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zvandehy committed Feb 16, 2021
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275 changes: 275 additions & 0 deletions BINF2111/Notebooks/.ipynb_checkpoints/1nap-angles-checkpoint.txt
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HEADER CYTOKINE 19-DEC-94 1NAP
REMARK
REMARK phipsi v. 0.99
REMARK torsion angles of each residue
REMARK Mon Dec 9 02:51:12 2019
REMARK
REMARK Used memory for PDB : 0.09 MB
REMARK
REMARK 999.9 -> cannot calculate the angle.
REMARK
REMARK phi psi omega
TORSIN ALA A 21 1 999.9 176.2 177.6
TORSIN GLU A 22 2 -105.7 -49.1 177.5
TORSIN LEU A 23 3 -90.0 109.5 -178.1
TORSIN ARG A 24 4 -131.6 56.4 179.4
TORSIN CYS A 25 5 -67.0 158.4 178.3
TORSIN LEU A 26 6 -97.2 -37.1 -178.3
TORSIN CYS A 27 7 -82.4 79.3 175.1
TORSIN ILE A 28 8 -65.6 -55.9 179.9
TORSIN LYS A 29 9 -106.6 137.9 -178.2
TORSIN THR A 30 10 -128.0 145.1 178.4
TORSIN THR A 31 11 -117.8 158.3 179.6
TORSIN SER A 32 12 -119.0 -11.4 -179.4
TORSIN GLY A 33 13 -112.8 113.0 176.7
TORSIN ILE A 34 14 -152.4 146.1 178.6
TORSIN HIS A 35 15 -105.4 130.2 -178.5
TORSIN PRO A 36 16 -35.4 -36.2 -176.5
TORSIN LYS A 37 17 -60.6 -34.8 -179.0
TORSIN ASN A 38 18 -77.9 -12.8 178.8
TORSIN ILE A 39 19 -87.6 128.3 177.7
TORSIN GLN A 40 20 -93.3 -58.2 -178.9
TORSIN SER A 41 21 -147.5 160.3 179.8
TORSIN LEU A 42 22 -134.9 140.3 176.9
TORSIN GLU A 43 23 -120.8 126.4 177.8
TORSIN VAL A 44 24 -107.6 118.3 -179.7
TORSIN ILE A 45 25 -112.6 119.9 -178.7
TORSIN GLY A 46 26 -68.4 163.9 175.1
TORSIN LYS A 47 27 -55.1 140.4 -176.9
TORSIN GLY A 48 28 -140.7 -171.4 -179.1
TORSIN THR A 49 29 -71.4 -33.3 -177.1
TORSIN HIS A 50 30 -98.3 17.2 177.0
TORSIN CYS A 51 31 -166.4 110.4 -179.6
TORSIN ASN A 52 32 -66.1 -3.4 -179.6
TORSIN GLN A 53 33 -132.2 162.1 177.8
TORSIN VAL A 54 34 -79.4 127.3 178.8
TORSIN GLU A 55 35 -111.1 136.8 177.8
TORSIN VAL A 56 36 -122.7 116.5 179.0
TORSIN ILE A 57 37 -109.5 119.0 179.4
TORSIN ALA A 58 38 -95.4 137.1 177.4
TORSIN THR A 59 39 -109.2 118.1 -178.3
TORSIN LEU A 60 40 -80.3 164.2 176.6
TORSIN LYS A 61 41 -60.5 -21.2 179.1
TORSIN ASP A 62 42 -92.5 0.4 179.1
TORSIN GLY A 63 43 91.7 -3.3 178.8
TORSIN ARG A 64 44 -77.3 149.0 179.5
TORSIN LYS A 65 45 -116.3 137.5 -179.8
TORSIN ILE A 66 46 -141.1 146.3 179.9
TORSIN CYS A 67 47 -86.0 128.1 179.4
TORSIN LEU A 68 48 -104.6 154.3 178.1
TORSIN ASP A 69 49 -78.7 106.6 178.7
TORSIN PRO A 70 50 -62.3 -24.8 179.8
TORSIN ASP A 71 51 -83.5 -16.4 -178.1
TORSIN ALA A 72 52 -78.4 120.5 178.7
TORSIN PRO A 73 53 -51.5 -32.2 179.7
TORSIN ARG A 74 54 -61.2 -42.8 -177.1
TORSIN ILE A 75 55 -67.4 -49.1 178.4
TORSIN LYS A 76 56 -56.2 -37.7 -179.9
TORSIN LYS A 77 57 -70.3 -34.1 177.9
TORSIN ILE A 78 58 -66.2 -43.9 -179.7
TORSIN VAL A 79 59 -59.1 -46.7 179.2
TORSIN GLN A 80 60 -63.5 -39.9 179.9
TORSIN LYS A 81 61 -71.7 -27.8 -179.8
TORSIN LYS A 82 62 -69.8 -44.3 -177.9
TORSIN LEU A 83 63 -61.5 -40.0 179.4
TORSIN ALA A 84 64 -79.3 -7.9 -178.9
TORSIN GLY A 85 65 63.5 23.2 179.1
TORSIN ASP A 86 66 -83.6 999.9 999.9
TORSIN ALA B 21 1 999.9 134.4 -177.2
TORSIN GLU B 22 2 -73.3 140.1 -179.9
TORSIN LEU B 23 3 -108.0 123.1 178.1
TORSIN ARG B 24 4 -105.0 -120.9 178.9
TORSIN CYS B 25 5 -75.9 135.0 -179.2
TORSIN LEU B 26 6 -87.2 -29.6 -175.6
TORSIN CYS B 27 7 -96.4 98.5 176.8
TORSIN ILE B 28 8 -75.8 -45.4 -179.4
TORSIN LYS B 29 9 -114.9 149.3 -179.6
TORSIN THR B 30 10 -127.7 158.5 176.8
TORSIN THR B 31 11 -138.4 145.5 177.6
TORSIN SER B 32 12 -105.7 2.8 -178.1
TORSIN GLY B 33 13 -120.1 104.0 175.5
TORSIN ILE B 34 14 -137.6 156.6 176.7
TORSIN HIS B 35 15 -98.2 135.5 179.1
TORSIN PRO B 36 16 -57.0 -31.6 -177.0
TORSIN LYS B 37 17 -69.9 -13.9 179.1
TORSIN ASN B 38 18 -89.6 -12.4 -177.3
TORSIN ILE B 39 19 -80.5 123.0 176.6
TORSIN GLN B 40 20 -97.1 -38.4 178.9
TORSIN SER B 41 21 -153.7 162.3 -180.0
TORSIN LEU B 42 22 -132.5 135.2 177.2
TORSIN GLU B 43 23 -116.1 125.3 179.8
TORSIN VAL B 44 24 -108.6 116.0 178.1
TORSIN ILE B 45 25 -102.8 115.6 -179.1
TORSIN GLY B 46 26 -74.7 165.2 177.7
TORSIN LYS B 47 27 -53.4 134.1 -177.2
TORSIN GLY B 48 28 -143.8 -165.7 -179.0
TORSIN THR B 49 29 -43.7 -76.2 -178.0
TORSIN HIS B 50 30 -96.2 60.0 175.8
TORSIN CYS B 51 31 161.5 95.5 -177.8
TORSIN ASN B 52 32 -89.0 47.2 176.4
TORSIN GLN B 53 33 -155.3 156.8 177.8
TORSIN VAL B 54 34 -85.3 143.4 178.2
TORSIN GLU B 55 35 -128.1 140.7 176.4
TORSIN VAL B 56 36 -125.7 117.6 -179.7
TORSIN ILE B 57 37 -113.9 119.9 178.4
TORSIN ALA B 58 38 -96.9 141.3 175.5
TORSIN THR B 59 39 -105.0 122.2 -180.0
TORSIN LEU B 60 40 -78.7 164.5 178.0
TORSIN LYS B 61 41 -61.2 -16.6 178.8
TORSIN ASP B 62 42 -99.8 9.2 177.9
TORSIN GLY B 63 43 81.6 0.0 179.6
TORSIN ARG B 64 44 -73.8 152.3 178.4
TORSIN LYS B 65 45 -116.8 127.9 -178.0
TORSIN ILE B 66 46 -124.5 137.6 177.9
TORSIN CYS B 67 47 -82.4 116.2 179.9
TORSIN LEU B 68 48 -98.3 155.3 -179.2
TORSIN ASP B 69 49 -86.6 110.6 -177.4
TORSIN PRO B 70 50 -68.6 -12.6 -178.8
TORSIN ASP B 71 51 -93.8 -22.4 -178.7
TORSIN ALA B 72 52 -69.2 120.7 179.7
TORSIN PRO B 73 53 -49.0 -36.5 179.6
TORSIN ARG B 74 54 -64.1 -36.0 -179.8
TORSIN ILE B 75 55 -73.7 -44.3 178.3
TORSIN LYS B 76 56 -53.1 -43.5 179.3
TORSIN LYS B 77 57 -65.6 -43.7 179.9
TORSIN ILE B 78 58 -60.7 -44.4 178.6
TORSIN VAL B 79 59 -55.3 -57.2 -179.5
TORSIN GLN B 80 60 -56.6 -36.5 -179.9
TORSIN LYS B 81 61 -71.0 -34.4 179.3
TORSIN LYS B 82 62 -67.4 -36.4 176.9
TORSIN LEU B 83 63 -63.4 -53.0 -179.7
TORSIN ALA B 84 64 -66.4 -8.9 179.3
TORSIN GLY B 85 65 65.1 27.8 -178.4
TORSIN ASP B 86 66 -93.2 999.9 999.9
TORSIN ARG C 24 1 999.9 177.6 -178.4
TORSIN CYS C 25 2 -36.7 134.9 176.8
TORSIN LEU C 26 3 -76.6 -46.3 -175.5
TORSIN CYS C 27 4 -73.0 92.7 179.3
TORSIN ILE C 28 5 -70.8 -44.5 -179.5
TORSIN LYS C 29 6 -129.9 144.1 -177.8
TORSIN THR C 30 7 -129.0 125.6 179.0
TORSIN THR C 31 8 -98.8 161.6 179.9
TORSIN SER C 32 9 -143.2 4.3 -179.4
TORSIN GLY C 33 10 -110.0 82.5 -179.3
TORSIN ILE C 34 11 -153.8 153.4 179.0
TORSIN HIS C 35 12 -124.2 144.1 -178.4
TORSIN PRO C 36 13 -17.8 -54.9 -177.5
TORSIN LYS C 37 14 -43.7 -45.9 -178.4
TORSIN ASN C 38 15 -79.4 -15.7 179.2
TORSIN ILE C 39 16 -81.6 111.2 178.8
TORSIN GLN C 40 17 -81.6 -46.4 178.9
TORSIN SER C 41 18 -155.0 161.8 179.3
TORSIN LEU C 42 19 -131.5 149.2 177.8
TORSIN GLU C 43 20 -130.3 123.3 -179.8
TORSIN VAL C 44 21 -107.4 112.9 179.5
TORSIN ILE C 45 22 -107.6 123.3 180.0
TORSIN GLY C 46 23 -72.8 153.2 -179.5
TORSIN LYS C 47 24 -60.9 150.9 -179.0
TORSIN GLY C 48 25 -157.4 179.1 -178.9
TORSIN THR C 49 26 -55.1 -19.6 -180.0
TORSIN HIS C 50 27 -108.6 12.3 176.8
TORSIN CYS C 51 28 -168.5 122.4 -177.7
TORSIN ASN C 52 29 -85.3 -5.2 179.7
TORSIN GLN C 53 30 -116.9 151.8 175.3
TORSIN VAL C 54 31 -74.9 138.9 179.3
TORSIN GLU C 55 32 -115.0 136.9 -179.4
TORSIN VAL C 56 33 -126.7 114.8 179.6
TORSIN ILE C 57 34 -111.2 123.8 177.5
TORSIN ALA C 58 35 -101.3 139.4 176.0
TORSIN THR C 59 36 -102.4 123.2 -179.2
TORSIN LEU C 60 37 -91.2 159.1 179.5
TORSIN LYS C 61 38 -50.5 -28.7 -179.9
TORSIN ASP C 62 39 -88.6 3.5 178.1
TORSIN GLY C 63 40 92.7 -12.2 179.8
TORSIN ARG C 64 41 -69.3 161.9 177.5
TORSIN LYS C 65 42 -125.7 145.0 178.5
TORSIN ILE C 66 43 -137.9 151.5 178.1
TORSIN CYS C 67 44 -101.8 130.5 -178.9
TORSIN LEU C 68 45 -104.5 150.0 178.9
TORSIN ASP C 69 46 -79.4 113.3 -178.4
TORSIN PRO C 70 47 -65.0 -18.4 -178.1
TORSIN ASP C 71 48 -95.2 -16.0 179.7
TORSIN ALA C 72 49 -68.2 125.9 179.1
TORSIN PRO C 73 50 -57.5 -35.4 177.8
TORSIN ARG C 74 51 -56.8 -49.2 -180.0
TORSIN ILE C 75 52 -67.4 -36.1 180.0
TORSIN LYS C 76 53 -63.6 -33.2 179.2
TORSIN LYS C 77 54 -69.9 -44.4 178.2
TORSIN ILE C 78 55 -56.7 -37.8 -178.7
TORSIN VAL C 79 56 -70.2 -47.4 179.6
TORSIN GLN C 80 57 -60.1 -31.3 -179.6
TORSIN LYS C 81 58 -77.2 -44.4 179.5
TORSIN LYS C 82 59 -59.4 -38.2 -178.6
TORSIN LEU C 83 60 -68.7 -21.4 -179.9
TORSIN ALA C 84 61 -99.0 -11.7 -179.8
TORSIN GLY C 85 62 83.6 16.5 -179.6
TORSIN ASP C 86 63 -95.4 999.9 999.9
TORSIN ALA D 21 1 999.9 92.4 180.0
TORSIN GLU D 22 2 -76.8 -37.1 179.6
TORSIN LEU D 23 3 -104.6 111.6 -178.9
TORSIN ARG D 24 4 -102.3 -119.8 178.7
TORSIN CYS D 25 5 -79.6 142.4 -179.9
TORSIN LEU D 26 6 -98.9 -27.8 -178.8
TORSIN CYS D 27 7 -120.3 87.5 176.0
TORSIN ILE D 28 8 -86.4 -34.1 175.5
TORSIN LYS D 29 9 -109.1 134.0 -178.6
TORSIN THR D 30 10 -122.0 -149.2 178.3
TORSIN THR D 31 11 -173.6 153.8 177.2
TORSIN SER D 32 12 -117.8 -19.4 -178.0
TORSIN GLY D 33 13 -85.6 84.5 176.1
TORSIN ILE D 34 14 -137.3 139.2 176.8
TORSIN HIS D 35 15 -91.2 120.0 -179.2
TORSIN PRO D 36 16 -52.6 -31.1 178.7
TORSIN LYS D 37 17 -69.7 -14.0 178.5
TORSIN ASN D 38 18 -86.1 -11.7 -177.5
TORSIN ILE D 39 19 -84.7 124.5 177.0
TORSIN GLN D 40 20 -93.3 -50.2 179.5
TORSIN SER D 41 21 -148.6 162.5 -179.8
TORSIN LEU D 42 22 -130.0 139.4 176.6
TORSIN GLU D 43 23 -124.9 125.4 179.2
TORSIN VAL D 44 24 -111.0 113.4 178.4
TORSIN ILE D 45 25 -98.7 125.1 -179.8
TORSIN GLY D 46 26 -77.1 165.9 177.6
TORSIN LYS D 47 27 -53.8 128.8 179.0
TORSIN GLY D 48 28 -120.1 -169.4 179.3
TORSIN THR D 49 29 -84.8 -37.3 179.7
TORSIN HIS D 50 30 -68.3 -22.1 177.5
TORSIN CYS D 51 31 -150.1 101.4 -177.5
TORSIN ASN D 52 32 -87.7 56.0 176.0
TORSIN GLN D 53 33 -166.8 160.6 -179.4
TORSIN VAL D 54 34 -87.0 134.1 179.1
TORSIN GLU D 55 35 -120.0 144.3 -179.7
TORSIN VAL D 56 36 -130.6 122.9 -179.8
TORSIN ILE D 57 37 -123.3 121.1 178.1
TORSIN ALA D 58 38 -98.5 135.5 174.3
TORSIN THR D 59 39 -99.9 125.4 -178.5
TORSIN LEU D 60 40 -87.6 166.6 179.8
TORSIN LYS D 61 41 -59.3 -32.3 179.7
TORSIN ASP D 62 42 -89.8 15.3 178.1
TORSIN GLY D 63 43 89.3 -21.2 178.9
TORSIN ARG D 64 44 -61.0 154.2 179.1
TORSIN LYS D 65 45 -124.4 137.7 178.5
TORSIN ILE D 66 46 -139.3 142.0 176.9
TORSIN CYS D 67 47 -76.1 127.0 178.8
TORSIN LEU D 68 48 -110.2 150.2 177.9
TORSIN ASP D 69 49 -78.0 108.7 -179.6
TORSIN PRO D 70 50 -63.1 -19.0 -178.2
TORSIN ASP D 71 51 -95.0 -22.3 -179.9
TORSIN ALA D 72 52 -66.4 126.4 -179.6
TORSIN PRO D 73 53 -47.9 -43.4 177.1
TORSIN ARG D 74 54 -58.9 -43.0 -178.5
TORSIN ILE D 75 55 -69.7 -36.7 178.6
TORSIN LYS D 76 56 -64.0 -41.6 179.0
TORSIN LYS D 77 57 -57.2 -58.2 179.1
TORSIN ILE D 78 58 -52.6 -42.7 178.9
TORSIN VAL D 79 59 -61.6 -45.2 -178.8
TORSIN GLN D 80 60 -65.2 -33.1 178.5
TORSIN LYS D 81 61 -72.8 -43.4 178.7
TORSIN LYS D 82 62 -58.6 -46.8 179.2
TORSIN LEU D 83 63 -56.3 -39.4 -176.7
TORSIN ALA D 84 64 -87.3 -6.6 -177.9
TORSIN GLY D 85 65 64.6 33.4 178.6
TORSIN ASP D 86 66 -79.9 999.9 999.9
REMARK user time : 0 sec.
REMKRK system time : 0 sec.
END
66 changes: 66 additions & 0 deletions BINF2111/Notebooks/.ipynb_checkpoints/1nap-anglesFORMATTED-checkpoint.txt
Original file line number Diff line number Diff line change
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ALA 21 999.9 176.2
GLU 22-105.7 -49.1
LEU 23 -90.0 109.5
ARG 24-131.6 56.4
CYS 25 -67.0 158.4
LEU 26 -97.2 -37.1
CYS 27 -82.4 79.3
ILE 28 -65.6 -55.9
LYS 29-106.6 137.9
THR 30-128.0 145.1
THR 31-117.8 158.3
SER 32-119.0 -11.4
GLY 33-112.8 113.0
ILE 34-152.4 146.1
HIS 35-105.4 130.2
PRO 36 -35.4 -36.2
LYS 37 -60.6 -34.8
ASN 38 -77.9 -12.8
ILE 39 -87.6 128.3
GLN 40 -93.3 -58.2
SER 41-147.5 160.3
LEU 42-134.9 140.3
GLU 43-120.8 126.4
VAL 44-107.6 118.3
ILE 45-112.6 119.9
GLY 46 -68.4 163.9
LYS 47 -55.1 140.4
GLY 48-140.7-171.4
THR 49 -71.4 -33.3
HIS 50 -98.3 17.2
CYS 51-166.4 110.4
ASN 52 -66.1 -3.4
GLN 53-132.2 162.1
VAL 54 -79.4 127.3
GLU 55-111.1 136.8
VAL 56-122.7 116.5
ILE 57-109.5 119.0
ALA 58 -95.4 137.1
THR 59-109.2 118.1
LEU 60 -80.3 164.2
LYS 61 -60.5 -21.2
ASP 62 -92.5 0.4
GLY 63 91.7 -3.3
ARG 64 -77.3 149.0
LYS 65-116.3 137.5
ILE 66-141.1 146.3
CYS 67 -86.0 128.1
LEU 68-104.6 154.3
ASP 69 -78.7 106.6
PRO 70 -62.3 -24.8
ASP 71 -83.5 -16.4
ALA 72 -78.4 120.5
PRO 73 -51.5 -32.2
ARG 74 -61.2 -42.8
ILE 75 -67.4 -49.1
LYS 76 -56.2 -37.7
LYS 77 -70.3 -34.1
ILE 78 -66.2 -43.9
VAL 79 -59.1 -46.7
GLN 80 -63.5 -39.9
LYS 81 -71.7 -27.8
LYS 82 -69.8 -44.3
LEU 83 -61.5 -40.0
ALA 84 -79.3 -7.9
GLY 85 63.5 23.2
ASP 86 -83.6 999.9
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