.4
7S51.6Low46.3Very low102 Ų102132.3 Ų132.371%0.71381%0.81SS**  trans-77.1141.7163.3-51.10000109.6
8N37.1Very low46.6Very low151 Ų151135 Ų13581%0.80781%0.812SS**  trans-153.1110.9150.5-149.2-11.9000113
9N48.4Very low46.5Very low168 Ų168138.1 Ų138.190%0.89882%0.817SS**  trans-94.9104.2168.1-88.5-3.1000108.9
10S48.5Very low46.7Very low108 Ų108141.2 Ų141.276%0.75582%0.82SS**  trans-160.7112.5156.7-1690000111.8
11R44.2Very low46.8Very low228 Ų228143.6 Ų143.686%0.8682%0.82SS**  175.6134.2101.4-175163.6-176.3177.51.2111
12V48.3Very low47.1Very low147 Ų147142.9 Ų142.989%0.89180%0.802SS**  trans-84.8140.9166164.40000109.5
13G43.9Very low46.8Very low55 Ų55143.8 Ų143.857%0.56780%0.799SS**  trans104.4135.2-177.900000112
14S43.4Very low47.1Very low115 Ų115144.9 Ų144.980%0.80480%0.797SS**  cis-144162.410.8-61.90000112.7
15N46.3Very low47.2Very low160 Ų160144.2 Ų144.286%0.85679%0.789SS**  trans-54.3133.4169.651.7-54.6000113.1
16S38.6Very low47.3Very low123 Ų123144.9 Ų144.986%0.8679%0.785SS**  trans-144.4149.8158.1-167.30000109.3
17S47.4Very low47.3Very low101 Ų101146.8 Ų146.871%0.70678%0.783SS**  trans-75.6159.5-163.6-53.10000115.2
18E50.2Low47Very low181 Ų181147.7 Ų147.785%0.84678%0.779SS**  trans-5.6116.6147-60.2158.9111.300117.1
19E45.3Very low47.8Very low193 Ų193147 Ų14790%0.90278%0.781SS**  -158.399.5125.4-115.8-169116.800111.8
20K51.3Low48Very low201 Ų201145.1 Ų145.187%0.87477%0.766SS**  trans-153.9150.3162.4-103.6-178.8-177.6174.80106.5
21K47.8Very low48Very low191 Ų191147.7 Ų147.783%0.8376%0.764SS**  trans75.7137.8-157.8-44.9-93.8-170.8170.70109.7
22H47.1Very low48.5Very low158 Ų158140.7 Ų140.773%0.73175%0.75SS**  cis-150.4153.1-10.2-151.8-102.3000107.9D24H22-D24 PolarHBondContact O-N 2.87Å
23L48.3Very low49.1Very low142 Ų142137.4 Ų137.474%0.74373%0.725SS**  trans-69.9116.4159.5-11065.6000107.1T25L23-T25 PolarHBondContact O-N 3.34Å
24D46.8Very low49.7Very low120 Ų120140.5 Ų140.564%0.64274%0.735SS**  trans-79.558.8171.8-149.5-79.2000109H22 K26H22-D24 PolarHBondContact O-N 2.87Å; D24-K26 PolarHBondContact O-N 2.84Å; D24-K26 IonicContact OD1-NZ 2.74Å; D24-K26 PolarHBondContact OD1-NZ 3.45Å; D24-K26 IonicContact OD2-NZ 3.6Å
25T49.8Very low50.7Low103 Ų103141.9 Ų141.963%0.63273%0.734SS**  trans-70.481.6168.9-55.90000107.3L23 E27L23-T25 PolarHBondContact O-N 3.34Å; T25-E27 HydrophobicContact CG2-CB 4.44Å; T25-E27 PolarHBondContact O-N 3.12Å
26K55.2Low51.2Low164 Ų164135.9 Ų135.971%0.71370%0.704SS**  trans-76.341.7-177.2-136.1177.9-148100.70112.2D24 N28D24-K26 PolarHBondContact O-N 2.84Å; D24-K26 IonicContact OD1-NZ 2.74Å; D24-K26 PolarHBondContact OD1-NZ 3.45Å; D24-K26 IonicContact OD2-NZ 3.6Å; K26-N28 PolarHBondContact O-N 3.41Å
27E54.5Low52.3Low172 Ų172135.9 Ų135.980%0.80470%0.699SS**  trans-72.576.2164.2-167.9-174-171.300108.2T25T25-E27 HydrophobicContact CG2-CB 4.44Å; T25-E27 PolarHBondContact O-N 3.12Å
28N45.6Very low53.6Low120 Ų120139 Ų13964%0.64270%0.7SS**  trans-13462.7174.3-161.861.2000109K26 H30K26-N28 PolarHBondContact O-N 3.41Å; N28-H30 WeakPolarHBondContact ND2-CB 3.42Å; N28-H30 PolarHBondContact O-N 3.22Å
29T52.8Low55Low138 Ų138135.4 Ų135.485%0.84769%0.69SS**  trans-68.648.1161.9-45.80000109.7F31T29-F31 PolarHBondContact O-N 3.48Å
30H52.7Low56.8Low127 Ų127130 Ų13059%0.58867%0.665SS**  trans-76.279.5176.9-168.5-63.1000107.5N28 S32N28-H30 WeakPolarHBondContact ND2-CB 3.42Å; N28-H30 PolarHBondContact O-N 3.22Å; H30-S32 PolarHBondContact CE1-OG 2.69Å; H30-S32 PolarHBondContact ND1-OG 2.82Å; H30-S32 PolarHBondContact O-N 2.73Å
31F49.4Very low58.4Low162 Ų162130.4 Ų130.471%0.71166%0.661SS**  trans-67.577.1171.1-175.5-112.3000109.1T29 Q33T29-F31 PolarHBondContact O-N 3.48Å; F31-Q33 VanDerWaalsContact C-N 3.28Å; F31-Q33 HydrophobicContact CD1-CG 3.86Å; F31-Q33 HydrophobicContact CE1-CG 3.47Å; F31-Q33 VanDerWaalsContact CE1-CG 3.47Å; F31-Q33 HydrophobicContact CZ-CG 4.31Å; F31-Q33 PolarHBondContact O-N 3.14Å
32S53.8Low60.2Low81 Ų81124.1 Ų124.157%0.56664%0.638SS**  trans-61.192.4167-68.30000108H30 P34H30-S32 PolarHBondContact CE1-OG 2.69Å; H30-S32 PolarHBondContact ND1-OG 2.82Å; H30-S32 PolarHBondContact O-N 2.73Å; S32-P34 VanDerWaalsContact O-CD 3.3Å; S32-P34 WeakPolarHBondContact O-CD 3.45Å; S32-P34 VanDerWaalsContact O-N 3.12Å
33Q60.8Low61.9Low79 Ų79122.4 Ų122.437%0.36963%0.634SS.*  trans-54.5119164-78.3-167.5-30.800107.4F31 N35F31-Q33 VanDerWaalsContact C-N 3.28Å; F31-Q33 HydrophobicContact CD1-CG 3.86Å; F31-Q33 HydrophobicContact CE1-CG 3.47Å; F31-Q33 VanDerWaalsContact CE1-CG 3.47Å; F31-Q33 HydrophobicContact CZ-CG 4.31Å; F31-Q33 PolarHBondContact O-N 3.14Å; Q33-N35 VanDerWaalsContact C-N 3.35Å; Q33-N35 PolarHBondContact O-N 3.24Å
34P57.5Low63.6Low119 Ų119116.7 Ų116.777%0.77361%0.605SS**  trans-73.489.7-171.628.1-34.3000110.6S32 S36S32-P34 VanDerWaalsContact O-CD 3.3Å; S32-P34 WeakPolarHBondContact O-CD 3.45Å; S32-P34 VanDerWaalsContact O-N 3.12Å; P34-S36 PolarHBondContact O-N 3.48Å
35N63.9Low65.2Low145 Ų145113.2 Ų113.278%0.77559%0.588SS**  trans38.365.3163.7-64.1-12000114.8Q33 T37Q33-N35 VanDerWaalsContact C-N 3.35Å; Q33-N35 PolarHBondContact O-N 3.24Å; N35-T37 PolarHBondContact O-N 3.42Å; N35-T37 PolarHBondContact O-OG1 3.43Å; N35-T37 VanDerWaalsContact O-OG1 3.06Å
36S56.5Low66.4Low33 Ų33109.4 Ų109.423%0.23157%0.565CS.*  trans-75.557.6170.2-1640000110.6P34 K38 T72 D74P34-S36 PolarHBondContact O-N 3.48Å; S36-K38 PolarHBondContact O-N 3.17Å; S36-T72 VanDerWaalsContact O-CG2 3.28Å; S36-T72 WeakPolarHBondContact O-CG2 3.45Å; S36-D74 WeakPolarHBondContact CB-OD2 3.24Å; S36-D74 PolarHBondContact OG-OD2 2.94Å
37T62.3Low67Low124 Ų124104.7 Ų104.776%0.76155%0.553SS**  trans-66.22.3-167.4-26.70000114.6N35N35-T37 PolarHBondContact O-N 3.42Å; N35-T37 PolarHBondContact O-OG1 3.43Å; N35-T37 VanDerWaalsContact O-OG1 3.06Å
38K73.2Confident67.3Low167 Ų167100 Ų10073%0.72653%0.532SS*.  trans-99.791.9179.6-68.8-174.8178.5-179.20110.3S36 Q40S36-K38 PolarHBondContact O-N 3.17Å; K38-Q40 PolarHBondContact O-N 3.09Å; K38-Q40 PolarHBondContact O-NE2 3.2Å
39V80.4Confident67.8Low104 Ų10499.1 Ų99.163%0.6353%0.531SS*.  trans-59.4129.8168.8-179.30000109.4V70 G71V39-V70 HydrophobicContact CG1-CG1 3.9Å; V39-G71 CarbonylContact C-O 3.56Å; V39-G71 VanDerWaalsContact CA-O 3.31Å; V39-G71 WeakPolarHBondContact CA-O 3.48Å
40Q83.7Confident67.8Low80 Ų8095.6 Ų95.637%0.37452%0.517SS..EExtended strand (participates in β ladder)trans-121167.7177.7-80.115489.400110.3K38 V70 G71 I76K38-Q40 PolarHBondContact O-N 3.09Å; K38-Q40 PolarHBondContact O-NE2 3.2Å; Q40-V70 WeakPolarHBondContact O-CA 3.43Å; Q40-G71 PolarHBondContact N-O 3.25Å; Q40-G71 PolarHBondContact O-N 3.31Å; Q40-I76 HydrophobicContact CB-CD1 3.84Å
41R84.9Confident67.8Low210 Ų21093.6 Ų93.679%0.79253%0.53SS*.EExtended strand (participates in β ladder)trans-129.2123.6173.1-56.4-175.1-168150.53.5107.7V68 F69 V70R41-V68 HydrophobicContact CB-CG1 3.87Å; R41-F69 WeakPolarHBondContact CA-O 3.35Å; R41-V70 HydrophobicContact CG-CG1 4.42Å; R41-V70 HydrophobicContact CG-CG2 4.19Å
42V84.6Confident68.1Low58 Ų5888 Ų8835%0.35252%0.518SS..EExtended strand (participates in β ladder)trans-120.5121.1176.8175.60000108.5V44 V68 F69 I76V42-V44 HydrophobicContact CG1-CG2 4.08Å; V42-V68 WeakPolarHBondContact O-CA 3.33Å; V42-F69 PolarHBondContact N-O 3.06Å; V42-F69 PolarHBondContact O-N 2.88Å; V42-I76 HydrophobicContact CB-CG2 4.01Å; V42-I76 HydrophobicContact CG2-CD1 4.36Å; V42-I76 HydrophobicContact CG2-CG2 3.83Å
43L83.5Confident68.1Low122 Ų12291 Ų9164%0.63954%0.536SS*.EExtended strand (participates in β ladder)trans-72.3126.2172.3178.465.1000108.9V45 P66 V68L43-V45 HydrophobicContact CG-CG2 4.48Å; L43-P66 HydrophobicContact CD1-CB 4.26Å; L43-V68 HydrophobicContact CD1-CG2 4.1Å
44V83.8Confident67.6Low23 Ų2394.9 Ų94.914%0.13955%0.554CS.*EExtended strand (participates in β ladder)trans-127.3147.9177.2-1760000107.9V42 F67 F69 L83V42-V44 HydrophobicContact CG1-CG2 4.08Å; V44-F67 HydrophobicContact CB-CD2 4.37Å; V44-F67 HydrophobicContact CB-CE1 4.37Å; V44-F67 HydrophobicContact CB-CE2 3.92Å; V44-F67 HydrophobicContact CB-CZ 3.93Å; V44-F67 HydrophobicContact CG1-CE1 4.12Å; V44-F67 HydrophobicContact CG1-CE2 4.08Å; V44-F67 HydrophobicContact CG1-CZ 3.64Å; V44-F67 PolarHBondContact N-O 3.22Å; V44-F67 PolarHBondContact O-N 3.39Å; V44-F69 HydrophobicContact CG2-CD2 3.68Å; V44-F69 HydrophobicContact CG2-CE2 3.99Å; V44-L83 HydrophobicContact CG1-CD2 3.48Å; V44-L83 VanDerWaalsContact CG1-CD2 3.48Å
45V80.1Confident67.1Low47 Ų4798.2 Ų98.229%0.28556%0.556SS.*EExtended strand (participates in β ladder)trans-132.6119.8-174-171.10000109.2L43 W61 M64 P66L43-V45 HydrophobicContact CG-CG2 4.48Å; V45-W61 HydrophobicContact CB-CE3 4.33Å; V45-W61 HydrophobicContact CB-CZ3 3.85Å; V45-W61 HydrophobicContact CG1-CE3 3.72Å; V45-W61 HydrophobicContact CG1-CZ3 3.76Å; V45-W61 HydrophobicContact CG2-CE3 4.5Å; V45-W61 HydrophobicContact CG2-CZ3 3.96Å; V45-M64 HydrophobicContact CG1-CB 3.63Å; V45-M64 HydrophobicContact CG1-CG 4.3Å; V45-M64 HydrophobicContact CG1-SD 3.74Å; V45-P66 HydrophobicContact CG2-CB 4.43Å
46S75.4Confident66.5Low22 Ų2297.6 Ų97.615%0.15456%0.56CS.*EExtended strand (participates in β ladder)trans-82.6138.8179590000111.5M64 V65S46-M64 VanDerWaalsContact O-CA 3.22Å; S46-M64 WeakPolarHBondContact O-CA 3.48Å; S46-M64 WeakPolarHBondContact O-CB 3.24Å; S46-M64 WeakPolarHBondContact O-CG 3.36Å; S46-V65 PolarHBondContact N-O 3.49Å; S46-V65 VanDerWaalsContact N-O 3.14Å; S46-V65 PolarHBondContact O-N 3.34Å; S46-V65 PolarHBondContact OG-N 2.92Å; S46-V65 PolarHBondContact OG-O 3.11Å
47S67.4Low66.3Low65 Ų65100.9 Ų100.946%0.45557%0.572SS.*PPolyproline II helixtrans-74.9127.6162.6-164.60000109.5
48I61.6Low65.9Low73 Ų73100.4 Ų100.437%0.37457%0.571SS.*PPolyproline II helixtrans-76.3153.4156.757.6163.7000109.9A50 G63I48-A50 VanDerWaalsContact C-N 3.28Å; I48-A50 HydrophobicContact CD1-CB 4.03Å; I48-A50 HydrophobicContact CG1-CB 4.29Å; I48-A50 PolarHBondContact O-N 3.5Å; I48-A50 VanDerWaalsContact O-N 3.17Å; I48-G63 WeakPolarHBondContact CD1-O 3.5Å; I48-G63 WeakPolarHBondContact CG1-O 3.43Å; I48-G63 WeakPolarHBondContact CG2-O 3.39Å
49V55.8Low65.1Low102 Ų10297.3 Ų97.362%0.61856%0.557SS**  trans-82.581.2162.7173.70000107.6G51V49-G51 PolarHBondContact O-N 3.5Å
50A52.3Low63.9Low65 Ų6595.4 Ų95.454%0.53755%0.553SS.*  trans-80.5105160.700000107.3I48 G52I48-A50 VanDerWaalsContact C-N 3.28Å; I48-A50 HydrophobicContact CD1-CB 4.03Å; I48-A50 HydrophobicContact CG1-CB 4.29Å; I48-A50 PolarHBondContact O-N 3.5Å; I48-A50 VanDerWaalsContact O-N 3.17Å; A50-G52 PolarHBondContact O-N 2.82Å
51G52.4Low62.7Low84 Ų8499.9 Ų99.987%0.86657%0.566SS**SBendtrans-64.298-173.700000113.2V49V49-G51 PolarHBondContact O-N 3.5Å
52G55.6Low61.5Low45 Ų4596.5 Ų96.546%0.46456%0.559SS.*SBendtrans169.4141.9171.500000112.9A50 Q54A50-G52 PolarHBondContact O-N 2.82Å; G52-Q54 VanDerWaalsContact C-N 3.3Å; G52-Q54 PolarHBondContact O-N 3.02Å
53P54.6Low60.9Low144 Ų14495.8 Ų95.894%0.93556%0.564SS**  trans-75.878.6178.831.8-35.2000110.8K55P53-K55 PolarHBondContact O-N 3Å
54Q50.2Low60.8Low161 Ų16192.3 Ų92.375%0.75255%0.545SS*.  trans-78.8118.7179.1-65.2-152.3-1.700112G52G52-Q54 VanDerWaalsContact C-N 3.3Å; G52-Q54 PolarHBondContact O-N 3.02Å
55K47.2Very low60.8Low188 Ų18895.2 Ų95.282%0.81756%0.562SS**  trans-47.5141166.7-177.9-178.7-178.6-179.90110.5P53 E57P53-K55 PolarHBondContact O-N 3Å; K55-E57 PolarHBondContact O-N 3.15Å
56P52Low61.2Low132 Ų13297 Ų9786%0.85758%0.575SS**  trans-67.489.3-176.426.6-35.2000112.8
57E50.6Low61.9Low102 Ų10298.9 Ų98.948%0.47758%0.581SS.*  trans-92.3163.2161.5-115.8-144.388.900109.9K55 K59 A60K55-E57 PolarHBondContact O-N 3.15Å; E57-K59 HydrophobicContact CB-CB 4.36Å; E57-K59 PolarHBondContact O-N 3.28Å; E57-K59 IonicContact OE1-NZ 3.32Å; E57-K59 PolarHBondContact OE1-NZ 2.91Å; E57-K59 WeakPolarHBondContact OE2-CE 3.29Å; E57-K59 IonicContact OE2-NZ 2.68Å; E57-K59 PolarHBondContact OE2-NZ 2.83Å; E57-A60 PolarHBondContact O-N 3.1Å
58P54.6Low63.2Low114 Ų11499.3 Ų99.374%0.7458%0.58SS**G310 helixtrans-61.3-5.3171.626.3-34.9000114.4A60P58-A60 PolarHBondContact O-N 3.42Å
59K55.6Low64.8Low103 Ų10397.9 Ų97.945%0.44857%0.571SS.*G310 helixtrans-73.89.8169.5-62.6178.4-170.81380114.3E57 W61 Q62E57-K59 HydrophobicContact CB-CB 4.36Å; E57-K59 PolarHBondContact O-N 3.28Å; E57-K59 IonicContact OE1-NZ 3.32Å; E57-K59 PolarHBondContact OE1-NZ 2.91Å; E57-K59 WeakPolarHBondContact OE2-CE 3.29Å; E57-K59 IonicContact OE2-NZ 2.68Å; E57-K59 PolarHBondContact OE2-NZ 2.83Å; K59-W61 PolarHBondContact O-N 2.92Å; K59-Q62 HydrophobicContact CB-CB 4.16Å; K59-Q62 WeakPolarHBondContact O-CB 3.35Å; K59-Q62 PolarHBondContact O-N 3.06Å
60A56.9Low66.6Low64 Ų6497.6 Ų97.653%0.52957%0.569SS.*G310 helixtrans-52-28.2173.800000113.6E57 P58 M64E57-A60 PolarHBondContact O-N 3.1Å; P58-A60 PolarHBondContact O-N 3.42Å; A60-M64 VanDerWaalsContact O-CE 3.25Å; A60-M64 WeakPolarHBondContact O-CE 3.46Å
61W57.5Low68.5Low173 Ų17395.2 Ų95.266%0.65555%0.552SS**G310 helixtrans-82.1-4.3175.6-48.4110.9000114.9V45 K59 G63 M64V45-W61 HydrophobicContact CB-CE3 4.33Å; V45-W61 HydrophobicContact CB-CZ3 3.85Å; V45-W61 HydrophobicContact CG1-CE3 3.72Å; V45-W61 HydrophobicContact CG1-CZ3 3.76Å; V45-W61 HydrophobicContact CG2-CE3 4.5Å; V45-W61 HydrophobicContact CG2-CZ3 3.96Å; K59-W61 PolarHBondContact O-N 2.92Å; W61-G63 PolarHBondContact O-N 2.68Å; W61-M64 HydrophobicContact CE3-SD 3.57Å; W61-M64 VanDerWaalsContact CE3-SD 3.57Å; W61-M64 HydrophobicContact CZ3-SD 4.07Å; W61-M64 WeakPolarHBondContact O-CB 3.3Å; W61-M64 PolarHBondContact O-N 2.99Å
62Q60.9Low70.5Confident139 Ų13993.1 Ų93.165%0.6552%0.522SS*.THydrogen-bonded Turntrans-68102.3-170.3-170.587.944.800111.1K59K59-Q62 HydrophobicContact CB-CB 4.16Å; K59-Q62 WeakPolarHBondContact O-CB 3.35Å; K59-Q62 PolarHBondContact O-N 3.06Å
63G71.4Confident72.2Confident43 Ų4397.3 Ų97.344%0.44353%0.528SS..THydrogen-bonded Turntrans88.6-2.8-176.800000114.5I48 W61I48-G63 WeakPolarHBondContact CD1-O 3.5Å; I48-G63 WeakPolarHBondContact CG1-O 3.43Å; I48-G63 WeakPolarHBondContact CG2-O 3.39Å; W61-G63 PolarHBondContact O-N 2.68Å
64M80.1Confident74Confident50 Ų5093.3 Ų93.325%0.24650%0.498CS..  trans-61.1139.6166.6-71.5-162.616600110.5V45 S46 A60 W61 P66V45-M64 HydrophobicContact CG1-CB 3.63Å; V45-M64 HydrophobicContact CG1-CG 4.3Å; V45-M64 HydrophobicContact CG1-SD 3.74Å; S46-M64 VanDerWaalsContact O-CA 3.22Å; S46-M64 WeakPolarHBondContact O-CA 3.48Å; S46-M64 WeakPolarHBondContact O-CB 3.24Å; S46-M64 WeakPolarHBondContact O-CG 3.36Å; A60-M64 VanDerWaalsContact O-CE 3.25Å; A60-M64 WeakPolarHBondContact O-CE 3.46Å; W61-M64 HydrophobicContact CE3-SD 3.57Å; W61-M64 VanDerWaalsContact CE3-SD 3.57Å; W61-M64 HydrophobicContact CZ3-SD 4.07Å; W61-M64 WeakPolarHBondContact O-CB 3.3Å; W61-M64 PolarHBondContact O-N 2.99Å; M64-P66 WeakPolarHBondContact O-CD 3.41Å
65V85Confident76.1Confident84 Ų8487.9 Ų87.951%0.50948%0.478SS..EExtended strand (participates in β ladder)trans-98.4111.3177.9-176.20000109.1S46S46-V65 PolarHBondContact N-O 3.49Å; S46-V65 VanDerWaalsContact N-O 3.14Å; S46-V65 PolarHBondContact O-N 3.34Å; S46-V65 PolarHBondContact OG-N 2.92Å; S46-V65 PolarHBondContact OG-O 3.11Å
66P88.4Confident78.4Confident85 Ų8579.6 Ų79.655%0.55244%0.442SS*.EExtended strand (participates in β ladder)trans-77.4139.9174.932.1-34.1000110.6L43 V45 M64L43-P66 HydrophobicContact CD1-CB 4.26Å; V45-P66 HydrophobicContact CG2-CB 4.43Å; M64-P66 WeakPolarHBondContact O-CD 3.41Å
67F90.8Very high80.4Confident61 Ų6175.7 Ų75.727%0.26842%0.422SS..EExtended strand (participates in β ladder)trans-146.6172.4173.163.9-85.6000110.7V44 F69 L83V44-F67 HydrophobicContact CB-CD2 4.37Å; V44-F67 HydrophobicContact CB-CE1 4.37Å; V44-F67 HydrophobicContact CB-CE2 3.92Å; V44-F67 HydrophobicContact CB-CZ 3.93Å; V44-F67 HydrophobicContact CG1-CE1 4.12Å; V44-F67 HydrophobicContact CG1-CE2 4.08Å; V44-F67 HydrophobicContact CG1-CZ 3.64Å; V44-F67 PolarHBondContact N-O 3.22Å; V44-F67 PolarHBondContact O-N 3.39Å; F67-F69 HydrophobicContact CE2-CD1 4.33Å; F67-F69 AromaticContact CE2-CE1 3.86Å; F67-F69 HydrophobicContact CE2-CE1 3.86Å; F67-F69 HydrophobicContact CE2-CE2 4.17Å; F67-F69 AromaticContact CE2-CZ 3.78Å; F67-F69 HydrophobicContact CE2-CZ 3.78Å; F67-F69 HydrophobicContact CZ-CZ 4.46Å; F67-L83 HydrophobicContact CE2-CD2 4.4Å; F67-L83 HydrophobicContact CZ-CD1 3.89Å; F67-L83 HydrophobicContact CZ-CD2 3.65Å; F67-L83 HydrophobicContact CZ-CG 4.43Å
68V93.4Very high82.5Confident73 Ų7375.3 Ų75.344%0.44242%0.423SS..EExtended strand (participates in β ladder)trans-130.3124.1-174.21790000109.8R41 V42 L43 V70R41-V68 HydrophobicContact CB-CG1 3.87Å; V42-V68 WeakPolarHBondContact O-CA 3.33Å; L43-V68 HydrophobicContact CD1-CG2 4.1Å; V68-V70 HydrophobicContact CG1-CG2 3.88Å
69F94.6Very high84.4Confident44 Ų4471.2 Ų71.219%0.19340%0.398CS..EExtended strand (participates in β ladder)trans-77.7129.8164.4-70-48.5000109.5R41 V42 V44 F67 I76 A79 L83R41-F69 WeakPolarHBondContact CA-O 3.35Å; V42-F69 PolarHBondContact N-O 3.06Å; V42-F69 PolarHBondContact O-N 2.88Å; V44-F69 HydrophobicContact CG2-CD2 3.68Å; V44-F69 HydrophobicContact CG2-CE2 3.99Å; F67-F69 HydrophobicContact CE2-CD1 4.33Å; F67-F69 AromaticContact CE2-CE1 3.86Å; F67-F69 HydrophobicContact CE2-CE1 3.86Å; F67-F69 HydrophobicContact CE2-CE2 4.17Å; F67-F69 AromaticContact CE2-CZ 3.78Å; F67-F69 HydrophobicContact CE2-CZ 3.78Å; F67-F69 HydrophobicContact CZ-CZ 4.46Å; F69-I76 HydrophobicContact CB-CG1 4.09Å; F69-I76 HydrophobicContact CB-CG2 4.05Å; F69-I76 HydrophobicContact CD2-CG2 4.42Å; F69-A79 HydrophobicContact CD1-CB 4Å; F69-A79 HydrophobicContact CD2-CB 4.23Å; F69-A79 HydrophobicContact CE1-CB 3.72Å; F69-A79 HydrophobicContact CE2-CB 3.97Å; F69-A79 HydrophobicContact CG-CB 4.26Å; F69-A79 HydrophobicContact CZ-CB 3.71Å; F69-L83 HydrophobicContact CE2-CD2 4.22Å; F69-L83 HydrophobicContact CZ-CB 4.26Å; F69-L83 HydrophobicContact CZ-CD2 4.25Å
70V94Very high86.2Confident95 Ų9568.3 Ų68.358%0.57639%0.39SS*.EExtended strand (participates in β ladder)trans-124.7122.1177.1-174.40000108.4V39 Q40 R41 V68V39-V70 HydrophobicContact CG1-CG1 3.9Å; Q40-V70 WeakPolarHBondContact O-CA 3.43Å; R41-V70 HydrophobicContact CG-CG1 4.42Å; R41-V70 HydrophobicContact CG-CG2 4.19Å; V68-V70 HydrophobicContact CG1-CG2 3.88Å
71G93.3Very high88.1Confident16 Ų1670.1 Ų70.117%0.16539%0.394CS..EExtended strand (participates in β ladder)trans170.3-168.8-174.700000112.7V39 Q40V39-G71 CarbonylContact C-O 3.56Å; V39-G71 VanDerWaalsContact CA-O 3.31Å; V39-G71 WeakPolarHBondContact CA-O 3.48Å; Q40-G71 PolarHBondContact N-O 3.25Å; Q40-G71 PolarHBondContact O-N 3.31Å
72T94.6Very high89.9Confident40 Ų4066.9 Ų66.925%0.24539%0.389CS..  trans-67.9159.4168.871.20000110.5S36 D74 S75 I76S36-T72 VanDerWaalsContact O-CG2 3.28Å; S36-T72 WeakPolarHBondContact O-CG2 3.45Å; T72-D74 PolarHBondContact O-N 3.04Å; T72-D74 VanDerWaalsContact O-N 3.11Å; T72-S75 PolarHBondContact N-OG 3.11Å; T72-S75 PolarHBondContact O-N 3.12Å; T72-S75 PolarHBondContact O-OG 3.46Å; T72-S75 WeakPolarHBondContact OG1-CB 3.44Å; T72-S75 PolarHBondContact OG1-N 3.34Å; T72-S75 VanDerWaalsContact OG1-N 3.12Å; T72-S75 PolarHBondContact OG1-OG 2.93Å; T72-I76 WeakPolarHBondContact O-CG1 3.37Å; T72-I76 PolarHBondContact O-N 3.04Å
73K90.1Very high91.5Very high133 Ų13361.9 Ų61.958%0.57837%0.366SS*.Hα-helixtrans-49.6-42.8177.8-167.2-168.8174.8-167.40111.8I76 A77K73-I76 PolarHBondContact O-N 3.49Å; K73-A77 PolarHBondContact O-N 2.87Å
74D92.4Very high92.5Very high59 Ų5964.2 Ų64.232%0.31637%0.369SS..Hα-helixtrans-80.4-36.6-170.3-42.4-77.9000111S36 T72 I76 A77 N78S36-D74 WeakPolarHBondContact CB-OD2 3.24Å; S36-D74 PolarHBondContact OG-OD2 2.94Å; T72-D74 PolarHBondContact O-N 3.04Å; T72-D74 VanDerWaalsContact O-N 3.11Å; D74-I76 VanDerWaalsContact C-N 3.31Å; D74-I76 PolarHBondContact O-N 3.47Å; D74-A77 PolarHBondContact O-N 3.49Å; D74-N78 WeakPolarHBondContact O-CB 3.3Å; D74-N78 PolarHBondContact O-N 3.01Å; D74-N78 PolarHBondContact O-OD1 2.98Å
75S94.7Very high93.3Very high48 Ų4869.1 Ų69.134%0.33639%0.385SS..Hα-helixtrans-63-36.4169.467.30000112.6T72 A79T72-S75 PolarHBondContact N-OG 3.11Å; T72-S75 PolarHBondContact O-N 3.12Å; T72-S75 PolarHBondContact O-OG 3.46Å; T72-S75 WeakPolarHBondContact OG1-CB 3.44Å; T72-S75 PolarHBondContact OG1-N 3.34Å; T72-S75 VanDerWaalsContact OG1-N 3.12Å; T72-S75 PolarHBondContact OG1-OG 2.93Å; S75-A79 VanDerWaalsContact O-CB 3.32Å; S75-A79 WeakPolarHBondContact O-CB 3.35Å; S75-A79 PolarHBondContact O-N 3.17Å
76I94.6Very high93.8Very high13 Ų1370.2 Ų70.27%0.06739%0.385CS..Hα-helixtrans-70.5-45.2177.3-65.9167.6000110Q40 V42 F69 T72 K73 D74 N78 A79 T80Q40-I76 HydrophobicContact CB-CD1 3.84Å; V42-I76 HydrophobicContact CB-CG2 4.01Å; V42-I76 HydrophobicContact CG2-CD1 4.36Å; V42-I76 HydrophobicContact CG2-CG2 3.83Å; F69-I76 HydrophobicContact CB-CG1 4.09Å; F69-I76 HydrophobicContact CB-CG2 4.05Å; F69-I76 HydrophobicContact CD2-CG2 4.42Å; T72-I76 WeakPolarHBondContact O-CG1 3.37Å; T72-I76 PolarHBondContact O-N 3.04Å; K73-I76 PolarHBondContact O-N 3.49Å; D74-I76 VanDerWaalsContact C-N 3.31Å; D74-I76 PolarHBondContact O-N 3.47Å; I76-N78 VanDerWaalsContact C-N 3.35Å; I76-N78 PolarHBondContact O-N 3.01Å; I76-A79 PolarHBondContact O-N 3.26Å; I76-T80 PolarHBondContact O-N 2.95Å; I76-T80 PolarHBondContact O-OG1 3.18Å
77A94.1Very high93.9Very high51 Ų5168 Ų6842%0.42137%0.368SS..Hα-helixtrans-58.2-45.8175.800000112K73 D74 A79 T80 V81K73-A77 PolarHBondContact O-N 2.87Å; D74-A77 PolarHBondContact O-N 3.49Å; A77-A79 PolarHBondContact O-N 3.44Å; A77-T80 PolarHBondContact O-N 2.92Å; A77-V81 PolarHBondContact O-N 2.99Å
78N95.4Very high94Very high94 Ų9469.3 Ų69.350%0.50338%0.378SS..Hα-helixtrans-61.4-42.9175.6-68-5.8000111.9D74 I76 V81 L82D74-N78 WeakPolarHBondContact O-CB 3.3Å; D74-N78 PolarHBondContact O-N 3.01Å; D74-N78 PolarHBondContact O-OD1 2.98Å; I76-N78 VanDerWaalsContact C-N 3.35Å; I76-N78 PolarHBondContact O-N 3.01Å; N78-V81 PolarHBondContact O-N 3.27Å; N78-L82 WeakPolarHBondContact O-CG 3.46Å; N78-L82 PolarHBondContact O-N 3.41Å; N78-L82 VanDerWaalsContact O-N 3.17Å
79A95.1Very high94.2Very high27 Ų2772 Ų7222%0.22338%0.381CS..Hα-helixtrans-65.8-37.5179.100000112.9F69 S75 I76 A77 L82 L83F69-A79 HydrophobicContact CD1-CB 4Å; F69-A79 HydrophobicContact CD2-CB 4.23Å; F69-A79 HydrophobicContact CE1-CB 3.72Å; F69-A79 HydrophobicContact CE2-CB 3.97Å; F69-A79 HydrophobicContact CG-CB 4.26Å; F69-A79 HydrophobicContact CZ-CB 3.71Å; S75-A79 VanDerWaalsContact O-CB 3.32Å; S75-A79 WeakPolarHBondContact O-CB 3.35Å; S75-A79 PolarHBondContact O-N 3.17Å; I76-A79 PolarHBondContact O-N 3.26Å; A77-A79 PolarHBondContact O-N 3.44Å; A79-L82 PolarHBondContact O-N 2.95Å; A79-L83 WeakPolarHBondContact O-CB 3.12Å; A79-L83 PolarHBondContact O-N 3.35Å
80T93.5Very high94.2Very high43 Ų4374.5 Ų74.526%0.26440%0.396SS..Hα-helixtrans-63.2-45.9174.4-59.40000111.7I76 A77 L82 L83 D84I76-T80 PolarHBondContact O-N 2.95Å; I76-T80 PolarHBondContact O-OG1 3.18Å; A77-T80 PolarHBondContact O-N 2.92Å; T80-L82 VanDerWaalsContact C-N 3.34Å; T80-L82 PolarHBondContact O-N 3.06Å; T80-L83 WeakPolarHBondContact O-CB 3.07Å; T80-L83 PolarHBondContact O-N 3.41Å; T80-D84 PolarHBondContact O-N 2.99Å
81V95.8Very high94Very high102 Ų10275.5 Ų75.562%0.61839%0.392SS*.Hα-helixtrans-61.9-41.5178.9173.70000111.8A77 N78 Y85A77-V81 PolarHBondContact O-N 2.99Å; N78-V81 PolarHBondContact O-N 3.27Å; V81-Y85 WeakPolarHBondContact O-CB 3.08Å; V81-Y85 PolarHBondContact O-N 3.14Å; V81-Y85 VanDerWaalsContact O-N 3.11Å
82L96.5Very high94.1Very high105 Ų10579.2 Ų79.255%0.5541%0.405SS..Hα-helixtrans-65.7-40.3175.7-69.1171.6000112.1N78 A79 T80 H86N78-L82 WeakPolarHBondContact O-CG 3.46Å; N78-L82 PolarHBondContact O-N 3.41Å; N78-L82 VanDerWaalsContact O-N 3.17Å; A79-L82 PolarHBondContact O-N 2.95Å; T80-L82 VanDerWaalsContact C-N 3.34Å; T80-L82 PolarHBondContact O-N 3.06Å; L82-H86 PolarHBondContact O-CD2 3.49Å; L82-H86 PolarHBondContact O-N 3.4Å; L82-H86 VanDerWaalsContact O-N 3.07Å
83L94.1Very high94.2Very high34 Ų3478.8 Ų78.818%0.17840%0.403CS..Hα-helixtrans-61.8-50175.117776.8000111.6V44 F67 F69 A79 T80 Y85 H86 L87V44-L83 HydrophobicContact CG1-CD2 3.48Å; V44-L83 VanDerWaalsContact CG1-CD2 3.48Å; F67-L83 HydrophobicContact CE2-CD2 4.4Å; F67-L83 HydrophobicContact CZ-CD1 3.89Å; F67-L83 HydrophobicContact CZ-CD2 3.65Å; F67-L83 HydrophobicContact CZ-CG 4.43Å; F69-L83 HydrophobicContact CE2-CD2 4.22Å; F69-L83 HydrophobicContact CZ-CB 4.26Å; F69-L83 HydrophobicContact CZ-CD2 4.25Å; A79-L83 WeakPolarHBondContact O-CB 3.12Å; A79-L83 PolarHBondContact O-N 3.35Å; T80-L83 WeakPolarHBondContact O-CB 3.07Å; T80-L83 PolarHBondContact O-N 3.41Å; L83-Y85 VanDerWaalsContact C-N 3.28Å; L83-Y85 PolarHBondContact O-N 2.88Å; L83-H86 PolarHBondContact O-N 2.88Å; L83-H86 VanDerWaalsContact O-N 3.16Å; L83-L87 HydrophobicContact CD1-CD1 4.03Å; L83-L87 HydrophobicContact CD1-CG 4.14Å; L83-L87 HydrophobicContact CD2-CD1 4.18Å; L83-L87 HydrophobicContact CG-CD1 3.75Å; L83-L87 HydrophobicContact CG-CG 4.18Å; L83-L87 WeakPolarHBondContact O-CB 3.22Å; L83-L87 WeakPolarHBondContact O-CG 3.19Å; L83-L87 PolarHBondContact O-N 3.46Å
84D92.6Very high94.3Very high92 Ų9275 Ų7549%0.49239%0.389SS..Hα-helixtrans-61.2-39.4-178.5-73.5-29.7000111.2T80 L87 N88T80-D84 PolarHBondContact O-N 2.99Å; D84-L87 PolarHBondContact O-N 3.38Å; D84-N88 WeakPolarHBondContact O-CB 3.34Å; D84-N88 PolarHBondContact O-N 3.16Å
85Y96.8Very high94.5Very high153 Ų15378.5 Ų78.560%0.640%0.403SS*.Hα-helixtrans-58.7-50.8171.7172.6-102.5000112.4V81 L83 N88 Y89V81-Y85 WeakPolarHBondContact O-CB 3.08Å; V81-Y85 PolarHBondContact O-N 3.14Å; V81-Y85 VanDerWaalsContact O-N 3.11Å; L83-Y85 VanDerWaalsContact C-N 3.28Å; L83-Y85 PolarHBondContact O-N 2.88Å; Y85-N88 PolarHBondContact O-N 3.04Å; Y85-Y89 PolarHBondContact O-N 3.26Å
86H94.9Very high94.6Very high106 Ų10680.5 Ų80.549%0.49141%0.41SS..Hα-helixtrans-66.4-38.4179.4-69.9-51.7000112.9L82 L83 N88 Y89 L90L82-H86 PolarHBondContact O-CD2 3.49Å; L82-H86 PolarHBondContact O-N 3.4Å; L82-H86 VanDerWaalsContact O-N 3.07Å; L83-H86 PolarHBondContact O-N 2.88Å; L83-H86 VanDerWaalsContact O-N 3.16Å; H86-N88 VanDerWaalsContact C-N 3.32Å; H86-Y89 PolarHBondContact O-N 2.83Å; H86-L90 WeakPolarHBondContact O-CG 3.44Å; H86-L90 PolarHBondContact O-N 2.98Å
87L91.5Very high94.6Very high39 Ų3987 Ų8720%0.20443%0.433CS..Hα-helixtrans-68.3-29.8174.7-69.3177.3000112.4L83 D84 K91L83-L87 HydrophobicContact CD1-CD1 4.03Å; L83-L87 HydrophobicContact CD1-CG 4.14Å; L83-L87 HydrophobicContact CD2-CD1 4.18Å; L83-L87 HydrophobicContact CG-CD1 3.75Å; L83-L87 HydrophobicContact CG-CG 4.18Å; L83-L87 WeakPolarHBondContact O-CB 3.22Å; L83-L87 WeakPolarHBondContact O-CG 3.19Å; L83-L87 PolarHBondContact O-N 3.46Å; D84-L87 PolarHBondContact O-N 3.38Å; L87-K91 WeakPolarHBondContact O-CD 3.3Å; L87-K91 WeakPolarHBondContact O-CE 3.45Å; L87-K91 VanDerWaalsContact O-CG 3.3Å; L87-K91 WeakPolarHBondContact O-CG 3.36Å
88N93.1Very high94.7Very high88 Ų8890.2 Ų90.247%0.47144%0.443SS..Hα-helixtrans-70.3-49.6171.9-16880.5000111.4D84 Y85 H86 L90 K91 E92D84-N88 WeakPolarHBondContact O-CB 3.34Å; D84-N88 PolarHBondContact O-N 3.16Å; Y85-N88 PolarHBondContact O-N 3.04Å; H86-N88 VanDerWaalsContact C-N 3.32Å; N88-L90 VanDerWaalsContact C-N 3.28Å; N88-L90 PolarHBondContact O-N 2.86Å; N88-K91 WeakPolarHBondContact O-CB 3.48Å; N88-K91 PolarHBondContact O-N 2.68Å; N88-E92 PolarHBondContact O-N 2.84Å
89Y96.4Very high94.8Very high129 Ų12990.7 Ų90.751%0.50644%0.442SS..Hα-helixtrans-55.4-41.2-180176.2-106.9000112.8Y85 H86 K91 E92 V93Y85-Y89 PolarHBondContact O-N 3.26Å; H86-Y89 PolarHBondContact O-N 2.83Å; Y89-K91 PolarHBondContact O-N 3.32Å; Y89-E92 PolarHBondContact O-N 3.03Å; Y89-V93 HydrophobicContact CD1-CG2 4.43Å; Y89-V93 HydrophobicContact CD2-CG2 4.21Å; Y89-V93 HydrophobicContact CE1-CG2 3.95Å; Y89-V93 HydrophobicContact CE2-CG2 3.71Å; Y89-V93 WeakPolarHBondContact O-CG2 3.48Å; Y89-V93 PolarHBondContact O-N 3.07Å
90L93.9Very high94.8Very high97 Ų9797.2 Ų97.251%0.50846%0.461SS..Hα-helixtrans-62.9-42.1176.2-69.1173.1000112.6H86 N88 V93 D94H86-L90 WeakPolarHBondContact O-CG 3.44Å; H86-L90 PolarHBondContact O-N 2.98Å; N88-L90 VanDerWaalsContact C-N 3.28Å; N88-L90 PolarHBondContact O-N 2.86Å; L90-V93 PolarHBondContact O-N 2.93Å; L90-D94 PolarHBondContact O-N 2.93Å
91K90.9Very high95Very high116 Ų116100.6 Ų100.650%0.50448%0.477SS..Hα-helixtrans-65.4-39.2176.4-65.3164.4-171.4169.80112L87 N88 Y89 D94 Q95L87-K91 WeakPolarHBondContact O-CD 3.3Å; L87-K91 WeakPolarHBondContact O-CE 3.45Å; L87-K91 VanDerWaalsContact O-CG 3.3Å; L87-K91 WeakPolarHBondContact O-CG 3.36Å; N88-K91 WeakPolarHBondContact O-CB 3.48Å; N88-K91 PolarHBondContact O-N 2.68Å; Y89-K91 PolarHBondContact O-N 3.32Å; K91-D94 PolarHBondContact O-N 2.8Å; K91-Q95 WeakPolarHBondContact O-CB 3.34Å; K91-Q95 PolarHBondContact O-N 2.87Å
92E94.7Very high95Very high94 Ų94101.4 Ų101.444%0.43947%0.474SS..Hα-helixtrans-64.7-45.8177.5-170.7-179.9157.100111N88 Y89 D94 Q95 L96N88-E92 PolarHBondContact O-N 2.84Å; Y89-E92 PolarHBondContact O-N 3.03Å; E92-D94 PolarHBondContact O-N 3.4Å; E92-Q95 PolarHBondContact O-N 2.9Å; E92-L96 HydrophobicContact CG-CD1 4.37Å; E92-L96 VanDerWaalsContact O-CG 3.3Å; E92-L96 WeakPolarHBondContact O-CG 3.47Å; E92-L96 PolarHBondContact O-N 2.98Å
93V96.6Very high94.9Very high31 Ų31100 Ų10019%0.18847%0.466CS..Hα-helixtrans-62.4-39.9174.5171.10000112Y89 L90 L96 R97Y89-V93 HydrophobicContact CD1-CG2 4.43Å; Y89-V93 HydrophobicContact CD2-CG2 4.21Å; Y89-V93 HydrophobicContact CE1-CG2 3.95Å; Y89-V93 HydrophobicContact CE2-CG2 3.71Å; Y89-V93 WeakPolarHBondContact O-CG2 3.48Å; Y89-V93 PolarHBondContact O-N 3.07Å; L90-V93 PolarHBondContact O-N 2.93Å; V93-L96 PolarHBondContact O-N 3.18Å; V93-R97 VanDerWaalsContact CG1-CZ 3.47Å; V93-R97 WeakPolarHBondContact O-CD 3.25Å; V93-R97 VanDerWaalsContact O-CG 3.24Å; V93-R97 WeakPolarHBondContact O-CG 3.45Å; V93-R97 PolarHBondContact O-N 2.94Å
94D92.9Very high95Very high54 Ų54101.6 Ų101.629%0.28948%0.475SS..Hα-helixtrans-72.3-31.1176.6-75.9-22.4000113.2L90 K91 E92 R97 L98L90-D94 PolarHBondContact O-N 2.93Å; K91-D94 PolarHBondContact O-N 2.8Å; E92-D94 PolarHBondContact O-N 3.4Å; D94-R97 WeakPolarHBondContact OD1-CD 3.32Å; D94-R97 IonicContact OD1-CZ 3.68Å; D94-R97 IonicContact OD1-NE 3.95Å; D94-R97 IonicContact OD1-NH1 2.68Å; D94-R97 PolarHBondContact OD1-NH1 3.5Å; D94-L98 PolarHBondContact O-N 2.96Å; D94-L98 VanDerWaalsContact O-N 3.11Å
95Q95.6Very high95.1Very high133 Ų133100.3 Ų100.362%0.62147%0.466SS*.Hα-helixtrans-64.2-49.5169.2176.5174.586.800111.3K91 E92 R97 L98 E99K91-Q95 WeakPolarHBondContact O-CB 3.34Å; K91-Q95 PolarHBondContact O-N 2.87Å; E92-Q95 PolarHBondContact O-N 2.9Å; Q95-R97 VanDerWaalsContact C-N 3.27Å; Q95-R97 PolarHBondContact O-N 3.39Å; Q95-L98 PolarHBondContact O-N 3.2Å; Q95-E99 PolarHBondContact O-N 2.89Å
96L96.9Very high95Very high90 Ų9097.7 Ų97.747%0.47146%0.459SS..Hα-helixtrans-61.5-34.2177.6-70166.7000112.3E92 V93 R100E92-L96 HydrophobicContact CG-CD1 4.37Å; E92-L96 VanDerWaalsContact O-CG 3.3Å; E92-L96 WeakPolarHBondContact O-CG 3.47Å; E92-L96 PolarHBondContact O-N 2.98Å; V93-L96 PolarHBondContact O-N 3.18Å; L96-R100 VanDerWaalsContact O-CB 3.3Å; L96-R100 WeakPolarHBondContact O-CB 3.34Å; L96-R100 PolarHBondContact O-N 3Å
97R96Very high94.9Very high148 Ų14897.7 Ų97.756%0.55846%0.462SS*.Hα-helixtrans-63.1-43.8171.4-76.3164.2175.7159.81.5111.9V93 D94 Q95 L101V93-R97 VanDerWaalsContact CG1-CZ 3.47Å; V93-R97 WeakPolarHBondContact O-CD 3.25Å; V93-R97 VanDerWaalsContact O-CG 3.24Å; V93-R97 WeakPolarHBondContact O-CG 3.45Å; V93-R97 PolarHBondContact O-N 2.94Å; D94-R97 WeakPolarHBondContact OD1-CD 3.32Å; D94-R97 IonicContact OD1-CZ 3.68Å; D94-R97 IonicContact OD1-NE 3.95Å; D94-R97 IonicContact OD1-NH1 2.68Å; D94-R97 PolarHBondContact OD1-NH1 3.5Å; Q95-R97 VanDerWaalsContact C-N 3.27Å; Q95-R97 PolarHBondContact O-N 3.39Å; R97-L101 WeakPolarHBondContact O-CG 3.44Å; R97-L101 PolarHBondContact O-N 3.11Å; R97-L101 VanDerWaalsContact O-N 3.11Å
98L95.7Very high94.9Very high120 Ų120103 Ų10363%0.62848%0.48SS*.Hα-helixtrans-70.2-43.3179.9-176.861.3000112.1D94 Q95 R100 L101 Q102D94-L98 PolarHBondContact O-N 2.96Å; D94-L98 VanDerWaalsContact O-N 3.11Å; Q95-L98 PolarHBondContact O-N 3.2Å; L98-R100 VanDerWaalsContact C-N 3.35Å; L98-R100 PolarHBondContact O-N 3.41Å; L98-L101 PolarHBondContact O-N 3.2Å; L98-Q102 PolarHBondContact O-N 3.24Å
99E96.9Very high94.7Very high104 Ų104104.3 Ų104.349%0.48648%0.483SS..Hα-helixtrans-57.9-47.3173.8-179.5179.6-163.500111Q95 L101 Q102 I103Q95-E99 PolarHBondContact O-N 2.89Å; E99-L101 VanDerWaalsContact C-N 3.35Å; E99-L101 PolarHBondContact O-N 2.79Å; E99-Q102 WeakPolarHBondContact O-CB 3.41Å; E99-Q102 PolarHBondContact O-N 2.82Å; E99-Q102 VanDerWaalsContact O-N 3.12Å; E99-I103 HydrophobicContact CG-CD1 4.06Å; E99-I103 WeakPolarHBondContact O-CG1 3.43Å; E99-I103 PolarHBondContact O-N 3.27Å
100R96.4Very high94.3Very high164 Ų164104 Ų10462%0.61949%0.488SS*.Hα-helixtrans-56.9-46.5175.1-175.8-165153.2168.31.1111.9L96 L98 Q102 I103 D104L96-R100 VanDerWaalsContact O-CB 3.3Å; L96-R100 WeakPolarHBondContact O-CB 3.34Å; L96-R100 PolarHBondContact O-N 3Å; L98-R100 VanDerWaalsContact C-N 3.35Å; L98-R100 PolarHBondContact O-N 3.41Å; R100-Q102 PolarHBondContact O-N 2.74Å; R100-I103 PolarHBondContact O-N 3.48Å; R100-I103 VanDerWaalsContact O-N 3.1Å; R100-D104 IonicContact CZ-OD2 3.57Å; R100-D104 IonicContact NE-OD2 2.91Å; R100-D104 PolarHBondContact NE-OD2 3.17Å; R100-D104 IonicContact NH2-OD2 3.31Å; R100-D104 PolarHBondContact NH2-OD2 3.41Å; R100-D104 WeakPolarHBondContact O-CB 3.44Å; R100-D104 PolarHBondContact O-N 2.98Å
101L96Very high93.4Very high114 Ų114101.6 Ų101.660%0.59749%0.487SS*.Hα-helixtrans-61.4-34.8178.7-73.2169.8000112.1R97 L98 E99 E105R97-L101 WeakPolarHBondContact O-CG 3.44Å; R97-L101 PolarHBondContact O-N 3.11Å; R97-L101 VanDerWaalsContact O-N 3.11Å; L98-L101 PolarHBondContact O-N 3.2Å; E99-L101 VanDerWaalsContact C-N 3.35Å; E99-L101 PolarHBondContact O-N 2.79Å; L101-E105 VanDerWaalsContact O-CB 3.29Å; L101-E105 WeakPolarHBondContact O-CB 3.32Å; L101-E105 PolarHBondContact O-N 2.86Å
102Q95.8Very high92.1Very high119 Ų11999.4 Ų99.456%0.55649%0.491SS*.Hα-helixtrans-67.6-37.5173.2-178.1177-24.900112.4L98 E99 R100 Q106L98-Q102 PolarHBondContact O-N 3.24Å; E99-Q102 WeakPolarHBondContact O-CB 3.41Å; E99-Q102 PolarHBondContact O-N 2.82Å; E99-Q102 VanDerWaalsContact O-N 3.12Å; R100-Q102 PolarHBondContact O-N 2.74Å; Q102-Q106 WeakPolarHBondContact O-CG 3.36Å; Q102-Q106 PolarHBondContact O-N 3.43Å
103I95.6Very high90.4Very high76 Ų76100 Ų10039%0.3951%0.506SS..Hα-helixtrans-68.9-47.5174.9-65.2164.8000110.9E99 R100 E105 Q106 L107E99-I103 HydrophobicContact CG-CD1 4.06Å; E99-I103 WeakPolarHBondContact O-CG1 3.43Å; E99-I103 PolarHBondContact O-N 3.27Å; R100-I103 PolarHBondContact O-N 3.48Å; R100-I103 VanDerWaalsContact O-N 3.1Å; I103-E105 PolarHBondContact O-N 3.3Å; I103-Q106 PolarHBondContact O-N 3.46Å; I103-Q106 VanDerWaalsContact O-N 3.15Å; I103-L107 HydrophobicContact CG2-CD1 4Å; I103-L107 HydrophobicContact CG2-CG 4.37Å; I103-L107 WeakPolarHBondContact O-CG 3.34Å; I103-L107 PolarHBondContact O-N 2.79Å
104D95.6Very high88.6Confident66 Ų66103.1 Ų103.135%0.35353%0.529SS..Hα-helixtrans-58.6-35.1176.8-75.4-25.4000111R100 R108R100-D104 IonicContact CZ-OD2 3.57Å; R100-D104 IonicContact NE-OD2 2.91Å; R100-D104 PolarHBondContact NE-OD2 3.17Å; R100-D104 IonicContact NH2-OD2 3.31Å; R100-D104 PolarHBondContact NH2-OD2 3.41Å; R100-D104 WeakPolarHBondContact O-CB 3.44Å; R100-D104 PolarHBondContact O-N 2.98Å; D104-R108 PolarHBondContact O-N 3.11Å
105E95.1Very high87.1Confident66 Ų66110.2 Ų110.231%0.30855%0.552SS.*Hα-helixtrans-67.9-49.1171.9178.161.9-13400112.9L101 I103 L107 R108 Q109L101-E105 VanDerWaalsContact O-CB 3.29Å; L101-E105 WeakPolarHBondContact O-CB 3.32Å; L101-E105 PolarHBondContact O-N 2.86Å; I103-E105 PolarHBondContact O-N 3.3Å; E105-L107 VanDerWaalsContact C-N 3.34Å; E105-L107 PolarHBondContact O-N 2.9Å; E105-R108 WeakPolarHBondContact O-CB 3.43Å; E105-R108 PolarHBondContact O-N 3.24Å; E105-R108 VanDerWaalsContact O-N 3.14Å; E105-R108 IonicContact OE1-CZ 3.49Å; E105-R108 IonicContact OE1-NH1 3.79Å; E105-R108 IonicContact OE1-NH2 2.82Å; E105-R108 PolarHBondContact OE1-NH2 3.15Å; E105-R108 IonicContact OE2-CZ 3.1Å; E105-R108 IonicContact OE2-NH1 2.69Å; E105-R108 PolarHBondContact OE2-NH1 3.21Å; E105-R108 IonicContact OE2-NH2 2.73Å; E105-R108 PolarHBondContact OE2-NH2 3.12Å; E105-Q109 WeakPolarHBondContact O-CG 3.45Å; E105-Q109 PolarHBondContact O-N 3.35Å; E105-Q109 VanDerWaalsContact O-N 3.09Å; E105-Q109 PolarHBondContact OE1-NE2 3.03Å
106Q94.9Very high85.3Confident97 Ų97108.6 Ų108.645%0.45355%0.553SS.*Hα-helixtrans-59.7-42.9177.8-76.2175.9-5.800112.1Q102 I103 R108 Q109 I110Q102-Q106 WeakPolarHBondContact O-CG 3.36Å; Q102-Q106 PolarHBondContact O-N 3.43Å; I103-Q106 PolarHBondContact O-N 3.46Å; I103-Q106 VanDerWaalsContact O-N 3.15Å; Q106-R108 VanDerWaalsContact C-N 3.31Å; Q106-R108 PolarHBondContact O-N 3.44Å; Q106-Q109 PolarHBondContact O-N 2.98Å; Q106-I110 WeakPolarHBondContact O-CG1 3.31Å; Q106-I110 PolarHBondContact O-N 2.98Å
107L93.1Very high83.6Confident106 Ų106109.7 Ų109.756%0.55557%0.565SS**Hα-helixtrans-61.2-39175.7-70.5172.7000111.8I103 E105 I110 G111I103-L107 HydrophobicContact CG2-CD1 4Å; I103-L107 HydrophobicContact CG2-CG 4.37Å; I103-L107 WeakPolarHBondContact O-CG 3.34Å; I103-L107 PolarHBondContact O-N 2.79Å; E105-L107 VanDerWaalsContact C-N 3.34Å; E105-L107 PolarHBondContact O-N 2.9Å; L107-I110 PolarHBondContact O-N 3.14Å; L107-G111 PolarHBondContact O-N 2.86Å
108R91.4Very high82.2Confident152 Ų152108 Ų10857%0.57457%0.573SS**Hα-helixtrans-63.9-39.6175.2-165177.376.4-112.3-1.7112.1D104 E105 Q106 A112D104-R108 PolarHBondContact O-N 3.11Å; E105-R108 WeakPolarHBondContact O-CB 3.43Å; E105-R108 PolarHBondContact O-N 3.24Å; E105-R108 VanDerWaalsContact O-N 3.14Å; E105-R108 IonicContact OE1-CZ 3.49Å; E105-R108 IonicContact OE1-NH1 3.79Å; E105-R108 IonicContact OE1-NH2 2.82Å; E105-R108 PolarHBondContact OE1-NH2 3.15Å; E105-R108 IonicContact OE2-CZ 3.1Å; E105-R108 IonicContact OE2-NH1 2.69Å; E105-R108 PolarHBondContact OE2-NH1 3.21Å; E105-R108 IonicContact OE2-NH2 2.73Å; E105-R108 PolarHBondContact OE2-NH2 3.12Å; Q106-R108 VanDerWaalsContact C-N 3.31Å; Q106-R108 PolarHBondContact O-N 3.44Å; R108-A112 VanDerWaalsContact O-CB 3.24Å; R108-A112 WeakPolarHBondContact O-CB 3.09Å; R108-A112 PolarHBondContact O-N 2.86Å
109Q89.3Confident79.9Confident114 Ų114108.7 Ų108.753%0.53358%0.578SS.*Hα-helixtrans-66.7-44.5178.8-66.8173.317.100111.8E105 Q106 A112 S113E105-Q109 WeakPolarHBondContact O-CG 3.45Å; E105-Q109 PolarHBondContact O-N 3.35Å; E105-Q109 VanDerWaalsContact O-N 3.09Å; E105-Q109 PolarHBondContact OE1-NE2 3.03Å; Q106-Q109 PolarHBondContact O-N 2.98Å; Q109-A112 PolarHBondContact O-N 2.75Å; Q109-S113 WeakPolarHBondContact O-CB 3.28Å; Q109-S113 PolarHBondContact O-N 3.42Å; Q109-S113 VanDerWaalsContact O-N 3.17Å
110I86.1Confident77.7Confident122 Ų122113.9 Ų113.963%0.62659%0.593SS**Hα-helixtrans-64.7-46.5176.4-63.2167000110.7Q106 L107 A112 S113 S114Q106-I110 WeakPolarHBondContact O-CG1 3.31Å; Q106-I110 PolarHBondContact O-N 2.98Å; L107-I110 PolarHBondContact O-N 3.14Å; I110-A112 VanDerWaalsContact C-N 3.34Å; I110-A112 PolarHBondContact O-N 2.87Å; I110-S113 PolarHBondContact O-N 2.85Å; I110-S114 PolarHBondContact O-N 3.06Å
111G75.9Confident75.5Confident47 Ų47111.6 Ų111.649%0.48560%0.597SS.*Hα-helixtrans-66.4-29.7179.300000114.4L107 S114L107-G111 PolarHBondContact O-N 2.86Å; G111-S114 PolarHBondContact O-OG 3.14Å
112A63Low73.4Confident71 Ų71114 Ų11459%0.58761%0.61SS**Hα-helixtrans-74.4-33.7173.700000112.6R108 Q109 I110 S114R108-A112 VanDerWaalsContact O-CB 3.24Å; R108-A112 WeakPolarHBondContact O-CB 3.09Å; R108-A112 PolarHBondContact O-N 2.86Å; Q109-A112 PolarHBondContact O-N 2.75Å; I110-A112 VanDerWaalsContact C-N 3.34Å; I110-A112 PolarHBondContact O-N 2.87Å; A112-S114 VanDerWaalsContact C-N 3.3Å; A112-S114 PolarHBondContact O-N 3.41Å
113S60Low71.6Confident106 Ų106117.2 Ų117.274%0.74162%0.623SS**Hα-helixtrans-70.4-21.8-177.9-163.10000113.8Q109 I110 R115Q109-S113 WeakPolarHBondContact O-CB 3.28Å; Q109-S113 PolarHBondContact O-N 3.42Å; Q109-S113 VanDerWaalsContact O-N 3.17Å; I110-S113 PolarHBondContact O-N 2.85Å; S113-R115 VanDerWaalsContact C-N 3.35Å; S113-R115 PolarHBondContact O-N 2.88Å
114S58Low69.4Low97 Ų97122.5 Ų122.568%0.67865%0.646SS**THydrogen-bonded Turntrans-81.3-7.3-178.570.60000114.9I110 G111 A112 P116I110-S114 PolarHBondContact O-N 3.06Å; G111-S114 PolarHBondContact O-OG 3.14Å; A112-S114 VanDerWaalsContact C-N 3.3Å; A112-S114 PolarHBondContact O-N 3.41Å; S114-P116 WeakPolarHBondContact O-CD 3.3Å
115R62Low67.2Low202 Ų202128.8 Ų128.876%0.76267%0.67SS**SBendtrans-80.7122.5-178.9-163.3178-168.4-166.63.2110.7S113S113-R115 VanDerWaalsContact C-N 3.35Å; S113-R115 PolarHBondContact O-N 2.88Å
116P57.1Low65Low100 Ų100128.5 Ų128.565%0.64968%0.684SS**PPolyproline II helixtrans-56.4146.9173.8-25.135000111.9S114S114-P116 WeakPolarHBondContact O-CD 3.3Å
117P62.6Low62.6Low112 Ų112134.4 Ų134.473%0.72770%0.704SS**PPolyproline II helixtrans-59.2130.3-178.523.8-33.6000110.6N119P117-N119 PolarHBondContact O-N 3.06Å
118P65.1Low60.4Low112 Ų112134.8 Ų134.873%0.72771%0.711SS**SBendtrans-81.261.4-17233.2-37000112.3
119N48.4Very low58.8Low135 Ų135133.8 Ų133.872%0.72272%0.721SS**  trans-171.8136.9169.9-107.1-84.6000107.4P117P117-N119 PolarHBondContact O-N 3.06Å
120R50.3Low57Low213 Ų213135.5 Ų135.580%0.80473%0.734SS**  cis-141.1154.219.9-65.6-173.9158.6147.5-3.5113.3
121T50.4Low55.3Low117 Ų117137.3 Ų137.372%0.71875%0.745SS**  trans45.290.8150.150.70000119.2K123T121-K123 PolarHBondContact O-N 2.85Å; T121-K123 VanDerWaalsContact O-N 3.12Å
122D51.4Low54.1Low163 Ų163138.7 Ų138.787%0.87276%0.76SS**  trans-57.8100.6137.9167.134.6000109
123K57.7Low54Low188 Ų188145.2 Ų145.282%0.81778%0.778SS**  trans-160.415.3172.4-130.8178-177.8-179.90119.4T121T121-K123 PolarHBondContact O-N 2.85Å; T121-K123 VanDerWaalsContact O-N 3.12Å
124E49.9Very low53.8Low186 Ų186143 Ų14387%0.86977%0.772SS**  trans-139.475.2170.759.2-168.715900113.6G126E124-G126 PolarHBondContact O-N 2.59Å
125K50.5Low53.6Low199 Ų199148 Ų14887%0.86579%0.788SS**  trans-71.175155.5-170.1-177.3-177.5-61.50108.6
126G48.2Very low52.8Low59 Ų59145.9 Ų145.961%0.60883%0.828SS**PPolyproline II helixtrans-50.4145.3177.500000111.9E124E124-G126 PolarHBondContact O-N 2.59Å
127Y43.5Very low52.6Low222 Ų222148.2 Ų148.287%0.87184%0.837SS**PPolyproline II helixtrans-72.6157-177.1-148.7-98.4000111.2T129Y127-T129 PolarHBondContact O-N 3.24Å
128V48.2Very low52.1Low114 Ų114150.1 Ų150.169%0.69184%0.843SS**PPolyproline II helixtrans-72.1127.3-178-170.60000110
129T57Low51.4Low130 Ų130152.2 Ų152.280%0.79885%0.849SS**  trans-124.7103.3159.550.80000108.1Y127Y127-T129 PolarHBondContact O-N 3.24Å
130D51Low51.5Low151 Ų151153.2 Ų153.281%0.80786%0.856SS**  trans-138.7115165-172.946.6000105.6
131D51Low51.6Low160 Ų160149.4 Ų149.486%0.85686%0.86SS**  trans-90.2121.7-166-72.3-69.5000111.5
132G50.8Low51.7Low76 Ų76151.6 Ų151.678%0.78487%0.869SS**  trans-13447.9-168.100000115.4G134G132-G134 PolarHBondContact O-N 2.82Å
133Q60.7Low51.7Low207 Ų207150.8 Ų150.897%0.96787%0.869SS**  trans-78107.6174.9-69.8-176.1-63.600112.2
134G55Low51.3Low61 Ų61147.9 Ų147.963%0.62987%0.873SS**  trans-170.7110.516700000109.8G132G132-G134 PolarHBondContact O-N 2.82Å
135M55.7Low51.4Low202 Ų202144.8 Ų144.8100%0.99587%0.873SS**  67.5110.773-66.2-69.8-171.100112.5
136G44.9Very low51.5Low156 Ų156139.8 Ų139.8100%1.60887%0.874SS**  trans155.60179.100000112.3

Retrieved 136 of 136 residues in 107 ms (Link to these results)