A0A087WRQ4_MOUSE Loading...

Small ubiquitin-like modifier 1

AlphaFold DB , UniProt , Accession A0A087WRQ4, Species MOUSE (Mus musculus, Mouse), Gene Sumo1, Length 75 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
1M45.1Very low56.3Low233 Ų233145.8 Ų145.8100%1.14881%0.805SS**  087.60-53.9-178.8-165.700104.1
2S59.5Low56.3Low115 Ų115144.3 Ų144.380%0.80480%0.795SS**  53.388.470.5-60.20000111.6
3D60.8Low56.4Low173 Ų173146.5 Ų146.593%0.92580%0.803SS**  trans-144.8135.8144.8-78.8-60.9000109.3
4Q65Low56.4Low162 Ų162138.4 Ų138.476%0.75777%0.77SS**  trans-114.6155.6-165.8-165.1-171.7-86.300108.8
5E55.2Low56.6Low128 Ų128138.5 Ų138.560%0.59877%0.769SS**  trans84.5134.2160.8-53.5-157.772.800118.2K7E5-K7 VanDerWaalsContact OE1-CE 3.26Å; E5-K7 WeakPolarHBondContact OE1-CE 3.46Å; E5-K7 IonicContact OE1-NZ 2.88Å; E5-K7 PolarHBondContact OE1-NZ 3.37Å
6A52.1Low56.9Low91 Ų91140.9 Ų140.975%0.75277%0.769SS**  cis-146.2138.837.100000117
7K56.9Low57Low167 Ų167140.6 Ų140.673%0.72676%0.758SS**  trans6.6169133-56.8171-179.7139.40119.8E5E5-K7 VanDerWaalsContact OE1-CE 3.26Å; E5-K7 WeakPolarHBondContact OE1-CE 3.46Å; E5-K7 IonicContact OE1-NZ 2.88Å; E5-K7 PolarHBondContact OE1-NZ 3.37Å
8P55.7Low57Low122 Ų122141.9 Ų141.979%0.79276%0.759SS**  cis-133.8162.9-44.336.8-20000112
9S48.9Very low57.4Low105 Ų105137.9 Ų137.973%0.73475%0.754SS**  trans-158.196.4154.1-154.40000108E11S9-E11 PolarHBondContact O-N 3.44Å
10T60.9Low58Low124 Ų124136 Ų13676%0.76174%0.74SS**  60.359.4106-128.80000112.2D12T10-D12 VanDerWaalsContact C-N 3.33Å; T10-D12 PolarHBondContact O-N 2.76Å
11E59.3Low58.8Low184 Ų184137.7 Ų137.786%0.8674%0.737SS**  trans-93.791.7148.3-70.1-172.3137.800105.8S9 L13S9-E11 PolarHBondContact O-N 3.44Å; E11-L13 PolarHBondContact O-N 2.92Å
12D56.5Low60.6Low128 Ų128128.2 Ų128.268%0.68469%0.69SS**  trans-27.381.1156.6-166.7-104.8000111.5T10 G14T10-D12 VanDerWaalsContact C-N 3.33Å; T10-D12 PolarHBondContact O-N 2.76Å; D12-G14 PolarHBondContact O-N 3.02Å; D12-G14 WeakPolarHBondContact OD1-CA 3.37Å
13L57.6Low61.7Low172 Ų172132.1 Ų132.190%0.90169%0.693SS**  trans-74.978.8157.4-66.7-179.8000104.2E11E11-L13 PolarHBondContact O-N 2.92Å
14G55.4Low62.6Low33 Ų33126.3 Ų126.334%0.3466%0.662SS.*  trans-43.6145.2-16400000111.6D12 K16D12-G14 PolarHBondContact O-N 3.02Å; D12-G14 WeakPolarHBondContact OD1-CA 3.37Å; G14-K16 VanDerWaalsContact C-N 3.34Å; G14-K16 PolarHBondContact O-N 3.33Å
15D59.9Low63.3Low140 Ų140127.3 Ų127.375%0.74966%0.663SS**  trans-20.697169.1-69.2-95000110K17D15-K17 HydrophobicContact CB-CG 4.11Å; D15-K17 PolarHBondContact O-N 3.37Å
16K61Low64.4Low178 Ų178123.9 Ų123.977%0.77465%0.651SS**  trans-5997.2155.7-75178.4178.7172.60101.5G14 E18G14-K16 VanDerWaalsContact C-N 3.34Å; G14-K16 PolarHBondContact O-N 3.33Å; K16-E18 HydrophobicContact CB-CG 4.14Å; K16-E18 WeakPolarHBondContact O-CG 3.43Å; K16-E18 PolarHBondContact O-N 2.86Å
17K59.3Low65.5Low135 Ų135127.2 Ų127.259%0.58765%0.654SS**  trans-6978.2178.8-70.3-162.4-174.9169.30105.6D15 G19D15-K17 HydrophobicContact CB-CG 4.11Å; D15-K17 PolarHBondContact O-N 3.37Å; K17-G19 PolarHBondContact O-N 2.91Å
18E57Low66Low165 Ų165121.5 Ų121.577%0.77164%0.643SS**THydrogen-bonded Turntrans-66.77.7177.7-71.5-175.8166.300111.6K16K16-E18 HydrophobicContact CB-CG 4.14Å; K16-E18 WeakPolarHBondContact O-CG 3.43Å; K16-E18 PolarHBondContact O-N 2.86Å
19G64.1Low66.3Low65 Ų65125.8 Ų125.867%0.6765%0.652SS**THydrogen-bonded Turntrans-101-31.9-158.900000116.5K17K17-G19 PolarHBondContact O-N 2.91Å
20E69.1Low67.5Low100 Ų100124.3 Ų124.347%0.46765%0.654SS.*  trans-161.593.8-162.2-126.3170.3-16300113.2T50 P51E20-T50 WeakPolarHBondContact O-CB 3.27Å; E20-T50 WeakPolarHBondContact O-CG2 3.23Å; E20-P51 HydrophobicContact CG-CG 4.14Å; E20-P51 VanDerWaalsContact O-CD 3.31Å; E20-P51 WeakPolarHBondContact O-CD 3.04Å
21Y76.3Confident68.1Low172 Ų172121 Ų12168%0.67563%0.634SS**  trans-96.1141.6170.7-60.9-87.9000109.5K23Y21-K23 PolarHBondContact O-N 2.81Å
22I82.6Confident69.1Low33 Ų33116 Ų11617%0.16962%0.617CS.*  trans-71.9112.6170.8-55.5159.9000107.7L24 I45 H49 P51 L54 M56 I62I22-L24 HydrophobicContact CG2-CD1 4.45Å; I22-L24 HydrophobicContact CG2-CD2 3.75Å; I22-L24 HydrophobicContact CG2-CG 3.97Å; I22-L24 PolarHBondContact O-N 2.9Å; I22-I45 HydrophobicContact CD1-CG2 3.51Å; I22-H49 HydrophobicContact CD1-CB 4.2Å; I22-P51 HydrophobicContact CG1-CG 3.77Å; I22-L54 HydrophobicContact CD1-CD1 3.52Å; I22-M56 HydrophobicContact CD1-CE 4.23Å; I22-M56 HydrophobicContact CD1-SD 4.03Å; I22-M56 HydrophobicContact CG1-SD 4.11Å; I22-M56 HydrophobicContact CG2-SD 4.44Å; I22-I62 HydrophobicContact CG2-CD1 3.96Å
23K81Confident70.2Confident198 Ų198115.3 Ų115.386%0.86161%0.611SS**  trans-91.9101.8-179.7-170.1173.2-173.3171.70110.9Y21Y21-K23 PolarHBondContact O-N 2.81Å
24L81.1Confident71.3Confident51 Ų51114.1 Ų114.127%0.26761%0.606SS.*  trans-96.5125.1178.8-56.3172.4000110.6I22 F38 I62I22-L24 HydrophobicContact CG2-CD1 4.45Å; I22-L24 HydrophobicContact CG2-CD2 3.75Å; I22-L24 HydrophobicContact CG2-CG 3.97Å; I22-L24 PolarHBondContact O-N 2.9Å; L24-F38 HydrophobicContact CB-CE1 4.17Å; L24-F38 HydrophobicContact CB-CZ 4.48Å; L24-F38 HydrophobicContact CD1-CB 3.98Å; L24-F38 HydrophobicContact CD1-CD1 3.48Å; L24-F38 VanDerWaalsContact CD1-CD1 3.48Å; L24-F38 HydrophobicContact CD1-CD2 3.88Å; L24-F38 HydrophobicContact CD1-CE1 3.84Å; L24-F38 HydrophobicContact CD1-CE2 4.22Å; L24-F38 HydrophobicContact CD1-CG 3.5Å; L24-F38 VanDerWaalsContact CD1-CG 3.5Å; L24-F38 HydrophobicContact CD1-CZ 4.2Å; L24-F38 HydrophobicContact CD2-CD1 4.48Å; L24-F38 HydrophobicContact CG-CD1 4.38Å; L24-F38 HydrophobicContact CG-CE1 4.47Å; L24-I62 HydrophobicContact CD2-CD1 3.44Å; L24-I62 VanDerWaalsContact CD2-CD1 3.44Å; L24-I62 HydrophobicContact CD2-CG2 4.34Å
25K79Confident72.6Confident182 Ų182113.3 Ų113.379%0.79160%0.595SS**  trans-117.1113.1176-174.7178.2179.2-177.80109.9
26V77.6Confident74Confident56 Ų56107.4 Ų107.434%0.33956%0.563SS.*  trans-83.8121174.5-176.30000109.2G28 L36 F38V26-G28 PolarHBondContact O-N 3.21Å; V26-L36 HydrophobicContact CB-CD1 4.5Å; V26-L36 HydrophobicContact CG1-CD1 4.14Å; V26-L36 HydrophobicContact CG2-CD1 3.58Å; V26-F38 HydrophobicContact CG2-CZ 4.25Å
27I75.5Confident75.3Confident161 Ų161103.4 Ų103.483%0.82654%0.543SS*.  trans-97.868.6177.752.1163.4000110.7
28G69.1Low76.8Confident47 Ų4798.2 Ų98.249%0.48552%0.521SS..SBendtrans-162.3127.3176.700000111.5V26 G30V26-G28 PolarHBondContact O-N 3.21Å; G28-G30 PolarHBondContact O-N 3.34Å
29Q61.8Low78.5Confident212 Ų21291.7 Ų91.799%0.99149%0.491SS*.THydrogen-bonded Turntrans-74.1114.8174.2-74179.55.600108.9
30G72.4Confident79.9Confident75 Ų7589.1 Ų89.177%0.77346%0.461SS*.THydrogen-bonded Turntrans120.8-3.2163.900000117.5G28G28-G30 PolarHBondContact O-N 3.34Å
31V74.7Confident81.1Confident54 Ų5492.9 Ų92.933%0.32748%0.479SS..  trans-99116.2175-170.40000109.7S35 L36 Q66V31-S35 WeakPolarHBondContact CG1-OG 3.39Å; V31-L36 HydrophobicContact CG1-CD1 4.16Å; V31-L36 HydrophobicContact CG1-CD2 3.58Å; V31-L36 HydrophobicContact CG1-CG 3.85Å; V31-Q66 HydrophobicContact CG1-CG 4.35Å
32P80.6Confident81.8Confident80 Ų8087.4 Ų87.452%0.51947%0.474SS..  trans-66.7138177.123.8-27.2000110.3N34 S35P32-N34 PolarHBondContact O-N 3.34Å; P32-N34 VanDerWaalsContact O-N 3.14Å; P32-S35 WeakPolarHBondContact CD-OG 3.33Å; P32-S35 WeakPolarHBondContact CG-OG 3.31Å; P32-S35 PolarHBondContact O-N 3.21Å; P32-S35 PolarHBondContact O-OG 3.25Å
33M79Confident82.2Confident112 Ų11291 Ų9155%0.55249%0.491SS*.G310 helixtrans-58-32.3-178.8-64.4-173.276.700112.5S35 L36M33-S35 PolarHBondContact O-N 3.38Å; M33-L36 WeakPolarHBondContact O-CB 3.23Å; M33-L36 PolarHBondContact O-N 2.81Å; M33-L36 VanDerWaalsContact O-N 3.13Å
34N80.6Confident82.6Confident147 Ų14787.8 Ų87.879%0.78647%0.473SS*.G310 helixtrans-71.9-12178.4-59.3-6000113.6P32 L36P32-N34 PolarHBondContact O-N 3.34Å; P32-N34 VanDerWaalsContact O-N 3.14Å; N34-L36 VanDerWaalsContact C-N 3.33Å
35S83.9Confident83.2Confident16 Ų1686.1 Ų86.111%0.11246%0.464CS..G310 helixtrans-98.218.3171.8750000111.8V31 P32 M33 Q66 E67V31-S35 WeakPolarHBondContact CG1-OG 3.39Å; P32-S35 WeakPolarHBondContact CD-OG 3.33Å; P32-S35 WeakPolarHBondContact CG-OG 3.31Å; P32-S35 PolarHBondContact O-N 3.21Å; P32-S35 PolarHBondContact O-OG 3.25Å; M33-S35 PolarHBondContact O-N 3.38Å; S35-Q66 CarbonylContact O-C 3.42Å; S35-Q66 VanDerWaalsContact O-CA 3.24Å; S35-Q66 WeakPolarHBondContact O-CA 3.26Å; S35-E67 PolarHBondContact O-N 2.76Å
36L88Confident83.5Confident16 Ų1679.3 Ų79.38%0.08444%0.442CS..EExtended strand (participates in β ladder)trans-119143.5178.6-64.1177.1000110.5V26 V31 M33 N34 F38 V64 Y65 Q66V26-L36 HydrophobicContact CB-CD1 4.5Å; V26-L36 HydrophobicContact CG1-CD1 4.14Å; V26-L36 HydrophobicContact CG2-CD1 3.58Å; V31-L36 HydrophobicContact CG1-CD1 4.16Å; V31-L36 HydrophobicContact CG1-CD2 3.58Å; V31-L36 HydrophobicContact CG1-CG 3.85Å; M33-L36 WeakPolarHBondContact O-CB 3.23Å; M33-L36 PolarHBondContact O-N 2.81Å; M33-L36 VanDerWaalsContact O-N 3.13Å; N34-L36 VanDerWaalsContact C-N 3.33Å; L36-F38 HydrophobicContact CB-CE2 3.88Å; L36-F38 HydrophobicContact CB-CZ 3.92Å; L36-F38 HydrophobicContact CD1-CZ 4.07Å; L36-V64 HydrophobicContact CB-CG1 4.15Å; L36-V64 HydrophobicContact CD1-CG1 4.15Å; L36-V64 HydrophobicContact CD2-CG1 3.93Å; L36-V64 HydrophobicContact CG-CG1 4.31Å; L36-Y65 CarbonylContact C-O 3.59Å; L36-Y65 VanDerWaalsContact CA-O 3.31Å; L36-Y65 WeakPolarHBondContact CA-O 3.37Å; L36-Q66 HydrophobicContact CD2-CG 3.87Å
37R89.6Confident83.8Confident94 Ų9484.5 Ų84.536%0.35547%0.468SS..EExtended strand (participates in β ladder)trans-117.6124.8171.9-176-179.8-61.2155.51.6108.3L39 R44 V64 Y65 E67R37-L39 HydrophobicContact CG-CD2 4.02Å; R37-R44 HydrophobicContact CG-CG 4.34Å; R37-V64 WeakPolarHBondContact O-CA 3.44Å; R37-Y65 PolarHBondContact N-O 2.85Å; R37-Y65 PolarHBondContact O-N 2.75Å; R37-E67 IonicContact CZ-OE1 2.94Å; R37-E67 IonicContact NE-OE1 2.77Å; R37-E67 PolarHBondContact NE-OE1 2.93Å; R37-E67 IonicContact NH2-OE1 3.66Å; R37-E67 PolarHBondContact NH2-OE1 3.14Å
38F90.9Very high84.3Confident27 Ų2782.7 Ų82.712%0.11846%0.46CS..EExtended strand (participates in β ladder)trans-102.2126.8178.6-57.7-87.2000109.1L24 V26 L36 I45 I62 E63 V64L24-F38 HydrophobicContact CB-CE1 4.17Å; L24-F38 HydrophobicContact CB-CZ 4.48Å; L24-F38 HydrophobicContact CD1-CB 3.98Å; L24-F38 HydrophobicContact CD1-CD1 3.48Å; L24-F38 VanDerWaalsContact CD1-CD1 3.48Å; L24-F38 HydrophobicContact CD1-CD2 3.88Å; L24-F38 HydrophobicContact CD1-CE1 3.84Å; L24-F38 HydrophobicContact CD1-CE2 4.22Å; L24-F38 HydrophobicContact CD1-CG 3.5Å; L24-F38 VanDerWaalsContact CD1-CG 3.5Å; L24-F38 HydrophobicContact CD1-CZ 4.2Å; L24-F38 HydrophobicContact CD2-CD1 4.48Å; L24-F38 HydrophobicContact CG-CD1 4.38Å; L24-F38 HydrophobicContact CG-CE1 4.47Å; V26-F38 HydrophobicContact CG2-CZ 4.25Å; L36-F38 HydrophobicContact CB-CE2 3.88Å; L36-F38 HydrophobicContact CB-CZ 3.92Å; L36-F38 HydrophobicContact CD1-CZ 4.07Å; F38-I45 HydrophobicContact CB-CB 4.31Å; F38-I45 HydrophobicContact CB-CD1 4.05Å; F38-I45 PolarHBondContact O-N 3.04Å; F38-I62 HydrophobicContact CB-CG2 4.07Å; F38-I62 HydrophobicContact CD1-CG2 4.19Å; F38-E63 CarbonylContact C-O 3.58Å; F38-E63 WeakPolarHBondContact CA-O 3.19Å; F38-V64 HydrophobicContact CD1-CB 4.35Å; F38-V64 HydrophobicContact CD1-CG1 4Å; F38-V64 HydrophobicContact CD1-CG2 3.62Å; F38-V64 HydrophobicContact CE1-CB 4.42Å; F38-V64 HydrophobicContact CE1-CG1 3.75Å; F38-V64 HydrophobicContact CE1-CG2 3.78Å; F38-V64 HydrophobicContact CZ-CG1 4.35Å
39L92.7Very high85.2Confident27 Ų2782.3 Ų82.314%0.14145%0.445CS..EExtended strand (participates in β ladder)trans-119.8140.3177.2-54.1-179.4000110.2R37 Q43 R44 E63 Y65R37-L39 HydrophobicContact CG-CD2 4.02Å; L39-Q43 CarbonylContact C-O 3.5Å; L39-Q43 VanDerWaalsContact CA-O 3.23Å; L39-Q43 WeakPolarHBondContact CA-O 3.34Å; L39-R44 HydrophobicContact CD2-CB 4.02Å; L39-E63 HydrophobicContact CB-CB 4.3Å; L39-E63 PolarHBondContact N-O 2.72Å; L39-E63 PolarHBondContact O-N 3.16Å; L39-Y65 HydrophobicContact CD1-CD2 3.86Å; L39-Y65 HydrophobicContact CD1-CE2 3.6Å; L39-Y65 HydrophobicContact CG-CD2 4.23Å; L39-Y65 HydrophobicContact CG-CE2 4.26Å
40F93.1Very high86.5Confident12 Ų1273 Ų735%0.05340%0.403CS..EExtended strand (participates in β ladder)trans-123.4124.2166.9178.4-107.6000108.1G42 Q43 I45 L54 M56 D60F40-G42 PolarHBondContact O-N 3.2Å; F40-Q43 PolarHBondContact N-O 3.45Å; F40-Q43 WeakPolarHBondContact O-CA 3.31Å; F40-Q43 WeakPolarHBondContact O-CB 3.47Å; F40-Q43 PolarHBondContact O-N 2.76Å; F40-I45 HydrophobicContact CB-CD1 3.9Å; F40-I45 HydrophobicContact CB-CG1 4Å; F40-L54 HydrophobicContact CD1-CB 4.06Å; F40-L54 HydrophobicContact CE1-CB 4.28Å; F40-L54 VanDerWaalsContact CE1-O 3.23Å; F40-L54 WeakPolarHBondContact CE1-O 3.4Å; F40-M56 HydrophobicContact CB-CE 3.46Å; F40-M56 VanDerWaalsContact CB-CE 3.46Å; F40-M56 HydrophobicContact CD1-CE 3.98Å; F40-M56 HydrophobicContact CD1-CG 4.15Å; F40-M56 HydrophobicContact CD2-CE 3.51Å; F40-M56 HydrophobicContact CD2-CG 4.03Å; F40-M56 HydrophobicContact CE1-CG 3.91Å; F40-M56 HydrophobicContact CE2-CE 4.22Å; F40-M56 HydrophobicContact CE2-CG 3.78Å; F40-M56 HydrophobicContact CG-CE 3.35Å; F40-M56 HydrophobicContact CG-CG 4.2Å; F40-M56 HydrophobicContact CZ-CB 4.47Å; F40-M56 HydrophobicContact CZ-CG 3.7Å; F40-D60 HydrophobicContact CE2-CB 3.88Å; F40-D60 WeakPolarHBondContact CE2-OD2 3.24Å; F40-D60 WeakPolarHBondContact CZ-OD2 3.47Å
41E93.2Very high87.2Confident179 Ų17970.6 Ų70.684%0.83637%0.374SS*.THydrogen-bonded Turntrans48.733.7-173.6-57.4-163.7134.500114Q43E41-Q43 VanDerWaalsContact C-N 3.27Å; E41-Q43 PolarHBondContact O-N 3.45Å
42G90.8Very high87.9Confident56 Ų5676.2 Ų76.258%0.57739%0.394SS*.THydrogen-bonded Turntrans80.6-6.5-176.300000115.4F40F40-G42 PolarHBondContact O-N 3.2Å
43Q91.5Very high88.3Confident110 Ų11076.8 Ų76.851%0.51439%0.389SS..EExtended strand (participates in β ladder)trans-86.8134.5174.2-173.8174.8-87.500111.5L39 F40 E41 I45L39-Q43 CarbonylContact C-O 3.5Å; L39-Q43 VanDerWaalsContact CA-O 3.23Å; L39-Q43 WeakPolarHBondContact CA-O 3.34Å; F40-Q43 PolarHBondContact N-O 3.45Å; F40-Q43 WeakPolarHBondContact O-CA 3.31Å; F40-Q43 WeakPolarHBondContact O-CB 3.47Å; F40-Q43 PolarHBondContact O-N 2.76Å; E41-Q43 VanDerWaalsContact C-N 3.27Å; E41-Q43 PolarHBondContact O-N 3.45Å; Q43-I45 PolarHBondContact O-N 2.89Å
44R90.6Very high88.7Confident129 Ų12972.4 Ų72.449%0.48737%0.368SS..EExtended strand (participates in β ladder)trans-66.8126.6174.1-175174.9-179.2146.86.3110.5R37 L39 E67R37-R44 HydrophobicContact CG-CG 4.34Å; L39-R44 HydrophobicContact CD2-CB 4.02Å; R44-E67 IonicContact CZ-OE1 3.35Å; R44-E67 IonicContact NH1-OE1 3.49Å; R44-E67 PolarHBondContact NH1-OE1 3.29Å; R44-E67 IonicContact NH2-OE1 2.69Å; R44-E67 PolarHBondContact NH2-OE1 3.27Å; R44-E67 IonicContact NH2-OE2 3.86Å; R44-E67 PolarHBondContact NH2-OE2 3.33Å
45I91.8Very high89.2Confident17 Ų1767.8 Ų67.89%0.08736%0.355CS..PPolyproline II helixtrans-81.6131.2172-57.3162.7000108.5I22 F38 F40 Q43 H49 L54 M56 I62I22-I45 HydrophobicContact CD1-CG2 3.51Å; F38-I45 HydrophobicContact CB-CB 4.31Å; F38-I45 HydrophobicContact CB-CD1 4.05Å; F38-I45 PolarHBondContact O-N 3.04Å; F40-I45 HydrophobicContact CB-CD1 3.9Å; F40-I45 HydrophobicContact CB-CG1 4Å; Q43-I45 PolarHBondContact O-N 2.89Å; I45-H49 HydrophobicContact CG2-CB 4.36Å; I45-L54 HydrophobicContact CG1-CD1 4.01Å; I45-L54 HydrophobicContact CG2-CD1 4.34Å; I45-M56 HydrophobicContact CD1-CE 3.73Å; I45-M56 HydrophobicContact CG1-CE 4.31Å; I45-I62 HydrophobicContact CD1-CD1 4Å; I45-I62 HydrophobicContact CD1-CG1 4.19Å; I45-I62 HydrophobicContact CD1-CG2 3.77Å
46A87.3Confident89.5Confident38 Ų3868.5 Ų68.531%0.31436%0.357SS..  trans-109.2161.6173.300000110.7N48 H49A46-N48 WeakPolarHBondContact CB-OD1 3.42Å; A46-N48 PolarHBondContact O-N 2.68Å; A46-N48 VanDerWaalsContact O-N 3.16Å; A46-H49 PolarHBondContact N-ND1 2.95Å; A46-H49 WeakPolarHBondContact O-CB 3.42Å; A46-H49 PolarHBondContact O-N 2.96Å
47D83.9Confident89.6Confident165 Ų16575.2 Ų75.288%0.88239%0.388SS*.THydrogen-bonded Turntrans-64.3-21.8-175-60.1-26000113.6H49D47-H49 VanDerWaalsContact C-N 3.34Å
48N84.6Confident89.4Confident123 Ų12379.5 Ų79.566%0.65841%0.412SS*.THydrogen-bonded Turntrans-87-4.1176.566.7-45.3000113.2A46A46-N48 WeakPolarHBondContact CB-OD1 3.42Å; A46-N48 PolarHBondContact O-N 2.68Å; A46-N48 VanDerWaalsContact O-N 3.16Å
49H87.8Confident89.2Confident39 Ų3987.1 Ų87.118%0.18145%0.448CS..  trans-80.3141.6-178.8-68.2175.5000112.9I22 I45 A46 D47 E53 L54I22-H49 HydrophobicContact CD1-CB 4.2Å; I45-H49 HydrophobicContact CG2-CB 4.36Å; A46-H49 PolarHBondContact N-ND1 2.95Å; A46-H49 WeakPolarHBondContact O-CB 3.42Å; A46-H49 PolarHBondContact O-N 2.96Å; D47-H49 VanDerWaalsContact C-N 3.34Å; H49-E53 WeakPolarHBondContact CA-OE1 3.33Å; H49-E53 WeakPolarHBondContact CB-OE1 3.38Å; H49-E53 IonicContact CD2-OE1 3.56Å; H49-E53 PolarHBondContact CD2-OE1 3.13Å; H49-E53 IonicContact CG-OE1 3.14Å; H49-E53 IonicContact NE2-OE1 3.5Å; H49-L54 HydrophobicContact CB-CD1 4.16Å; H49-L54 HydrophobicContact CB-CG 4.39Å
50T88.9Confident89.1Confident16 Ų1689.2 Ų89.210%0.09846%0.459CS..  trans-105.3148176.464.40000111.1E20 K52 E53 L54E20-T50 WeakPolarHBondContact O-CB 3.27Å; E20-T50 WeakPolarHBondContact O-CG2 3.23Å; T50-K52 PolarHBondContact O-N 3.41Å; T50-E53 PolarHBondContact N-OE1 3.35Å; T50-E53 PolarHBondContact N-OE2 3.38Å; T50-E53 VanDerWaalsContact N-OE2 3.13Å; T50-E53 WeakPolarHBondContact O-CG 3.19Å; T50-E53 PolarHBondContact O-N 3.13Å; T50-E53 PolarHBondContact OG1-N 3.32Å; T50-E53 PolarHBondContact OG1-OE2 2.96Å; T50-L54 PolarHBondContact O-N 2.76Å
51P88.4Confident89Confident25 Ų2594.2 Ų94.216%0.16249%0.49CS..Hα-helixtrans-53.4-43175.2-24.833.3000112.3E20 I22 E53 L54 G55 M56E20-P51 HydrophobicContact CG-CG 4.14Å; E20-P51 VanDerWaalsContact O-CD 3.31Å; E20-P51 WeakPolarHBondContact O-CD 3.04Å; I22-P51 HydrophobicContact CG1-CG 3.77Å; P51-E53 PolarHBondContact O-N 2.88Å; P51-L54 CarbonylContact O-C 3.55Å; P51-L54 PolarHBondContact O-N 3.3Å; P51-G55 PolarHBondContact O-N 3.19Å; P51-M56 HydrophobicContact CB-CB 3.99Å; P51-M56 HydrophobicContact CB-SD 4.37Å; P51-M56 PolarHBondContact O-N 2.77Å
52K88.1Confident88.9Confident173 Ų17387.7 Ų87.775%0.75246%0.461SS*.Hα-helixtrans-59.2-38.8179.7-176.8175.1-179.9176.70114.2T50 L54 G55T50-K52 PolarHBondContact O-N 3.41Å; K52-L54 VanDerWaalsContact C-N 3.35Å; K52-G55 PolarHBondContact O-N 3.5Å
53E88.8Confident88.9Confident91 Ų9189.4 Ų89.443%0.42545%0.454SS..Hα-helixtrans-77.2-26.5-179.385.6-159.5-153.600112.7H49 T50 P51H49-E53 WeakPolarHBondContact CA-OE1 3.33Å; H49-E53 WeakPolarHBondContact CB-OE1 3.38Å; H49-E53 IonicContact CD2-OE1 3.56Å; H49-E53 PolarHBondContact CD2-OE1 3.13Å; H49-E53 IonicContact CG-OE1 3.14Å; H49-E53 IonicContact NE2-OE1 3.5Å; T50-E53 PolarHBondContact N-OE1 3.35Å; T50-E53 PolarHBondContact N-OE2 3.38Å; T50-E53 VanDerWaalsContact N-OE2 3.13Å; T50-E53 WeakPolarHBondContact O-CG 3.19Å; T50-E53 PolarHBondContact O-N 3.13Å; T50-E53 PolarHBondContact OG1-N 3.32Å; T50-E53 PolarHBondContact OG1-OE2 2.96Å; P51-E53 PolarHBondContact O-N 2.88Å
54L88.9Confident88.7Confident21 Ų2187.7 Ų87.711%0.1145%0.451CS..Hα-helixtrans-80.8-10.9172.8-63.6-178.4000111.5I22 F40 I45 H49 T50 P51 K52 M56I22-L54 HydrophobicContact CD1-CD1 3.52Å; F40-L54 HydrophobicContact CD1-CB 4.06Å; F40-L54 HydrophobicContact CE1-CB 4.28Å; F40-L54 VanDerWaalsContact CE1-O 3.23Å; F40-L54 WeakPolarHBondContact CE1-O 3.4Å; I45-L54 HydrophobicContact CG1-CD1 4.01Å; I45-L54 HydrophobicContact CG2-CD1 4.34Å; H49-L54 HydrophobicContact CB-CD1 4.16Å; H49-L54 HydrophobicContact CB-CG 4.39Å; T50-L54 PolarHBondContact O-N 2.76Å; P51-L54 CarbonylContact O-C 3.55Å; P51-L54 PolarHBondContact O-N 3.3Å; K52-L54 VanDerWaalsContact C-N 3.35Å; L54-M56 VanDerWaalsContact C-N 3.26Å; L54-M56 HydrophobicContact CB-CE 4.45Å; L54-M56 HydrophobicContact CB-CG 3.97Å; L54-M56 HydrophobicContact CB-SD 4.4Å; L54-M56 HydrophobicContact CD1-CE 3.58Å; L54-M56 HydrophobicContact CD1-SD 4.08Å
55G89.9Confident88.6Confident49 Ų4987.3 Ų87.351%0.50545%0.45SS..THydrogen-bonded Turntrans6927.6-17400000112.5P51 K52P51-G55 PolarHBondContact O-N 3.19Å; K52-G55 PolarHBondContact O-N 3.5Å
56M90.3Very high88.3Confident31 Ų3193.5 Ų93.515%0.15348%0.479CS..  trans-69.8133.1178.6-75.7175.7169.300111.1I22 F40 I45 P51 L54 D60 I62I22-M56 HydrophobicContact CD1-CE 4.23Å; I22-M56 HydrophobicContact CD1-SD 4.03Å; I22-M56 HydrophobicContact CG1-SD 4.11Å; I22-M56 HydrophobicContact CG2-SD 4.44Å; F40-M56 HydrophobicContact CB-CE 3.46Å; F40-M56 VanDerWaalsContact CB-CE 3.46Å; F40-M56 HydrophobicContact CD1-CE 3.98Å; F40-M56 HydrophobicContact CD1-CG 4.15Å; F40-M56 HydrophobicContact CD2-CE 3.51Å; F40-M56 HydrophobicContact CD2-CG 4.03Å; F40-M56 HydrophobicContact CE1-CG 3.91Å; F40-M56 HydrophobicContact CE2-CE 4.22Å; F40-M56 HydrophobicContact CE2-CG 3.78Å; F40-M56 HydrophobicContact CG-CE 3.35Å; F40-M56 HydrophobicContact CG-CG 4.2Å; F40-M56 HydrophobicContact CZ-CB 4.47Å; F40-M56 HydrophobicContact CZ-CG 3.7Å; I45-M56 HydrophobicContact CD1-CE 3.73Å; I45-M56 HydrophobicContact CG1-CE 4.31Å; P51-M56 HydrophobicContact CB-CB 3.99Å; P51-M56 HydrophobicContact CB-SD 4.37Å; P51-M56 PolarHBondContact O-N 2.77Å; L54-M56 VanDerWaalsContact C-N 3.26Å; L54-M56 HydrophobicContact CB-CE 4.45Å; L54-M56 HydrophobicContact CB-CG 3.97Å; L54-M56 HydrophobicContact CB-SD 4.4Å; L54-M56 HydrophobicContact CD1-CE 3.58Å; L54-M56 HydrophobicContact CD1-SD 4.08Å; M56-D60 VanDerWaalsContact CA-OD2 3.27Å; M56-D60 WeakPolarHBondContact CA-OD2 3.48Å; M56-I62 HydrophobicContact CE-CD1 3.74Å; M56-I62 HydrophobicContact CE-CG1 3.96Å; M56-I62 HydrophobicContact SD-CD1 4.43Å
57E90.8Very high88.1Confident157 Ų15793.8 Ų93.873%0.73447%0.474SS*.  trans-105.2172.1173.2-61.6-169.2168.700111.4D60E57-D60 PolarHBondContact N-OD2 2.94Å; E57-D60 WeakPolarHBondContact O-CB 3.49Å; E57-D60 PolarHBondContact O-N 3.35Å
58E84.9Confident87.5Confident185 Ų18594.2 Ų94.286%0.86447%0.47SS*.THydrogen-bonded Turntrans-64.7140.8171.7-166.1169.5-166.300109.3D60E58-D60 VanDerWaalsContact C-N 3.26Å; E58-D60 PolarHBondContact O-N 3.49Å
59E87.3Confident86.6Confident187 Ų18793.5 Ų93.587%0.87447%0.471SS*.THydrogen-bonded Turntrans742.6-177.4-42.7-173.8140.900116.3
60D91.1Very high85.4Confident71 Ų7194.6 Ų94.638%0.3849%0.493SS..  trans-60.6146.7173.4-91.1-14.1000113.4F40 M56 E57 E58F40-D60 HydrophobicContact CE2-CB 3.88Å; F40-D60 WeakPolarHBondContact CE2-OD2 3.24Å; F40-D60 WeakPolarHBondContact CZ-OD2 3.47Å; M56-D60 VanDerWaalsContact CA-OD2 3.27Å; M56-D60 WeakPolarHBondContact CA-OD2 3.48Å; E57-D60 PolarHBondContact N-OD2 2.94Å; E57-D60 WeakPolarHBondContact O-CB 3.49Å; E57-D60 PolarHBondContact O-N 3.35Å; E58-D60 VanDerWaalsContact C-N 3.26Å; E58-D60 PolarHBondContact O-N 3.49Å
61V89.5Confident83.9Confident116 Ų11696.8 Ų96.870%0.70352%0.518SS*.  trans-100.8130.7-175.2-178.50000110.8
62I91.1Very high82.4Confident43 Ų43104.1 Ų104.122%0.22155%0.55CS.*  trans-107.4124.7173.1-63.6174.9000108.3I22 L24 F38 I45 M56I22-I62 HydrophobicContact CG2-CD1 3.96Å; L24-I62 HydrophobicContact CD2-CD1 3.44Å; L24-I62 VanDerWaalsContact CD2-CD1 3.44Å; L24-I62 HydrophobicContact CD2-CG2 4.34Å; F38-I62 HydrophobicContact CB-CG2 4.07Å; F38-I62 HydrophobicContact CD1-CG2 4.19Å; I45-I62 HydrophobicContact CD1-CD1 4Å; I45-I62 HydrophobicContact CD1-CG1 4.19Å; I45-I62 HydrophobicContact CD1-CG2 3.77Å; M56-I62 HydrophobicContact CE-CD1 3.74Å; M56-I62 HydrophobicContact CE-CG1 3.96Å; M56-I62 HydrophobicContact SD-CD1 4.43Å
63E91.1Very high80.7Confident91 Ų91100.9 Ų100.943%0.42555%0.549SS..EExtended strand (participates in β ladder)trans-81.7138.6174.7-56.8-175.916800110.1F38 L39 Y65F38-E63 CarbonylContact C-O 3.58Å; F38-E63 WeakPolarHBondContact CA-O 3.19Å; L39-E63 HydrophobicContact CB-CB 4.3Å; L39-E63 PolarHBondContact N-O 2.72Å; L39-E63 PolarHBondContact O-N 3.16Å; E63-Y65 HydrophobicContact CB-CD2 4.46Å; E63-Y65 HydrophobicContact CB-CE2 3.71Å; E63-Y65 WeakPolarHBondContact OE2-CE2 3.36Å; E63-Y65 PolarHBondContact OE2-OH 2.92Å
64V88.3Confident79.1Confident75 Ų75102.3 Ų102.346%0.45556%0.564SS.*EExtended strand (participates in β ladder)trans-125.3119-178.7-169.10000109.6L36 R37 F38L36-V64 HydrophobicContact CB-CG1 4.15Å; L36-V64 HydrophobicContact CD1-CG1 4.15Å; L36-V64 HydrophobicContact CD2-CG1 3.93Å; L36-V64 HydrophobicContact CG-CG1 4.31Å; R37-V64 WeakPolarHBondContact O-CA 3.44Å; F38-V64 HydrophobicContact CD1-CB 4.35Å; F38-V64 HydrophobicContact CD1-CG1 4Å; F38-V64 HydrophobicContact CD1-CG2 3.62Å; F38-V64 HydrophobicContact CE1-CB 4.42Å; F38-V64 HydrophobicContact CE1-CG1 3.75Å; F38-V64 HydrophobicContact CE1-CG2 3.78Å; F38-V64 HydrophobicContact CZ-CG1 4.35Å
65Y87.1Confident77.6Confident120 Ų120111.1 Ų111.147%0.47162%0.618SS.*EExtended strand (participates in β ladder)trans-112.8147.5175.7-62.8-89.7000109.9L36 R37 L39 E63 E67L36-Y65 CarbonylContact C-O 3.59Å; L36-Y65 VanDerWaalsContact CA-O 3.31Å; L36-Y65 WeakPolarHBondContact CA-O 3.37Å; R37-Y65 PolarHBondContact N-O 2.85Å; R37-Y65 PolarHBondContact O-N 2.75Å; L39-Y65 HydrophobicContact CD1-CD2 3.86Å; L39-Y65 HydrophobicContact CD1-CE2 3.6Å; L39-Y65 HydrophobicContact CG-CD2 4.23Å; L39-Y65 HydrophobicContact CG-CE2 4.26Å; E63-Y65 HydrophobicContact CB-CD2 4.46Å; E63-Y65 HydrophobicContact CB-CE2 3.71Å; E63-Y65 WeakPolarHBondContact OE2-CE2 3.36Å; E63-Y65 PolarHBondContact OE2-OH 2.92Å; Y65-E67 PolarHBondContact O-N 3.48Å
66Q86Confident76.9Confident147 Ų147114.2 Ų114.269%0.68762%0.624SS**EExtended strand (participates in β ladder)trans-71.7120.4165.3-77-179.576.400108.8V31 S35 L36 Q68V31-Q66 HydrophobicContact CG1-CG 4.35Å; S35-Q66 CarbonylContact O-C 3.42Å; S35-Q66 VanDerWaalsContact O-CA 3.24Å; S35-Q66 WeakPolarHBondContact O-CA 3.26Å; L36-Q66 HydrophobicContact CD2-CG 3.87Å; Q66-Q68 PolarHBondContact O-N 3.5Å
67E82.8Confident76.2Confident45 Ų45118.6 Ų118.621%0.2165%0.649CS.*  trans-67.5113.2170.3-174.5152.2-119.800107.7S35 R37 R44 Y65 T69S35-E67 PolarHBondContact O-N 2.76Å; R37-E67 IonicContact CZ-OE1 2.94Å; R37-E67 IonicContact NE-OE1 2.77Å; R37-E67 PolarHBondContact NE-OE1 2.93Å; R37-E67 IonicContact NH2-OE1 3.66Å; R37-E67 PolarHBondContact NH2-OE1 3.14Å; R44-E67 IonicContact CZ-OE1 3.35Å; R44-E67 IonicContact NH1-OE1 3.49Å; R44-E67 PolarHBondContact NH1-OE1 3.29Å; R44-E67 IonicContact NH2-OE1 2.69Å; R44-E67 PolarHBondContact NH2-OE1 3.27Å; R44-E67 IonicContact NH2-OE2 3.86Å; R44-E67 PolarHBondContact NH2-OE2 3.33Å; Y65-E67 PolarHBondContact O-N 3.48Å; E67-T69 VanDerWaalsContact C-N 3.3Å; E67-T69 HydrophobicContact CG-CG2 4.5Å; E67-T69 PolarHBondContact O-N 2.86Å; E67-T69 PolarHBondContact O-OG1 2.78Å
68Q72.6Confident75.4Confident173 Ų173116.4 Ų116.481%0.80864%0.644SS**  trans-70.787.7178.4-173.5-177.2-6.900109.7Q66 G70Q66-Q68 PolarHBondContact O-N 3.5Å; Q68-G70 PolarHBondContact O-N 2.69Å
69T65.1Low74.9Confident109 Ų109112.4 Ų112.467%0.66963%0.631SS**  trans-86.881.3169.432.90000109.7E67E67-T69 VanDerWaalsContact C-N 3.3Å; E67-T69 HydrophobicContact CG-CG2 4.5Å; E67-T69 PolarHBondContact O-N 2.86Å; E67-T69 PolarHBondContact O-OG1 2.78Å
70G61.7Low74.1Confident62 Ų62107.8 Ų107.864%0.63962%0.616SS**  trans87.4122.9166.300000115.3Q68 H72Q68-G70 PolarHBondContact O-N 2.69Å; G70-H72 PolarHBondContact O-N 3.4Å
71G58.2Low73Confident62 Ų62110.2 Ų110.264%0.63963%0.632SS**  trans-69.7114.2169.200000110S73G71-S73 PolarHBondContact O-N 3.09Å
72H56.8Low71.8Confident179 Ų179109.8 Ų109.883%0.82963%0.626SS**  trans-7273.3163.9-119.6-98.3000108.3G70 T74G70-H72 PolarHBondContact O-N 3.4Å; H72-T74 PolarHBondContact O-N 3.02Å
73S53Low70.3Confident104 Ų104114.9 Ų114.973%0.72766%0.658SS**  trans-74.381.2159-76.70000107.1G71 V75G71-S73 PolarHBondContact O-N 3.09Å; S73-V75 VanDerWaalsContact C-N 3.25Å; S73-V75 PolarHBondContact O-N 2.86Å; S73-V75 VanDerWaalsContact O-N 3.09Å
74T54.1Low68.6Low121 Ų121116.9 Ų116.974%0.74268%0.677SS**  trans-68.395.7152.236.60000106.5H72H72-T74 PolarHBondContact O-N 3.02Å
75V57.2Low66.8Low206 Ų206120.7 Ų120.7100%1.24870%0.697SS**  trans-72.70157-710000110.2S73S73-V75 VanDerWaalsContact C-N 3.25Å; S73-V75 PolarHBondContact O-N 2.86Å; S73-V75 VanDerWaalsContact O-N 3.09Å

Retrieved 75 of 75 residues in 52.8 ms (Link to these results)