NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
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8526 |
1mdi   |
cing | 1-original | 9 | unknown | chemical shift |
1 MET #N #HN CA 54.9000 HA 4.0000 CB 32.5900 HB# 2.1700 CG 30.7300 HG# 2.6000 ;0.0 2 VAL CA 61.2900 HA 3.7500 CB 32.9300 HB 1.9400 CG1 21.3500 HG1# 0.8900 CG2 20.6300 HG2# 0.7700 ;0.0 3 LYS N 128.18 HN 8.2800 CA 55.9200 HA 4.5300 CB 33.9900 HB1 1.8400 HB2 1.7900 CG 24.7300 HG# 1.3500 CD 29.0000 HD1 1.7800 HD2 1.6500 CE 41.9700 HE# 2.9800 ;0.0 4 GLN N 125.64 HN 8.6900 CA 54.9900 HA 4.7800 CB 29.1700 HB# 2.0100 CG 33.9100 HG1 2.3700 HG2 2.2700 NE2 112.6700 HE21 7.6100 HE22 7.0000 ;0.0 5 ILE N 126.30 HN 8.6600 CA 57.4900 HA 4.3200 CB 36.6800 HB 2.0100 CG1 26.5600 HG11 1.6300 HG12 1.1200 CG2 18.3700 HG2# 0.9200 CD1 9.2900 HD1# 0.6900 ;0.0 6 GLU N 123.14 HN 9.0400 CA 55.4600 HA 4.6500 CB 30.4800 HB1 1.9300 HB2 2.3700 CG 34.9500 HG# 2.3700 ;0.0 7 SER N 110.13 HN 7.3000 CA 56.7400 HA 5.0000 CB 66.9700 HB1 4.0000 HB2 4.3000 ;0.0 8 LYS N 122.5900 HN 9.4100 CA 60.2800 HA 3.9400 CB 32.1600 HB# 1.8500 CG 25.2300 HG1 1.5200 HG2 1.4400 CD 29.4500 HD# 1.7000 CE 41.5200 HE# 2.9700 ;0.0 9 THR N 115.70 HN 8.2700 CA 66.1600 HA 4.0200 CB 68.4800 HB 4.0400 CG2 21.7300 HG2# 1.2400 ;0.0 10 ALA N 123.65 HN 7.8300 CA 54.8000 HA 4.1900 CB 18.9000 HB# 1.5700 ;0.0 11 PHE N 120.16 HN 8.1600 CA 60.4400 HA 4.0900 CB 39.0100 HB1 3.3000 HB2 2.9900 CD1 130.7900 HD1 6.9600 CD2 130.7900 HD2 6.9600 ;0.0 12 GLN N 117.26 HN 8.0200 CA 58.4600 HA 3.5800 CB 28.3900 HB# 2.1500 CG 33.6100 HG# 2.4100 NE2 114.38 HE21 7.64 HE22 6.8900 ;0.0 13 GLU N 116.93 HN 8.2400 CA 59.0000 HA 3.9900 CB 28.5800 HB1 2.0100 HB2 2.0600 CG 35.0300 HG1 2.5900 HG2 2.3600 ;0.0 14 ALA N 121.61 HN 7.8000 CA 54.7500 HA 4.06 CB 18.4000 HB# 1.35 ;0.0 15 LEU N 117.13 HN 7.6800 CA 57.7900 HA 3.7100 CB 41.1500 HB1 0.9600 HB2 1.5900 CG 26.0800 HG 0.9500 CD1 24.4900 HD1# -0.2200 CD2 22.1800 HD2# -0.1000 ;0.0 16 ASP N 119.38 HN 8.2300 CA 56.5300 HA 4.3300 CB 39.7400 HB# 2.7300 ;0.0 17 ALA N 121.3700 HN 8.0600 CA 53.3200 HA 4.2000 CB 18.5200 HB# 1.4400 ;0.0 18 ALA N 118.6900 HN 7.1200 CA 53.5300 HA 3.9300 CB 20.6000 HB# 1.3600 ;0.0 19 GLY N 106.00 HN 7.6200 CA 47.2600 HA1 3.9100 HA2 3.7700 ;0.0 20 ASP N 128.54 HN 9.1400 CA 53.8800 HA 4.6900 CB 40.5000 HB# 2.7900 ;0.0 21 LYS N 119.2600 HN 7.7900 CA 57.3100 HA 4.3000 CB 33.5400 HB# 1.9200 CG 26.1200 HG# 1.5600 CD 29.6000 HD# 1.6600 CE 42.2100 HE# 3.0500 ;0.0 22 LEU N 122.80 HN 8.90 CA 55.7700 HA 4.4200 CB 42.9300 HB1 1.9600 HB2 1.4100 CG 26.8200 HG 1.5700 CD1 27.4700 HD1# 0.8600 CD2 23.9800 HD2# 1.0500 ;0.0 23 VAL N 125.80 HN 9.0400 CA 60.0800 HA 4.8800 CB 34.5000 HB 1.9300 CG1 21.3900 HG1# 0.6200 CG2 21.6700 HG2# 0.8500 ;0.0 24 VAL N 126.44 HN 9.1700 CA 60.0100 HA 4.5000 CB 33.6500 HB 1.5100 CG1 21.4600 HG1# 0.4600 CG2 21.2900 HG2# 0.5500 ;0.0 25 VAL N 126.31 HN 9.1200 CA 60.1000 HA 4.7500 CB 34.3800 HB 1.9300 CG1 22.0700 HG1# 0.0300 CG2 21.3500 HG2# 0.8800 ;0.0 26 ASP N 122.73 HN 8.2200 CA 50.7400 HA 4.3600 CB 38.1300 HB1 2.2700 HB2 1.3200 ;0.0 27 PHE N 125.12 HN 8.9700 CA 57.4000 HA 4.8400 CB 38.6600 HB1 2.3100 HB2 2.9000 CD1 131.5600 HD1 6.7700 CD1 131.5600 HD1 6.7700 CE1 130.4400 HE1 6.7700 CE2 130.4400 HE2 6.7700 ;0.0 28 SER N 118.04 HN 8.6400 CA 56.2600 HA 4.0900 CB 65.3200 HB1 3.16 HB2 3.38 ;0.0 29 ALA N 118.9800 HN 6.20 CA 50.7800 HA 4.7000 CB 22.2200 HB# 0.2400 ;0.0 30 THR N 115.42 HN 9.4800 CA 64.5700 HA 3.7600 CB 69.3100 HB 4.2300 CG2 21.9600 HG2# 1.3100 ;0.0 31 TRP N 114.13 HN 6.5600 CA 53.6600 HA 4.5800 CB 29.5800 HB1 3.0800 HB2 3.6800 CD1 128.3700 HD1 7.3100 NE1 135.82 HE1 11.46 CE3 121.4200 HE3 7.3800 CZ2 114.9100 HZ2 7.4300 CZ3 121.7600 HZ3 7.0300 CH2 124.6900 HH2 7.2600 ;0.0 32 CYS N 119.4900 HN 6.37 CA 53.3800 HA 4.9300 CB 34.9200 HB1 1.7100 HB2 2.0300 ;0.0 33 GLY N 119.42 HN 9.6900 CA 49.1200 HA1 4.2000 HA2 3.8400 ;0.0 34 PRO CA 65.4100 HA 4.3000 CB 32.8600 HB1 2.4400 HB2 1.7700 CG 27.8100 HG1 2.3500 HG2 2.0600 CD 50.8600 HD1 3.8300 HD2 3.6700 ;0.0 35 ALA N 117.17 HN 6.9200 CA 54.7400 HA 3.9400 CB 17.8000 HB# 1.3900 ;0.0 36 LYS N 120.71 HN 8.30 CA 59.9400 HA 3.9000 CB 32.2100 HB# 1.9100 CG 25.2100 HG1 1.5000 HG2 1.4200 CD 29.3700 HD# 1.6500 CE 41.4100 HE# 2.9500 ;0.0 37 MET N 115.4700 HN 8.6400 CA 57.7500 HA 4.2600 CB 26.2700 HB# 2.3300 CG 30.6900 HG1 3.1700 HG2 2.9400 CE 39.4200 HE# 2.70 ;0.0 38 ILE N 116.12 HN 7.5400 CA 61.2200 HA 4.7100 CB 40.3200 HB 1.9700 CG1 31.1000 HG1# 1.9200 CG2 16.7200 HG2# 1.2900 CD1 14.1300 HD1# 0.9500 ;0.0 39 LYS N 125.11 HN 7.4100 CA 61.9500 HA 4.2600 CB 30.0700 HB# 2.0000 CG 25.1900 HG1 1.5900 HG2 1.2700 CD 29.3900 HD# 1.6600 CE 41.7000 HE# 2.8600 ;0.0 40 PRO CA 66.1200 HA 4.3900 CB 30.8300 HB1 2.3900 HB2 1.9900 CG 28.5700 HG1 2.1600 HG2 2.0500 CD 50.2700 HD1 3.8500 HD2 3.7800 ;0.0 41 PHE N 119.83 HN 7.60 CA 60.9900 HA 4.4700 CB 39.2300 HB1 3.5100 HB2 3.2100 CD1 131.2300 HD1 7.2700 CD2 131.2300 HD2 7.2700 CE1 132.2000 HE1 7.4800 CE2 132.2000 HE2 7.4800 ;0.0 42 PHE N 121.70 HN 8.7600 CA 62.6800 HA 3.9700 CB 39.6600 HB1 3.5800 HB2 3.1600 CD1 132.5200 HD1 7.3900 CD2 132.5200 HD2 7.3900 CE1 132.0200 HE1 7.7100 CE2 132.0200 HE2 7.7100 ;0.0 43 HIS N 114.21 HN 8.4800 CA 59.1400 HA 3.8100 CB 27.8400 HB# 3.3700 CE1 136.5800 HE1 8.3800 CD2 119.1900 HD2 7.3400 ;0.0 44 SER N 119.43 HN 8.5500 CA 62.0300 HA 4.1500 CB 62.8100 HB# 3.9100 ;0.0 45 LEU N 122.83 HN 7.9300 CA 57.3300 HA 3.8100 CB 41.3300 HB1 1.1000 HB2 1.4800 CG 25.4600 HG 1.1200 CD1 27.0600 HD1# 0.7200 CD2 22.6600 HD2# 0.6800 ;0.0 46 SER N 114.53 HN 6.7600 CA 60.2000 HA 3.2100 CB 62.5600 HB# 2.8400 ;0.0 47 GLU N 118.50 HN 6.8200 CA 56.9600 HA 4.0600 CB 29.1400 HB1 2.0400 HB2 1.9600 CG 35.1600 HG1 2.2300 HG2 2.1500 ;0.0 48 LYS N 119.2900 HN 7.1500 CA 57.9000 HA 4.0200 CB 34.2500 HB1 1.4900 HB2 1.6100 CG 24.8100 HG1 1.1100 HG2 0.5500 CD 29.6300 HD1 1.5000 HD2 1.4200 CE 41.7400 HE# 2.7600 ;0.0 49 TYR N 118.5900 HN 7.9800 CA 56.6900 HA 4.8100 CB 37.3900 HB# 3.0300 CD1 133.3400 HD1 7.3400 CE1 117.6900 HE1 6.8800 CD2 133.3400 HD2 7.3400 CE2 117.6900 HE2 6.8800 ;0.0 50 SER N 115.25 HN 7.8900 CA 60.3600 HA 4.4300 CB 63.2000 HB1 3.8900 HB2 4.0200 ;0.0 51 ASN N 118.45 HN 9.1400 CA 52.9400 HA 4.8100 CB 37.7000 HB1 2.9700 HB2 2.9200 ND2 112.47 HD21 7.6400 HD22 6.8500 ;0.0 52 VAL N 120.95 HN 7.5000 CA 60.8200 HA 4.4600 CB 34.8900 HB 2.1100 CG1 22.6000 HG1# 0.2300 CG2 23.3900 HG2# 0.88 ;0.0 53 ILE N 127.83 HN 8.8900 CA 59.9800 HA 4.3600 CB 38.5800 HB 1.8800 CG1 27.8800 HG11 1.4300 HG12 1.2900 CG2 17.3800 HG2# 0.8900 CD1 12.9100 HD1# 0.8600 ;0.0 54 PHE N 126.01 HN 8.6800 CA 56.7100 HA 5.2200 CB 40.4700 HB1 2.3900 HB2 2.8100 CD1 132.4400 HD1 6.59 CD2 132.4400 HD2 6.59 CE1 130.8900 HE1 7.08 CE2 130.8900 HE2 7.08 CZ 128.4400 HZ 6.7200 ;0.0 55 LEU N 122.24 HN 9.4200 CA 52.6500 HA 5.3700 CB 45.7200 HB1 1.2600 HB2 1.6500 CG 26.6100 HG 1.5000 CD1 23.7000 HD1# 0.8500 CD2 25.5800 HD2# 0.5700 ;0.0 56 GLU N 120.01 HN 8.5300 CA 54.5300 HA 4.9300 CB 33.6300 HB# 1.8500 CG 37.1700 HG1 2.1600 HG2 2.0500 ;0.0 57 VAL N 123.6800 HN 8.4300 CA 60.4000 HA 4.0300 CB 35.5300 HB 1.1000 CG1 21.2900 HG1# 0.6200 CG2 20.0300 HG2# 0.1400 ;0.0 58 ASP N 129.100 HN 9.1900 CA 52.7500 HA 4.8700 CB 41.7600 HB1 2.8400 HB2 2.3500 ;0.0 59 VAL N 118.6300 HN 8.5400 CA 64.5300 HA 3.5400 CB 30.2500 HB 1.7600 CG1 22.4000 HG1# 0.6000 CG2 17.9300 HG2# 0.3600 ;0.0 60 ASP N 117.81 HN 8.1100 CA 56.2700 HA 4.8600 CB 41.2500 HB# 2.8200 ;0.0 61 ASP N 120.09 HN 8.2900 CA 55.0000 HA 4.7100 CB 40.8500 HB1 2.9300 HB2 2.7200 ;0.0 62 ALA N 125.15 HN 8.0900 CA 50.1400 HA 4.9300 CB 17.5700 HB# 1.1800 ;0.0 63 GLN N 121.0500 HN 8.0000 CA 59.3300 HA 4.0800 CB 28.8100 HB# 2.1500 CG 33.9800 HG1 2.5600 HG2 2.4200 NE2 111.5400 HE21 7.6800 HE22 6.8700 ;0.0 64 ASP N 117.65 HN 8.9600 CA 56.3400 HA 4.3300 CB 38.9200 HB1 2.8200 HB2 2.6200 ;0.0 65 VAL N 122.3300 HN 7.5100 CA 65.3900 HA 3.4500 CB 31.1200 HB 1.9600 CG1 21.7800 HG1# 0.4000 CG2 22.5200 HG2# 0.6300 ;0.0 66 ALA N 120.3800 HN 7.7200 CA 55.5400 HA 3.7300 CB 18.4900 HB# 1.3600 ;0.0 67 SER N 111.53 HN 8.4200 CA 61.2500 HA 4.2600 CB 62.7100 HB# 3.9200 ;0.0 68 GLU N 123.35 HN 7.8100 CA 58.7500 HA 4.1200 CB 27.8900 HB# 2.1800 CG 33.8400 HG# 2.5500 ;0.0 69 ALA N 119.84 HN 7.60 CA 52.2400 HA 4.4500 CB 20.2000 HB# 1.2000 ;0.0 70 GLU N 114.1700 HN 7.7200 CA 56.3200 HA 3.8100 CB 25.9300 HB1 2.1100 HB2 2.0700 CG 34.6100 HG# 2.2800 ;0.0 71 VAL N 118.2200 HN 7.39 CA 63.7400 HA 3.5800 CB 31.9900 HB 1.4400 CG1 21.8600 HG1# 0.5600 CG2 21.6500 HG2# -0.1400 ;0.0 72 LYS N 123.66 HN 8.80 CA 55.5900 HA 4.7200 CB 34.8500 HB1 2.0100 HB2 1.6600 CG 24.4700 HG1 1.6400 HG2 1.3600 CD 28.7300 HD1 1.6300 HD2 1.6300 CE 41.8900 HE1 2.9200 HE2 2.9200 ;0.0 73 ALA N 121.81 HN 7.6400 CA 50.5500 HA 5.5300 CB 23.4100 HB# 1.2700 ;0.0 74 THR N 112.3400 HN 9.1900 CA 57.1500 HA 4.8600 CB 71.3800 HB 3.5600 CG2 20.6400 HG2# 0.5800 ;0.0 75 PRO CA 62.7300 HA 5.1400 CB 33.1700 HB1 2.0000 HB2 1.4500 CG 24.6200 HG1 1.8700 HG2 1.6700 CD 49.5200 HD1 4.0200 HD2 3.2100 ;0.0 76 THR N 118.1900 HN 8.0900 CA 62.9900 HA 4.5300 CB 72.6200 HB 3.8100 CG2 21.4000 HG2# 1.1300 ;0.0 77 PHE N 125.42 HN 8.9200 CA 55.4500 HA 5.6600 CB 40.7900 HB1 2.2200 HB2 1.9500 CD1 132.8000 HD1 6.5300 CD2 132.8000 HD2 6.5300 CE1 130.0400 HE1 7.0200 CE2 130.0400 HE2 7.0200 CZ 128.3000 HZ 6.9100 ;0.0 78 GLN N 118.70 HN 8.6300 CA 54.4900 HA 5.0300 CB 33.3100 HB1 1.9700 HB2 2.1700 CG 34.6000 HG# 2.3600 NE2 105.89 HE21 6.6800 HE22 6.5700 ;0.0 79 PHE N 119.31 HN 8.0700 CA 55.9100 HA 5.5200 CB 41.5200 HB1 2.5900 HB2 2.4700 CD1 132.2300 HD1 6.9500 CE1 131.7200 HE1 7.1400 CD2 132.2300 HD2 6.9500 CE2 131.7200 HE2 7.1400 CZ 128.5200 HZ 7.2200 ;0.0 80 PHE N 121.94 HN 10.0100 CA 56.4500 HA 5.6100 CB 44.4200 HB1 2.5900 HB2 2.6900 CD1 131.5600 HD1 6.7400 CE1 131.5400 HE1 7.3700 CD2 131.5600 HD2 6.7400 CE2 131.5400 HE2 7.3700 CZ 130.3200 HZ 7.7900 ;0.0 81 LYS N 118.12 HN 8.8900 CA 56.6500 HA 4.5600 CB 36.3200 HB# 1.6800 CG 26.0100 HG# 1.4300 CD 29.1500 HD# 1.7800 CE 41.7500 HE# 2.9900 ;0.0 82 LYS N 128.53 HN 10.2100 CA 56.8900 HA 3.9800 CB 30.0800 HB1 2.0900 HB2 1.7900 CG 25.8500 HG1 1.4700 HG2 1.4100 CD 29.3100 HD1 1.7500 HD2 1.6500 CE 41.7500 HE# 2.9900 ;0.0 83 GLY N 104.1800 HN 9.3600 CA 45.8100 HA1 4.1800 HA2 3.3300 ;0.0 84 GLN N 118.68 HN 7.8000 CA 53.4600 HA 4.7300 CB 31.0700 HB1 2.1200 HB2 1.9700 CG 33.3900 HG# 2.3800 NE2 112.5900 HE21 7.5500 HE22 6.90 ;0.0 85 LYS N 125.8900 HN 9.0100 CA 57.2000 HA 3.9700 CB 31.5100 HB1 1.7700 HB2 1.4000 CG 25.2300 HG1 1.5300 HG2 1.1300 CD 29.3100 HD1 1.7200 HD2 1.6000 CE 41.5900 HE# 2.9300 ;0.0 86 VAL N 121.33 HN 9.2100 CA 60.7400 HA 4.5800 CB 32.6500 HB 2.4200 CG1 21.7400 HG1# 0.9800 CG2 19.2800 HG2# 0.6600 ;0.0 87 GLY N 107.8300 HN 7.50 CA 46.1100 HA1 4.2900 HA2 3.7000 ;0.0 88 GLU N 117.8500 HN 8.6500 CA 56.2200 HA 5.7400 CB 32.5300 HB1 2.3600 HB2 2.1700 CG 35.4100 HG# 2.1600 ;0.0 89 PHE N 117.45 HN 8.9200 CA 58.3000 HA 5.0600 CB 40.8000 HB1 3.5500 HB2 3.4100 CD1 133.1600 HD1 7.3600 CE1 130.7700 HE1 7.4100 CD2 133.1600 HD2 7.3600 CE2 130.7700 HE2 7.4100 CZ 129.3500 HZ 6.8000 ;0.0 90 SER N 115.17 HN 9.1600 CA 57.2300 HA 5.3700 CB 66.7200 HB1 3.8100 HB2 3.7100 ;0.0 91 GLY N 108.4400 HN 8.3400 CA 43.7500 HA1 4.7000 HA2 3.6200 ;0.0 92 ALA N 123.87 HN 8.08 CA 50.9900 HA 4.3900 CB 18.1500 HB# 1.3500 ;0.0 93 ASN N 122.85 HN 7.6700 CA 52.0100 HA 4.8800 CB 39.3600 HB1 2.9000 HB2 2.6000 ND2 113.11 HD21 7.47 HD22 7.17 ;0.0 94 LYS N 124.60 HN 8.6400 CA 60.8000 HA 3.6400 CB 32.3900 HB1 1.3800 HB2 1.0700 CG 25.3600 HG1 1.2600 HG2 0.6600 CD 29.0900 HD1 1.1000 HD2 0.9300 CE 41.1300 HE# 2.5700 ;0.0 95 GLU N 119.01 HN 8.4500 CA 59.8300 HA 4.1000 CB 28.2100 HB1 2.1100 HB2 1.9800 CG 36.2000 HG1 2.4200 HG2 2.3100 ;0.0 96 LYS N 121.08 HN 7.8400 CA 58.4300 HA 3.8300 CB 32.4300 HB1 0.9400 HB2 1.3100 CG 24.4800 HG1 0.8000 HG2 0.2500 CD 29.2100 HD1 1.1100 HD2 0.8700 CE 41.6500 HE1 2.5800 HE2 2.4700 ;0.0 97 LEU N 122.95 HN 8.0600 CA 59.2800 HA 4.2100 CB 41.6000 HB1 1.4800 HB2 2.3400 CG 26.8600 HG 1.5600 CD1 26.6500 HD1# 0.8800 CD2 22.7300 HD2# 0.7200 ;0.0 98 GLU N 117.12 HN 7.8700 CA 60.6000 HA 3.8800 CB 29.5000 HB# 2.2400 CG 36.8800 HG1 2.5500 HG2 2.3900 ;0.0 99 ALA N 120.0700 HN 8.4400 CA 55.2100 HA 4.1000 CB 18.3900 HB# 1.3800 ;0.0 100 THR N 115.00 HN 8.0800 CA 67.1800 HA 3.6500 CB 68.6900 HB 3.9400 CG2 20.3000 HG2# 0.2400 ;0.0 101 ILE N 120.12 HN 7.5100 CA 66.7800 HA 3.2300 CB 38.1100 HB 1.6800 CG1 30.6700 HG11 0.7800 HG12 0.7400 CG2 16.1400 HG2# 0.1900 CD1 15.4300 HD1# 0.8300 ;0.0 102 ASN N 113.2400 HN 7.6100 CA 56.6600 HA 4.300 CB 39.0900 HB# 2.7400 ND2 113.2200 HD21 7.3800 HD22 7.3300 ;0.0 103 GLU N 117.27 HN 7.7200 CA 57.7300 HA 4.1600 CB 29.0500 HB1 2.0600 HB2 2.1600 CG 33.8400 HG1 2.5300 HG2 2.4300 ;0.0 104 LEU N 117.6800 HN 7.4200 CA 55.1800 HA 4.4200 CB 45.1600 HB1 1.4300 HB2 1.5900 CG 26.4200 HG 1.6300 CD1 26.4300 HD1# 0.3300 CD2 22.0000 HD2# 0.7300 ;0.0 105 VAL N 122.87 HN 7.5600 CA 65.1600 HA 3.8300 CB 31.7400 HB 2.1400 CG1 21.5700 HG1# 1.0300 CG2 21.5700 HG2# 1.0300 ;0.0 106 PHE HA 4.1500 HB1 3.0300 HB2 2.9700 HD1 7.0600 HE1 7.2200 HD2 7.0600 HE2 7.2200 HZ 7.2600 ;0.0 107 ARG HN 8.2200 HA 4.2400 HB# 1.5600 HG1 1.4300 HG2 1.3600 HD# 3.0300 HE 7.1000 ;0.0 108 PHE HN 8.2000 HA 4.3200 HB1 2.7800 HB2 2.8500 HD1 6.8700 HD2 6.8700 HE1 7.1200 HE2 7.1200 ;0.0 109 ARG HN 8.0500 HA 4.1500 HB1 1.3500 HB2 1.5100 HG1 1.4500 HG2 1.2800 HD# 2.9600 HE 7.0100 ;0.0 110 TYR HN 8.2400 HA 4.5700 HB1 2.7500 HB2 2.7200 HD1 6.9100 HD2 6.9100 HE1 6.7400 HE2 6.7400 ;0.0 111 VAL HN 8.0700 HA 4.2300 HB 2.1000 HG1# 0.9900 HG2# 1.0900 ;0.0 112 CYS HN 9.1400 HA 5.3200 HB1 3.28 HB2 3.14 ;0.0 113 GLU HN 8.9900 HA 4.5800 HB1 1.8100 HB2 2.0500 HG# 2.3200 ;0.0 114 GLY HN 8.4000 HA1 4.2100 HA2 4.1000 ;0.0 115 PRO HA 4.4500 HB1 2.3500 HB2 1.9600 HG# 2.0900 HD1 3.7400 HD2 3.6300 ;0.0 116 SER HN 8.5000 HA 4.4800 HB# 3.8800 ;0.0 117 HIS HN 8.3800 HA 4.7600 HB1 3.2400 HB2 3.3200 HD1 7.3400 HE1 8.6000 ;0.0 118 GLY HN 8.3000 HA1 3.8300 HA2 3.7400 ;0.0
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