NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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22491 |
2jox   |
15208 | cing | 1-original | 2 | DYANA/DIANA | dihedral angle |
#Num Res Ang phi psi Dif Count Class # 2 CYSS PHI 9999.0 9999.0 # 0.0 0/10 None # 2 CYSS PSI 9999.0 9999.0 # 0.0 # 2 CYSS PSI 103.0 138.5 # pfrb #rm 26aug5 # 3 GLY PHI -147.5 -84.2 # 31.7 5/10 New # 3 GLY PSI 150.3 190.9 # 20.3 # 3 GLY PHI -84.2 -50.0 # pfrb #rm 26aug5 # 3 GLY PSI -31.1 -3.1 # pfrb #rm 26aug5 # 4 ASP PHI -96.1 -56.4 # 19.8 5/10 New # 4 ASP PSI -35.6 -5.0 # 15.3 # 4 ASP PHI -98.5 -69.1 # pfrb #rm 26aug5 # 4 ASP PSI -67.0 -39.8 # pfrb #rm 26aug5 # 5 CYSS PHI -97.0 -67.8 # 14.6 6/10 New # 5 CYSS PSI 107.6 154.9 # 23.7 # 5 CYSS PHI -128.7 -101.2 # pfrb #rm 26aug5 # 5 CYSS PSI -21.6 0.0 # pfrb #rm 26aug5 # 6 VAL PHI -96.5 -66.5 # 15.0 9/10 Good # 6 VAL PSI -39.2 -5.3 # 17.0 # 6 VAL PHI -180.0 0.0 # noe #rm 26aug5 # 6 VAL PSI 90.0 180.0 # noe #rm 26aug5 # 7 GLU PHI -145.3 -104.7 # 20.3 8/10 New # 7 GLU PSI 149.6 165.0 # 7.7 # 7 GLU PHI -180.0 0.0 # noe #rm 26aug5 # 7 GLU PSI -90.0 45.0 # noe #rm 26aug5 # 8 LYS PHI -82.8 -58.9 # 11.9 6/10 New # 8 LYS PSI 127.8 159.2 # 15.7 # 8 LYS PHI -180.0 0.0 # noe #rm 26aug5 # 8 LYS PSI 90.0 180.0 # noe #rm 26aug5 # 9 GLU PHI -140.3 -107.0 # 16.7 7/10 New # 9 GLU PSI 135.3 168.5 # 16.6 # 9 GLU PHI -180.0 0.0 # noe #rm 26aug5 # 9 GLU PSI 90.0 180.0 # noe #rm 26aug5 # 10 TYR PHI -103.9 -53.2 # 25.4 8/10 New # 10 TYR PSI 132.4 165.6 # 16.6 # 11 PRO PHI -151.0 -62.3 # 44.3 5/10 New # 11 PRO PSI 126.3 159.4 # 16.5 # 12 ASN PHI -70.6 -53.8 # 8.4 7/10 New #rm 26aug5 # 12 ASN PSI 140.7 163.9 # 11.6 #rm 26aug5 # 13 ARG PHI -101.8 -53.1 # 24.4 8/10 New #rm 26aug5 # 13 ARG PSI 121.1 154.2 # 16.6 #rm 19aug5 # 14 GLY PHI -103.8 -81.0 # 11.4 6/10 New # 14 GLY PSI 97.1 185.3 # 44.1 # 14 GLY PHI 30.0 90.0 # type I' #rm 26aug5 # 14 GLY PSI 0.0 60.0 # type I' #rm 26aug5 # 15 ASN PHI 45.3 213.8 # 84.3 10/10 New # 15 ASN PSI -173.1 -92.4 # 40.4 # 15 ASN PHI 60.0 120.0 # type I' #rm 26aug5 # 15 ASN PSI -30.0 30.0 # type I' #rm 26aug5 # 16 THR PHI -113.8 -75.7 # 19.1 6/10 New # 16 THR PSI 112.0 158.9 # 23.4 # 17 CYS PHI -105.5 -59.9 # 22.8 9/10 Good # 17 CYS PSI 105.0 141.1 # 18.0 # 18 LEU PHI -120.0 -89.2 # 15.4 8/10 New # 18 LEU PSI 100.1 138.4 # 19.1 # 19 GLU PHI -127.5 -88.2 # 19.6 7/10 New # 19 GLU PSI 118.8 147.7 # 14.5 # 20 ASN PHI -128.0 -66.3 # 30.9 6/10 New # 20 ASN PSI 108.9 166.9 # 29.0 # 21 GLY PHI -145.3 -95.2 # 25.1 9/10 Good # 21 GLY PSI 135.5 180.4 # 22.4 # 22 SER PHI 64.5 92.4 # 13.9 8/10 New # 22 SER PSI 5.3 36.1 # 15.4 # 23 PHE PHI -122.6 -77.9 # 22.3 9/10 Good # 23 PHE PSI 120.1 159.1 # 19.5 # 24 LEU PHI -123.2 -85.1 # 19.1 9/10 Good # 24 LEU PSI 97.1 141.3 # 22.1 # 25 LEU PHI -68.3 -53.4 # 7.5 9/10 New # 25 LEU PSI -42.0 -15.0 # 13.5 # 26 ASN PHI -80.2 -59.5 # 10.3 10/10 Good # 26 ASN PSI -38.2 -17.2 # 10.5 # 27 PHE PHI -138.7 -93.4 # 22.6 9/10 Good # 27 PHE PSI 115.8 166.4 # 25.3 # 28 THR PHI -123.0 -91.3 # 15.9 10/10 Good # 28 THR PSI 111.8 138.6 # 13.4 # 29 GLY PHI -121.2 -71.1 # 25.1 5/10 New # 29 GLY PSI 117.0 179.2 # 31.1 # 30 CYSS PHI -90.9 -67.5 # 11.7 4/10 New # 30 CYSS PSI 116.5 149.4 # 16.4 # 30 CYSS PHI -84.2 -64.2 # pfrb # 30 CYSS PSI 103.0 123.0 # pfrb # 31 ALA PHI -112.6 -56.4 # 28.1 9/10 Good # 31 ALA PSI 116.1 152.4 # 18.2 # 31 ALA PHI -74.7 -54.7 # pfrb # 31 ALA PSI -31.1 -11.1 # pfrb # 32 VAL PHI -70.5 -54.9 # 7.8 8/10 New # 32 VAL PSI -51.3 -13.6 # 18.8 # 32 VAL PHI -89.0 -69.0 # pfrb # 32 VAL PSI -59.8 -39.8 # pfrb # 33 CYSS PHI -96.0 -57.8 # 19.1 9/10 Good # 33 CYSS PSI -48.5 -24.9 # 11.8 # 33 CYSS PHI -128.7 -108.7 # pfrb # 33 CYSS PSI -21.6 -1.6 # pfrb # 34 SER PHI -91.5 -70.5 # 10.4 8/10 New # 34 SER PSI -49.6 5.7 # 27.6 # 34 SER PHI 77.7 97.7 # pfrb # 34 SER PSI -11.4 9.6 # pfrb # 35 LYS PHI -66.1 -55.7 # 5.2 9/10 Good # 35 LYS PSI -34.5 -17.0 # 8.7 # 35 LYS PHI -65.3 -45.3 # pfrb # 35 LYS PSI 129.6 149.6 # pfrb 36 ARG PHI -180.0 0.0 # restricted # 36 ARG PHI -96.2 -67.5 # 14.4 7/10 New add 8aug5 rm 26aug5 # 36 ARG PSI -35.4 12.7 # 24.1 rm 26aug5 # 37 ASP PHI -136.6 -69.2 # 33.7 6/10 New add 8aug5 rm 26aug5 # 37 ASP PSI 110.7 172.3 # 30.8 rm 19aug5 # 38 PHE PHI -122.9 -71.1 # 25.9 7/10 New add 8aug5 # 38 PHE PSI 115.3 167.4 # 26.0 # 39 MET PHI -146.0 -67.6 # 39.2 5/10 New add 8aug5 # 39 MET PSI 96.0 163.7 # 33.9 # 40 LEU PHI -124.1 -72.4 # 25.9 8/10 New add 8aug5 # 40 LEU PSI 130.4 155.8 # 12.7 41 ILE PHI -136.5 -101.4 # 17.6 10/10 Good 41 ILE PSI 124.9 143.4 # 9.2 # 42 THR PHI -120.2 -94.2 # 13.0 10/10 Good add 8aug5 # 42 THR PSI 105.6 130.7 # 12.6 # 43 ASN PHI -151.1 -101.0 # 25.1 10/10 Good # 43 ASN PSI 119.8 173.4 # 26.8 # 44 LYS PHI -86.5 -52.8 # 16.9 5/10 New # 44 LYS PSI 134.0 152.9 # 9.4 45 SER PHI -107.3 -56.4 # 25.4 9/10 Good 45 SER PSI 107.1 156.1 # 24.5 46 LEU PHI -147.0 -85.0 # 31.0 10/10 Good 46 LEU PSI 111.8 137.6 # 12.9 47 LYS PHI -132.0 -96.5 # 17.7 10/10 Good 47 LYS PSI 118.9 146.3 # 13.7 48 GLU PHI -142.3 -109.8 # 16.3 10/10 Good 48 GLU PSI 116.7 149.6 # 16.4 49 GLU PHI -118.2 -100.8 # 8.7 10/10 Good 49 GLU PSI 121.6 145.7 # 12.0 # 50 ASP PHI -155.9 -109.8 # 23.1 9/10 Good # 50 ASP PSI 103.2 147.1 # 21.9 # 50 ASP PHI 40.0 60.0 # Type I' BH 50 # 50 ASP PSI 30.0 50.0 # Type I' BH 40 # 51 GLY PHI -109.5 -47.5 # 31.0 7/10 New # 51 GLY PSI 119.0 162.7 # 21.9 # 51 GLY PHI 90.0 110.0 # Type I' BH 100 # 51 GLY PSI -40.0 -20.0 # Type I' BH -30 # 52 GLU PHI 72.1 90.0 # 8.9 6/10 New # 52 GLU PSI -18.3 16.8 # 17.6 53 GLU PHI -118.0 -85.9 # 16.1 10/10 Good 53 GLU PSI 129.9 167.0 # 18.6 54 ILE PHI -138.3 -104.3 # 17.0 10/10 Good 54 ILE PSI 124.1 144.7 # 10.3 55 VAL PHI -132.4 -117.4 # 7.5 10/10 Good 55 VAL PSI 118.4 131.4 # 6.5 56 THR PHI -121.5 -105.6 # 8.0 10/10 Good 56 THR PSI 120.7 137.6 # 8.4 # 57 TYR PHI -134.7 -112.5 # 11.1 10/10 Good # 57 TYR PSI 126.7 159.1 # 16.2 #rm 6sep5 58 ASP PHI -173.1 -142.0 # 15.6 10/10 Good 58 ASP PSI 158.5 171.2 # 6.4 59 HIS PHI -136.6 -98.8 # 18.9 10/10 Good 59 HIS PSI 133.5 161.9 # 14.2 # 60 LEU PHI -131.9 -92.9 # 19.5 9/10 New # 60 LEU PSI 110.2 149.9 # 19.9 # 61 CYSS PHI -133.2 -104.4 # 14.4 10/10 Good # 61 CYSS PSI 117.6 156.4 # 19.4 # 61 CYSS PHI -63.3 -43.3 # pfrb # 61 CYSS PSI 118.5 138.5 # pfrb # 62 LYS PHI -124.7 -64.1 # 30.3 10/10 Good # 62 LYS PSI 116.3 150.2 # 17.0 # 62 LYS PHI -74.7 -54.7 # pfrb # 62 LYS PSI -23.1 -3.1 # pfrb # 63 ASN PHI -80.7 -52.9 # 13.9 8/10 New # 63 ASN PSI -38.0 0.5 # 19.3 # 63 ASN PHI -98.5 -78.5 # pfrb # 63 ASN PSI -67.0 -47.0 # pfrb # 64 CYSS PHI -107.0 -59.2 # 23.9 7/10 New # 64 CYSS PSI -45.8 -23.0 # 11.4 # 64 CYSS PHI -121.2 -101.0 # pfrb # 64 CYSS PSI -20.0 0.0 # pfrb # 65 HIS PHI -115.1 -74.0 # 20.6 5/10 New # 65 HIS PSI -29.6 9.8 # 19.7 # 65 HIS PHI 73.5 93.5 # pfrb # 65 HIS PSI -1.5 18.5 # pfrb # 66 HIS PHI -93.7 -57.1 # 18.3 5/10 New # 66 HIS PSI 110.9 140.5 # 14.8 # 67 VAL PHI -98.0 -57.9 # 20.1 10/10 Good add 8aug5 rm # 67 VAL PSI 125.5 140.9 # 7.7 # 68 ILE PHI -101.9 -62.0 # 20.0 10/10 Good add 8aug5 # 68 ILE PSI 103.2 131.5 # 14.1 # 69 ALA PHI -103.5 -76.7 # 13.4 9/10 New # 69 ALA PSI -54.0 -24.3 # 14.9 # 70 ARG PHI -171.3 -144.5 # 13.4 7/10 New # 70 ARG PSI 135.4 164.0 # 14.3 # 71 HIST PHI -133.2 -78.3 # 27.4 10/10 Good # 71 HIST PSI 114.6 140.2 # 12.8 72 GLU PHI -140.2 -94.3 # 22.9 9/10 Good 72 GLU PSI 124.5 144.9 # 10.2 73 TYR PHI -138.0 -112.1 # 13.0 10/10 Good 73 TYR PSI 121.3 131.1 # 4.9 74 THR PHI -130.1 -105.9 # 12.1 10/10 Good 74 THR PSI 116.2 135.8 # 9.8 75 PHE PHI -134.8 -113.3 # 10.8 10/10 Good 75 PHE PSI 123.5 155.8 # 16.2 76 SER PHI -134.7 -120.4 # 7.2 10/10 Good 76 SER PSI 129.1 142.6 # 6.7 77 ILE PHI -143.7 -100.6 # 21.5 10/10 Good 77 ILE PSI 122.0 156.3 # 17.1 78 MET PHI -119.1 -81.4 # 18.9 10/10 Good 78 MET PSI 115.8 133.7 # 9.0 # 79 ASP PHI -120.7 -74.0 # 23.4 9/10 New # 79 ASP PSI 115.9 166.4 # 25.2 # 79 ASP PHI 40.0 60.0 #type II' BH 50 # 79 ASP PSI -80.0 -60.0 #type II' BH -70 # 80 GLU PHI -69.5 -50.1 # 9.7 9/10 Good # 80 GLU PSI -36.0 -6.9 # 14.6 # 80 GLU PHI -100.0 -80.0 #type II' BH -90 # 80 GLU PSI -30.0 -10.0 #type II' BH -20 # 81 PHE PHI -112.1 -74.1 # 19.0 8/10 New # 81 PHE PSI -31.1 4.6 # 17.9 82 GLN PHI -147.4 -107.5 # 20.0 10/10 Good 82 GLN PSI 143.6 164.6 # 10.5 83 GLU PHI -148.5 -114.5 # 17.0 10/10 Good 83 GLU PSI 129.3 155.6 # 13.1 84 TYR PHI -137.9 -111.8 # 13.1 10/10 Good 84 TYR PSI 125.5 153.9 # 14.2 85 THR PHI -139.8 -112.9 # 13.4 10/10 Good 85 THR PSI 125.6 150.7 # 12.6 86 MET PHI -158.1 -129.8 # 14.2 10/10 Good 86 MET PSI 143.3 172.6 # 14.6 # 87 LEU PHI -161.2 -135.6 # 12.8 10/10 Good # 87 LEU PSI 130.0 150.1 # 10.1 # 88 CYSZ PHI -117.3 -87.5 # 14.9 10/10 Good # 88 CYSZ PSI 114.6 133.6 # 9.5 # 89 LEU PHI -144.6 -83.1 # 30.7 10/10 Good # 89 LEU PSI 110.1 139.5 # 14.7 # 90 LEU PHI -63.2 -52.5 # 5.4 8/10 New # 90 LEU PSI -45.9 -29.4 # 8.2 # 91 CYSS PHI -72.2 -57.9 # 7.1 10/10 Good # 91 CYSS PSI -46.1 -22.8 # 11.6 # 92 GLY PHI -109.0 -61.7 # 23.6 8/10 New # 92 GLY PSI -40.9 -10.5 # 15.2 # 93 LYS PHI -226.7 -132.2 # 47.2 10/10 New # 93 LYS PSI 97.6 198.0 # 50.2 94 ALA PHI -143.5 -115.4 # 14.0 10/10 Good 94 ALA PSI 130.0 157.0 # 13.5 95 GLU PHI -159.8 -129.4 # 15.2 10/10 Good 95 GLU PSI 137.8 164.0 # 13.1 96 ASP PHI -141.6 -104.6 # 18.5 10/10 Good 96 ASP PSI 130.6 152.3 # 10.9 97 THR PHI -153.7 -126.1 # 13.8 10/10 Good 97 THR PSI 125.5 148.0 # 11.3 98 ILE PHI -122.1 -100.6 # 10.7 10/10 Good 98 ILE PSI 120.4 131.5 # 5.6 # 99 SER PHI -128.4 -107.5 # 10.5 10/10 Good # 99 SER PSI 112.1 132.5 # 10.2 #100 ILE PHI -106.5 -70.8 # 17.8 10/10 Good #100 ILE PSI 126.5 141.5 # 7.5 #101 LEU PHI -143.4 -80.4 # 31.5 8/10 New #101 LEU PSI 117.1 157.6 # 20.3 #102 PRO PHI -110.9 -75.5 # 17.7 8/10 New #102 PRO PSI 124.2 161.2 # 18.5 #103 ASP PHI -66.4 -54.1 # 6.2 5/10 New #103 ASP PSI 132.9 154.6 # 10.8 #104 ASP PHI -149.5 -84.4 # 32.5 6/10 New #104 ASP PSI 94.6 159.8 # 32.6 #105 PRO PHI -97.4 -68.1 # 14.7 7/10 New #105 PRO PSI 114.4 173.5 # 29.6 #106 ARG PHI -67.0 -54.6 # 6.2 8/10 New #106 ARG PSI 132.7 151.1 # 9.2 #107 GLN PHI -135.3 -79.3 # 28.0 8/10 New #107 GLN PSI 103.7 148.8 # 22.6 # #HNHB #HACAHB #stereo 2 CYSZ CHI1 30.0 90.0 #missing HN #? #2=2 from noe OK 4 ASP CHI1 -90.0 -30.0 #QB #QB 5 CYSS CHI1 -90.0 -30.0 #HB3 #HB2 #2=2 OK 6 VAL CHI1 -90.0 -30.0 #HB #? #1=1 from noe 7 GLU CHI1 150.0 210.0 #? #HB2 #2>3 cf noe 8 LYS CHI1 -90.0 -30.0 #HB2? #HB3? #2>3 from noe # 9 GLU CHI1 -90.0 -30.0 #QB #QB? 10 TYR CHI1 -90.0 -30.0 #HB3 #HB2 weak #2=2 cf noe 12 ASN CHI1 -90.0 -30.0 #QB #QB # 13 ARG CHI1 -90.0 -30.0 #HB2 weak #HB3 weak #2>2 # 15 ASN CHI1 -90.0 -30.0 #QB weak #QB weak # 16 THR CHI1 150.0 210.0 #?HB #?HB 17 CYS CHI1 -90.0 -30.0 #HB3 #HB2 #2=2 18 LEU CHI1 -90.0 -30.0 #HB3?? #HB2?? #2=2?? cf noe 18 LEU CHI2 30.0 90.0 # # #from noe 19 GLU CHI1 30.0 90.0 #HB2 weak #??? #2=2? 20 ASN CHI1 -90.0 -30.0 #QB #QB # 22 SER CHI1 150.0 210.0 #? #HB2 weak #2>3 rm 1aug5 23 PHE CHI1 150.0 210.0 #? #HB2 #2>3 24 LEU CHI1 -90.0 -30.0 #missing? #HB2 #2=2 25 LEU CHI1 -90.0 -30.0 #HB3 #HB2 #2=2 26 ASN CHI1 150.0 210.0 #? #HB2 #2>3 cf noe 27 PHE CHI1 150.0 210.0 #? #HB2 #2>3 cf noe 28 THR CHI1 30.0 90.0 #HB!! #overlap HA #g- from noe 30 CYSS CHI1 150.0 210.0 #? #HB2 #2>3 agrees with PfRb1 # 32 VAL CHI1 30.0 90.0 #?HB #?HB 33 CYSZ CHI1 30.0 90.0 #HB2 weak #? #2=2 agrees with PfRb1 34 SER CHI1 150.0 210.0 #HB3 weak? #overlap? #t from noe assume 2=2 35 LYS CHI1 -90.0 -30.0 #HB3 weak? #HB2 #2=2 cf noe 36 ARG CHI1 150.0 210.0 #missing HN? #HB2 #2>3 from noe 37 ASP CHI1 30.0 90.0 #? PROBLEM #HB2 weak #2>3 from noe 38 PHE CHI1 -90.0 -30.0 #HB2 #HB3 #2>3 cf noe 39 MET CHI1 30.0 90.0 #HB2?? #? #2=2 cf noe 40 LEU CHI1 -90.0 -30.0 #HB2 weak #HB3 weak #2>3 cf noe 40 LEU CHI2 -90.0 -30.0 # # #from noe 41 ILE CHI1 -90.0 -30.0 #HB very weak #HB #cf noe 42 THR CHI1 150.0 210.0 #?HB #?HB #cf noe # 43 ASN CHI1 30.0 90.0 #HB2 very weak #?? #from noe # 44 LYS CHI1 150.0 210.0 #HB2 very weak #HB2 #2>3 cf noe 45 SER CHI1 -90.0 -30.0 #HB3 #HB2 #2=2 flip in noe 46 LEU CHI1 150.0 210.0 #HB2 very weak #HB2 #2>3 cf noe # 47 LYS CHI1 -90.0 -30.0 #QB #QB #flex # 48 GLU CHI1 -90.0 -30.0 #HB2 #HB2 #flex # 49 GLU CHI1 -90.0 -30.0 #HB2 #HB3 #flex # 50 ASP CHI1 -90.0 -30.0 #HB2 #HB3 #flex # 52 GLU CHI1 -90.0 -30.0 #HB2 #HB3 #flex 53 GLU CHI1 -90.0 -30.0 #QB #HB3 #2>3 cf noe 54 ILE CHI1 -90.0 -30.0 #?HB #HB #cf noe 55 VAL CHI1 150.0 210.0 #?HB #HB #1>2 from noe 56 THR CHI1 30.0 90.0 #HB #? #cf noe 57 TYR CHI1 30.0 90.0 #HB3 #? #2>3 cf noe 58 ASP CHI1 -90.0 -30.0 #HB3 #HB2 #2=2 cf noe 59 HIS CHI1 -90.0 -30.0 #HB3 #HB2 #2=2 cf noe 60 LEU CHI1 -90.0 -30.0 #HB2 #HB3 #2>3 cf noe 61 CYSS CHI1 150.0 210.0 #? #HB2 #2>3 agrees with PfRb1 62 LYS CHI1 150.0 210.0 #HB2 very weak #HB3 #2=2 cf noe 63 ASN CHI1 150.0 210.0 #? #HB2 #2>3 cf noe 64 CYSS CHI1 30.0 90.0 #HB2 #? #2=2 agrees with PfRb1 65 HIS CHI1 -90.0 -30.0 #HB3 #missing? #2=2 from noe # 66 HIS CHI1 150.0 210.0 #?QB #QB #flex??? 67 VAL CHI1 150.0 210.0 #HB very weak #HB #1>2 from noe 68 ILE CHI1 -90.0 -30.0 #? #HB overlap #assign from noe 70 ARG CHI1 -90.0 -30.0 #HB2 overlap #HB3 overlap #2=2 cf noe 71 HIST CHI1 150.0 210.0 #? #HB3 #2=2 cf noe # 72 GLU CHI1 -90.0 -30.0 #QB #QB #flex 73 TYR CHI1 150.0 210.0 #? #HB3 #2=2 cf noe 74 THR CHI1 30.0 90.0 #HB #? #cf noe 75 PHE CHI1 150.0 210.0 #?HB3 overlap #HB3 overlap #2=2 cf noe 76 SER CHI1 -90.0 -30.0 #HB2 weak #HB3 weak #2>3 cf noe 77 ILE CHI1 -90.0 -30.0 #HB weak #HB weak #from noe 78 MET CHI1 30.0 90.0 #HB2 #? #2=2 cf noe # 79 ASP CHI1 -90.0 -30.0 #QB #QB #assign from noe # 80 GLU CHI1 -90.0 -30.0 #HB2 #HB3 overlap #2>3 cf noe 81 PHE CHI1 -90.0 -30.0 #HB2 #HB3 #2>3 cf noe 82 GLN CHI1 -90.0 -30.0 #HB3 #HB2 #2=2 cf noe 83 GLU CHI1 -90.0 -30.0 #HB2 #HB3 #2>3 cf noe 84 TYR CHI1 -90.0 -30.0 #QB #QB #from noe 85 THR CHI1 30.0 90.0 #HB #? #cf noe 86 MET CHI1 150.0 210.0 #? #HB2 #2>3 from noe 87 LEU CHI1 150.0 210.0 #? #HB2 #2>3 cf noe qd1>2 88 CYSZ CHI1 150.0 210.0 #? #HB2 #2>3 cf noe 89 LEU CHI1 150.0 210.0 #? #QB #QB cf noe qd1>2 89 LEU CHI2 30.0 90.0 # # #from noe 90 LEU CHI1 150.0 210.0 #? #HB2 #2>3 cf noe qd1=1 # 91 CYSS CHI1 -90.0 -30.0 #HB2? #missing!!! #2>3 flip from NOEs 19jul5 ??? 31aug5 # 91 CYSS CHI1 30.0 90.0 #HB2? #? #testing 2=2 93 LYS CHI1 150.0 210.0 #HB2 very weak #HB2 #2>3 cf noe # 95 GLU CHI1 -90.0 90.0 #HB3 #HB3 #flex 96 ASP CHI1 150.0 210.0 #? #HB3 #2=2 cf noe 97 THR CHI1 -90.0 -30.0 #HB weak #HB #cf noe 98 ILE CHI1 -90.0 -30.0 #HB weak #HB #cf noe # 99 SER CHI1 -90.0 -30.0 #QB #QB #QB flex #100 ILE CHI1 -90.0 -30.0 #HB #HB #flex #101 LEU CHI1 -90.0 -30.0 #HB3 #HB2 #flex #103 ASP CHI1 -90.0 -30.0 #HB2 #HB3 #flex #104 ASP CHI1 -90.0 -30.0 #HB2 #HB2 #flex #106 ARG CHI1 -90.0 -30.0 #HB2 #HB3 #flex #107 GLN CHI1 -90.0 -30.0 #HB2 #HB3 #flex #
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