#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1maj s VAL 2 N 0.00 0.32 0.52 5.18 1.01 -1.26 -5.05 120.40 121.11 1maj s VAL 2 Ca 0.00 -0.46 -0.13 0.00 0.00 0.00 0.00 61.98 61.39 1maj s VAL 2 Cb 0.00 -0.33 -0.06 0.00 0.00 0.00 0.00 36.38 35.99 1maj s VAL 2 CO 0.00 -0.10 0.94 -0.69 0.00 0.00 0.00 175.10 175.25 1maj s VAL 3 N -0.55 4.65 -0.23 2.92 1.01 -1.26 -4.71 120.40 122.22 1maj s VAL 3 Ca -0.03 0.95 -0.03 0.00 0.00 0.00 0.00 61.98 62.87 1maj s VAL 3 Cb -0.04 -3.77 0.08 0.00 0.00 0.00 0.00 36.38 32.64 1maj s VAL 3 CO -0.00 -0.78 0.08 -0.04 0.00 0.00 0.00 175.10 174.36 1maj s MET 4 N -4.35 0.44 -0.83 2.72 -1.94 -1.26 -3.42 119.30 110.67 1maj s MET 4 Ca 0.56 -0.50 -0.25 0.00 -1.71 0.00 0.00 55.69 53.79 1maj s MET 4 Cb -0.10 -1.82 0.05 0.00 2.01 0.00 0.00 34.83 34.97 1maj s MET 4 CO 0.38 -0.80 1.28 0.99 -0.01 0.00 0.00 175.02 176.86 1maj s THR 5 N 1.92 3.92 0.11 2.05 2.01 0.11 -4.71 115.64 121.05 1maj s THR 5 Ca 0.04 -0.16 -0.30 0.00 0.31 0.00 0.00 61.69 61.58 1maj s THR 5 Cb -0.17 -4.92 -0.06 0.00 0.01 0.00 0.00 72.50 67.36 1maj s THR 5 CO -0.18 -1.81 1.00 -1.10 -0.69 0.00 0.00 174.62 171.84 1maj s GLN 6 N 5.12 4.65 0.08 4.92 -0.21 -1.26 -2.51 119.66 130.45 1maj s GLN 6 Ca 0.37 1.51 -0.26 0.00 0.02 0.00 0.00 55.36 57.00 1maj s GLN 6 Cb -0.07 -3.37 0.08 0.00 1.00 0.00 0.00 33.01 30.66 1maj s GLN 6 CO 0.05 0.14 0.69 0.95 -2.12 0.00 0.00 175.29 175.00 1maj s THR 7 N 0.12 0.00 1.06 -0.19 -4.23 -0.50 -4.69 115.64 107.21 1maj s THR 7 Ca 0.48 0.00 -0.17 0.00 -1.18 0.00 0.00 61.69 60.82 1maj s THR 7 Cb -0.24 -1.00 0.23 0.00 1.34 0.00 0.00 72.50 72.83 1maj s THR 7 CO 0.30 0.00 1.24 -2.16 -0.54 0.00 0.00 174.62 173.46 1maj s PRO 8 N -3.16 -0.10 0.26 3.99 0.04 -1.26 0.16 135.00 134.92 1maj s PRO 8 Ca 0.00 -0.28 0.13 0.00 0.04 0.00 0.00 61.00 60.89 1maj s PRO 8 Cb -0.01 -1.75 0.15 0.00 0.04 0.00 0.00 34.50 32.94 1maj s PRO 8 CO -0.08 -2.93 1.48 -0.07 0.04 0.00 0.00 177.00 175.43 1maj h LEU 9 N -2.02 0.00 -7.81 -3.56 3.38 -1.89 -3.40 115.31 100.01 1maj h LEU 9 Ca -0.44 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.37 1maj h LEU 9 Cb 1.26 0.00 -0.21 0.00 0.09 0.00 0.00 40.66 41.80 1maj h LEU 9 CO 0.36 0.62 -0.56 -0.44 0.09 0.00 0.00 178.44 178.51 1maj s SER 10 N -6.56 0.08 -0.36 -0.43 0.01 -1.26 -0.82 113.70 104.37 1maj s SER 10 Ca 0.02 -0.27 0.01 0.00 1.31 0.00 0.00 55.95 57.01 1maj s SER 10 Cb 0.09 0.17 0.14 0.00 0.21 0.00 0.00 66.02 66.64 1maj s SER 10 CO 0.75 -0.33 0.24 -0.22 0.41 0.00 0.00 173.24 174.09 1maj s LEU 11 N -1.33 0.92 -0.14 2.44 2.96 0.00 -4.90 118.68 118.63 1maj s LEU 11 Ca -0.14 -2.23 -0.29 0.00 -0.22 0.00 0.00 54.13 51.25 1maj s LEU 11 Cb -0.08 -0.31 -0.04 0.00 0.50 0.00 0.00 46.19 46.26 1maj s LEU 11 CO 0.01 -0.29 1.58 -2.16 -1.32 0.00 0.00 176.35 174.17 1maj s PRO 12 N 1.00 4.02 0.00 0.98 0.04 -1.25 -3.58 135.00 136.21 1maj s PRO 12 Ca 0.20 1.89 0.00 0.00 0.04 0.00 0.00 61.00 63.12 1maj s PRO 12 Cb -0.19 -3.98 0.00 0.00 0.04 0.00 0.00 34.50 30.37 1maj s PRO 12 CO -0.01 -1.02 0.00 1.33 0.04 0.00 0.00 177.00 177.33 1maj n VAL 13 N 5.87 0.00 -4.47 -0.36 0.24 -1.18 -4.83 118.33 113.60 1maj n VAL 13 Ca 0.17 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.21 1maj n VAL 13 Cb 0.44 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.71 1maj n VAL 13 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1maj s SER 14 N 0.25 4.03 -0.99 -1.34 0.15 -1.26 0.31 113.70 114.85 1maj s SER 14 Ca 0.00 -1.26 -0.21 0.00 0.70 0.00 0.00 55.95 55.18 1maj s SER 14 Cb 0.00 -0.42 0.09 0.00 -1.71 0.00 0.00 66.02 63.97 1maj s SER 14 CO 0.00 -0.45 1.31 -0.76 1.20 0.00 0.00 173.24 174.54 1maj s LEU 15 N -3.75 4.22 0.00 3.45 1.43 -1.26 -3.36 118.68 119.41 1maj s LEU 15 Ca 0.36 -1.75 0.00 0.00 -1.03 0.00 0.00 54.13 51.71 1maj s LEU 15 Cb 0.07 -2.49 0.00 0.00 0.03 0.00 0.00 46.19 43.80 1maj s LEU 15 CO 0.19 -1.29 0.00 0.61 0.23 0.00 0.00 176.35 176.09 1maj n GLY 16 N 6.20 1.14 0.00 -3.19 0.00 0.21 -4.87 105.19 104.68 1maj n GLY 16 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 1maj n GLY 16 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1maj n ASP 17 N 0.00 -0.18 -3.95 1.61 8.00 -1.21 -3.78 116.55 117.03 1maj n ASP 17 Ca 0.00 -0.04 -0.18 0.00 0.71 0.00 0.00 54.79 55.28 1maj n ASP 17 Cb 0.00 0.00 -0.15 0.00 -0.02 0.00 0.00 41.12 40.95 1maj n ASP 17 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1maj s GLN 18 N -0.39 0.62 0.56 -1.24 0.00 -1.26 0.88 119.66 118.84 1maj s GLN 18 Ca 0.00 -0.18 0.08 0.00 -0.00 0.00 0.00 55.36 55.26 1maj s GLN 18 Cb 0.00 -0.62 0.07 0.00 0.00 0.00 0.00 33.01 32.46 1maj s GLN 18 CO 0.00 0.06 0.66 0.00 0.00 0.00 0.00 175.29 176.01 1maj s ALA 19 N 0.23 4.61 -0.48 2.60 0.00 -0.43 -4.88 121.76 123.41 1maj s ALA 19 Ca -0.03 -1.85 0.06 0.00 0.00 0.00 0.00 51.96 50.14 1maj s ALA 19 Cb -0.07 -1.22 0.22 0.00 0.00 0.00 0.00 23.12 22.05 1maj s ALA 19 CO -0.00 -0.71 0.76 0.43 0.00 0.00 0.00 175.76 176.23 1maj n SER 20 N -2.07 -2.48 -4.71 0.00 7.64 -1.25 -1.21 113.62 109.53 1maj n SER 20 Ca 0.10 -3.05 -0.42 0.00 1.01 0.00 0.00 58.87 56.51 1maj n SER 20 Cb 0.62 1.32 -0.03 0.00 -1.01 0.00 0.00 64.21 65.11 1maj n SER 20 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1maj s ILE 21 N 0.45 2.49 0.28 0.44 1.09 -1.07 -4.64 121.20 120.24 1maj s ILE 21 Ca 0.32 0.26 -0.04 0.00 -1.10 0.00 0.00 60.65 60.09 1maj s ILE 21 Cb 0.14 -3.17 -0.05 0.00 -1.06 0.00 0.00 42.46 38.33 1maj s ILE 21 CO -0.17 0.01 0.53 -0.55 -0.10 0.00 0.00 174.94 174.66 1maj s SER 22 N 1.60 6.41 -0.30 3.58 0.15 0.42 -0.17 113.70 125.39 1maj s SER 22 Ca 0.74 0.63 -0.02 0.00 0.70 0.00 0.00 55.95 58.00 1maj s SER 22 Cb -0.45 -2.11 0.19 0.00 -1.71 0.00 0.00 66.02 61.94 1maj s SER 22 CO 0.32 -0.18 0.63 0.00 1.20 0.00 0.00 173.24 175.21 1maj s ARG 24 N 2.86 2.55 0.12 0.00 0.52 -1.04 -1.05 118.95 122.90 1maj s ARG 24 Ca 0.19 -0.85 0.03 0.00 -0.52 0.00 0.00 55.73 54.58 1maj s ARG 24 Cb -0.15 -2.53 -0.04 0.00 0.52 0.00 0.00 34.95 32.75 1maj s ARG 24 CO -0.21 0.53 0.14 0.45 0.02 0.00 0.00 175.30 176.24 1maj s SER 25 N -2.36 5.73 0.34 0.23 0.15 -0.16 -0.71 113.70 116.92 1maj s SER 25 Ca 0.26 0.01 0.18 0.00 0.70 0.00 0.00 55.95 57.10 1maj s SER 25 Cb -0.12 -1.58 0.17 0.00 -1.71 0.00 0.00 66.02 62.79 1maj s SER 25 CO 0.18 0.12 1.50 0.28 1.20 0.00 0.00 173.24 176.52 1maj h SER 26 N 2.81 0.00 -0.21 5.45 0.02 -1.88 -3.35 113.55 116.39 1maj h SER 26 Ca -0.47 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.27 1maj h SER 26 Cb 1.18 0.00 -0.39 0.00 0.14 0.00 0.00 62.40 63.33 1maj h SER 26 CO 0.67 0.29 -1.07 1.67 -1.14 0.00 0.00 176.83 177.24 1maj n GLN 27 N -3.16 0.85 -0.50 3.45 7.27 -1.26 -5.06 117.38 118.97 1maj n GLN 27 Ca 0.03 -2.74 0.07 0.00 0.07 0.00 0.00 57.00 54.43 1maj n GLN 27 Cb 0.65 -0.79 -0.02 0.00 2.41 0.00 0.00 30.24 32.50 1maj n GLN 27 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 1maj n SER 28 N -0.04 -6.52 -0.19 1.69 2.88 -1.26 -4.73 113.62 105.46 1maj n SER 28 Ca 0.07 0.54 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 1maj n SER 28 Cb 0.98 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 62.90 1maj n SER 28 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1maj n LEU 29 N 0.00 0.01 -4.74 2.46 4.77 -1.25 -4.93 117.00 113.33 1maj n LEU 29 Ca 0.00 -0.40 -0.41 0.00 -0.03 0.00 0.00 56.01 55.18 1maj n LEU 29 Cb 0.23 -0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 1maj n LEU 29 CO 0.00 0.10 0.82 -0.69 -1.33 0.00 0.00 177.39 176.29 1maj s VAL 30 N -0.01 3.82 0.66 4.08 1.01 -1.26 -4.22 120.40 124.48 1maj s VAL 30 Ca 0.00 1.55 -0.11 0.00 0.00 0.00 0.00 61.98 63.42 1maj s VAL 30 Cb 0.00 -3.99 0.15 0.00 0.00 0.00 0.00 36.38 32.54 1maj s VAL 30 CO 0.00 0.25 0.89 1.57 0.00 0.00 0.00 175.10 177.81 1maj n HIS 31 N 2.49 -3.99 -0.34 5.22 -0.00 -0.67 -4.93 115.22 113.00 1maj n HIS 31 Ca 0.03 -0.78 0.07 0.00 0.46 0.00 0.00 57.72 57.50 1maj n HIS 31 Cb 0.46 -0.69 0.26 0.00 -0.12 0.00 0.00 29.99 29.90 1maj n HIS 31 CO 0.00 0.00 0.00 0.66 0.46 0.00 0.00 176.34 177.46 1maj h SER 32 N -1.20 0.90 -4.03 0.26 4.64 -1.96 -3.43 113.55 108.72 1maj h SER 32 Ca -0.29 0.04 -0.03 0.00 -0.47 0.00 0.00 61.79 61.04 1maj h SER 32 Cb 0.79 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.74 1maj h SER 32 CO 0.20 0.49 -0.01 -0.46 -0.87 0.00 0.00 176.83 176.18 1maj n ASN 33 N -4.59 0.38 -3.91 4.97 0.23 -1.26 -4.97 115.26 106.11 1maj n ASN 33 Ca 0.18 -1.10 -0.41 0.00 -0.53 0.00 0.00 54.58 52.72 1maj n ASN 33 Cb 0.35 -0.02 -0.03 0.00 -2.08 0.00 0.00 39.78 38.00 1maj n ASN 33 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1maj n GLY 34 N 4.57 3.09 2.78 4.83 0.00 -1.26 -4.83 105.19 114.36 1maj n GLY 34 Ca 0.01 -1.35 -0.17 0.00 0.00 0.00 0.00 46.02 44.50 1maj n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1maj s ASN 35 N 4.39 0.65 -0.37 1.61 0.01 -1.26 -5.05 114.94 114.92 1maj s ASN 35 Ca 0.54 0.18 0.01 0.00 -0.71 0.00 0.00 52.86 52.89 1maj s ASN 35 Cb 0.11 0.05 0.10 0.00 0.41 0.00 0.00 41.25 41.92 1maj s ASN 35 CO 0.04 -0.21 0.11 -0.89 -1.51 0.00 0.00 177.10 174.64 1maj s THR 36 N 1.87 2.72 0.28 1.60 2.01 -1.26 -1.66 115.64 121.20 1maj s THR 36 Ca -0.00 -2.20 -0.12 0.00 0.31 0.00 0.00 61.69 59.67 1maj s THR 36 Cb -0.12 -2.93 -0.08 0.00 0.01 0.00 0.00 72.50 69.38 1maj s THR 36 CO -0.04 -0.63 0.65 -0.31 -0.69 0.00 0.00 174.62 173.60 1maj s TYR 37 N 1.01 3.40 -0.06 4.92 2.02 -1.26 -4.30 117.35 123.08 1maj s TYR 37 Ca 0.09 1.06 -0.30 0.00 -0.37 0.00 0.00 57.07 57.55 1maj s TYR 37 Cb -0.21 -2.40 0.11 0.00 -0.40 0.00 0.00 41.96 39.06 1maj s TYR 37 CO -0.06 0.18 0.94 -1.17 -1.57 0.00 0.00 175.55 173.87 1maj s LEU 38 N -2.88 -0.35 -0.30 -1.29 0.20 -1.26 -4.09 118.68 108.70 1maj s LEU 38 Ca 0.51 0.10 -0.04 0.00 0.69 0.00 0.00 54.13 55.39 1maj s LEU 38 Cb -0.11 1.94 0.17 0.00 -0.43 0.00 0.00 46.19 47.76 1maj s LEU 38 CO 0.19 -0.52 0.62 0.54 -0.29 0.00 0.00 176.35 176.89 1maj s ASN 39 N -2.12 -1.30 0.59 3.68 4.22 -0.43 -0.20 114.94 119.39 1maj s ASN 39 Ca 0.04 1.13 -0.01 0.00 -2.14 0.00 0.00 52.86 51.87 1maj s ASN 39 Cb -0.01 2.22 0.04 0.00 1.28 0.00 0.00 41.25 44.78 1maj s ASN 39 CO -0.06 -0.25 0.85 0.26 -2.04 0.00 0.00 177.10 175.86 1maj s TRP 40 N 2.87 2.89 -0.25 1.54 0.52 0.47 -1.37 118.94 125.62 1maj s TRP 40 Ca 0.11 0.14 -0.17 0.00 0.02 0.00 0.00 56.10 56.20 1maj s TRP 40 Cb -0.14 -2.87 0.07 0.00 -1.15 0.00 0.00 33.47 29.38 1maj s TRP 40 CO -0.20 -1.02 0.64 -0.47 0.02 0.00 0.00 176.95 175.91 1maj s TYR 41 N -2.91 -0.88 -0.16 -1.98 5.04 -0.78 -3.49 117.35 112.20 1maj s TYR 41 Ca 0.58 1.88 -0.05 0.00 -2.44 0.00 0.00 57.07 57.04 1maj s TYR 41 Cb -0.10 0.45 -0.03 0.00 0.35 0.00 0.00 41.96 42.62 1maj s TYR 41 CO 0.40 -0.44 -0.01 -1.17 -1.34 0.00 0.00 175.55 173.00 1maj s LEU 42 N 1.15 3.42 -0.21 6.97 2.96 -1.26 -1.40 118.68 130.31 1maj s LEU 42 Ca -0.06 -0.06 -0.15 0.00 -0.22 0.00 0.00 54.13 53.64 1maj s LEU 42 Cb -0.05 -1.83 -0.04 0.00 0.50 0.00 0.00 46.19 44.76 1maj s LEU 42 CO -0.12 0.18 0.36 -1.58 -1.32 0.00 0.00 176.35 173.88 1maj s GLN 43 N 0.29 4.15 0.00 1.98 0.74 -0.08 -4.39 119.66 122.35 1maj s GLN 43 Ca -0.01 0.13 0.00 0.00 0.05 0.00 0.00 55.36 55.52 1maj s GLN 43 Cb -0.14 -3.54 0.00 0.00 1.10 0.00 0.00 33.01 30.43 1maj s GLN 43 CO 0.02 -0.03 0.00 1.17 -0.55 0.00 0.00 175.29 175.90 1maj n LYS 44 N 4.48 1.50 0.07 1.67 3.00 -1.26 -3.02 118.16 124.60 1maj n LYS 44 Ca -0.09 0.00 -0.16 0.00 -0.00 0.00 0.00 58.31 58.06 1maj n LYS 44 Cb 0.51 0.00 -0.08 0.00 0.00 0.00 0.00 35.03 35.47 1maj n LYS 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1maj h ALA 45 N 1.00 0.25 -0.34 3.14 0.00 -1.97 -3.39 119.26 117.96 1maj h ALA 45 Ca 0.00 -0.74 -0.23 0.00 0.00 0.00 0.00 54.91 53.95 1maj h ALA 45 Cb 0.00 0.01 -0.35 0.00 0.00 0.00 0.00 17.79 17.45 1maj h ALA 45 CO 0.00 0.80 -0.96 0.41 0.00 0.00 0.00 179.25 179.50 1maj n GLY 46 N 1.10 1.81 0.00 0.00 0.00 -1.26 -4.83 105.19 102.01 1maj n GLY 46 Ca -0.08 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1maj n GLY 46 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1maj n GLN 47 N -0.75 0.78 -0.32 1.61 7.27 -1.26 -4.87 117.38 119.85 1maj n GLN 47 Ca 0.02 -0.11 -0.07 0.00 0.07 0.00 0.00 57.00 56.91 1maj n GLN 47 Cb 0.82 -0.49 -0.03 0.00 2.41 0.00 0.00 30.24 32.96 1maj n GLN 47 CO 0.00 0.00 0.00 1.03 0.07 0.00 0.00 177.06 178.16 1maj h SER 48 N 0.00 -1.65 -0.34 1.69 0.87 -1.77 -3.15 113.55 109.20 1maj h SER 48 Ca 0.00 0.29 -0.25 0.00 -1.23 0.00 0.00 61.79 60.60 1maj h SER 48 Cb 0.19 0.78 -0.02 0.00 -0.44 0.00 0.00 62.40 62.90 1maj h SER 48 CO 0.00 -0.29 0.82 -0.81 -0.53 0.00 0.00 176.83 176.01 1maj n PRO 49 N -5.39 1.18 0.00 2.24 -0.04 -1.26 -4.71 135.00 127.02 1maj n PRO 49 Ca 0.05 -2.24 0.00 0.00 -0.04 0.00 0.00 63.50 61.27 1maj n PRO 49 Cb 0.34 -3.76 0.00 0.00 -0.04 0.00 0.00 33.50 30.04 1maj n PRO 49 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1maj n LYS 50 N 8.20 0.00 -3.64 0.54 4.81 -1.19 -5.18 118.16 121.70 1maj n LYS 50 Ca 0.44 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.81 1maj n LYS 50 Cb 0.46 0.00 -0.07 0.00 0.02 0.00 0.00 35.03 35.44 1maj n LYS 50 CO 0.00 0.00 0.00 -1.17 1.17 0.00 0.00 177.40 177.40 1maj s LEU 51 N 0.00 -0.31 -0.09 3.14 2.96 -1.26 -4.94 118.68 118.17 1maj s LEU 51 Ca 0.00 0.60 -0.10 0.00 -0.22 0.00 0.00 54.13 54.41 1maj s LEU 51 Cb 0.00 1.61 -0.03 0.00 0.50 0.00 0.00 46.19 48.26 1maj s LEU 51 CO 0.00 -0.10 -0.19 0.18 -1.32 0.00 0.00 176.35 174.91 1maj n LEU 52 N 2.06 1.14 -4.28 -0.68 4.32 -1.23 -4.61 117.00 113.73 1maj n LEU 52 Ca -0.12 0.19 -0.30 0.00 -0.02 0.00 0.00 56.01 55.77 1maj n LEU 52 Cb 0.56 -0.60 -0.16 0.00 -1.62 0.00 0.00 43.42 41.60 1maj n LEU 52 CO 0.02 -0.39 -0.55 -0.63 -1.22 0.00 0.00 177.39 174.62 1maj s ILE 53 N -2.12 1.89 -0.19 -0.08 -1.09 -1.26 -0.86 121.20 117.50 1maj s ILE 53 Ca -0.16 -1.02 0.13 0.00 -2.23 0.00 0.00 60.65 57.36 1maj s ILE 53 Cb 0.02 -1.57 0.43 0.00 -1.58 0.00 0.00 42.46 39.75 1maj s ILE 53 CO 0.24 0.54 1.21 0.00 -1.23 0.00 0.00 174.94 175.69 1maj n TYR 54 N 2.50 0.21 -3.37 3.97 0.18 -1.14 -0.39 117.16 119.12 1maj n TYR 54 Ca -0.16 -1.43 0.00 0.00 1.88 0.00 0.00 57.90 58.19 1maj n TYR 54 Cb 0.52 -0.24 0.00 0.00 -0.38 0.00 0.00 39.34 39.23 1maj n TYR 54 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 1maj n LYS 55 N -0.87 0.00 -0.15 -3.48 4.76 0.73 -4.39 118.16 114.76 1maj n LYS 55 Ca 0.19 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.63 1maj n LYS 55 Cb 0.77 0.00 0.05 0.00 -1.84 0.00 0.00 35.03 34.01 1maj n LYS 55 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1maj n VAL 56 N 0.00 0.61 0.00 -0.18 0.24 -1.26 -4.49 118.33 113.26 1maj n VAL 56 Ca 0.00 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.07 1maj n VAL 56 Cb 0.00 -0.57 0.00 0.00 -1.47 0.00 0.00 33.84 31.80 1maj n VAL 56 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1maj n SER 57 N 0.13 0.00 -4.51 -1.34 2.88 -0.12 -3.88 113.62 106.78 1maj n SER 57 Ca 0.05 0.00 -0.45 0.00 -1.33 0.00 0.00 58.87 57.14 1maj n SER 57 Cb 0.45 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.90 1maj n SER 57 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1maj n ASN 58 N 0.00 0.24 -4.52 -3.46 3.02 -1.26 -4.57 115.26 104.71 1maj n ASN 58 Ca 0.00 1.14 -0.34 0.00 -0.03 0.00 0.00 54.58 55.35 1maj n ASN 58 Cb 0.00 -1.16 -0.12 0.00 -0.61 0.00 0.00 39.78 37.89 1maj n ASN 58 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1maj s ARG 59 N -1.36 3.26 0.99 3.52 0.52 -1.26 -2.87 118.95 121.75 1maj s ARG 59 Ca 0.61 -0.55 -0.12 0.00 -0.52 0.00 0.00 55.73 55.15 1maj s ARG 59 Cb -0.77 -2.74 0.14 0.00 0.52 0.00 0.00 34.95 32.09 1maj s ARG 59 CO 0.58 0.41 0.84 0.34 0.02 0.00 0.00 175.30 177.50 1maj n PHE 60 N 2.99 -0.30 -1.98 -0.53 7.35 -0.04 -4.79 117.46 120.16 1maj n PHE 60 Ca -0.18 0.24 -0.28 0.00 -0.76 0.00 0.00 57.45 56.47 1maj n PHE 60 Cb 0.53 -1.86 -0.05 0.00 0.35 0.00 0.00 39.48 38.45 1maj n PHE 60 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 1maj s SER 61 N -2.37 5.01 0.00 -2.13 0.01 -1.26 -2.81 113.70 110.14 1maj s SER 61 Ca 0.64 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.55 1maj s SER 61 Cb -0.22 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 63.46 1maj s SER 61 CO 0.62 -2.80 0.00 0.61 0.41 0.00 0.00 173.24 172.08 1maj n GLY 62 N 6.60 0.69 3.41 3.44 0.00 -1.26 -5.09 105.19 112.97 1maj n GLY 62 Ca 0.37 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.06 1maj n GLY 62 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1maj s VAL 63 N -0.77 3.13 -1.65 1.61 1.01 -1.12 -4.98 120.40 117.62 1maj s VAL 63 Ca 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.33 1maj s VAL 63 Cb 0.00 -2.29 0.00 0.00 0.00 0.00 0.00 36.38 34.09 1maj s VAL 63 CO 0.00 0.54 0.16 -0.81 0.00 0.00 0.00 175.10 174.99 1maj n PRO 64 N 3.19 0.19 0.00 2.72 -0.04 -1.26 -4.79 135.00 135.02 1maj n PRO 64 Ca -0.18 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.28 1maj n PRO 64 Cb 0.53 -1.03 0.00 0.00 -0.04 0.00 0.00 33.50 32.95 1maj n PRO 64 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1maj n ASP 65 N -0.19 0.00 -0.18 3.54 -0.08 -1.26 -4.66 116.55 113.72 1maj n ASP 65 Ca 0.00 0.00 0.29 0.00 -1.51 0.00 0.00 54.79 53.57 1maj n ASP 65 Cb 0.02 0.00 0.65 0.00 2.34 0.00 0.00 41.12 44.13 1maj n ASP 65 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 1maj h ARG 66 N 0.00 0.00 -6.15 -0.67 3.08 -1.93 -3.38 114.38 105.32 1maj h ARG 66 Ca 0.00 0.00 -0.57 0.00 0.07 0.00 0.00 59.98 59.48 1maj h ARG 66 Cb 0.00 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.00 1maj h ARG 66 CO 0.00 0.00 0.60 -0.06 -1.07 0.00 0.00 179.97 179.44 1maj s PHE 67 N -4.65 3.45 -0.28 3.04 0.08 -1.26 -1.74 117.98 116.62 1maj s PHE 67 Ca -0.04 1.50 -0.03 0.00 0.12 0.00 0.00 56.93 58.47 1maj s PHE 67 Cb 0.18 -3.18 0.10 0.00 -0.57 0.00 0.00 43.02 39.54 1maj s PHE 67 CO 0.61 -0.30 0.12 -1.12 -0.10 0.00 0.00 175.22 174.43 1maj s SER 68 N 1.14 3.53 -0.26 1.36 0.01 0.45 -4.89 113.70 115.04 1maj s SER 68 Ca 0.45 -1.29 -0.17 0.00 1.31 0.00 0.00 55.95 56.25 1maj s SER 68 Cb -0.17 -0.45 -0.03 0.00 0.21 0.00 0.00 66.02 65.58 1maj s SER 68 CO 0.14 -0.42 0.49 -0.83 0.41 0.00 0.00 173.24 173.02 1maj s GLY 69 N 2.00 1.85 0.04 3.44 0.00 -1.26 -0.68 107.32 112.72 1maj s GLY 69 Ca 0.08 -0.64 -0.16 0.00 0.00 0.00 0.00 44.72 44.00 1maj s GLY 69 CO -0.32 1.19 0.36 -1.35 0.00 0.00 0.00 173.10 172.98 1maj s SER 70 N 1.56 -0.20 0.08 1.64 1.04 -0.34 -0.94 113.70 116.53 1maj s SER 70 Ca 0.20 -0.08 -0.26 0.00 0.48 0.00 0.00 55.95 56.28 1maj s SER 70 Cb -0.16 0.39 0.08 0.00 0.10 0.00 0.00 66.02 66.43 1maj s SER 70 CO 0.09 -0.63 0.87 -0.83 0.98 0.00 0.00 173.24 173.73 1maj s GLY 71 N -1.99 -0.39 0.00 7.32 0.00 -1.26 -0.20 107.32 110.80 1maj s GLY 71 Ca -0.06 0.60 0.00 0.00 0.00 0.00 0.00 44.72 45.26 1maj s GLY 71 CO -0.02 0.19 0.00 -1.26 0.00 0.00 0.00 173.10 172.00 1maj n SER 72 N -0.34 0.00 0.00 1.64 2.88 0.87 -4.92 113.62 113.75 1maj n SER 72 Ca -0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.45 1maj n SER 72 Cb 0.62 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.08 1maj n SER 72 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1maj n GLY 73 N 5.00 0.34 0.82 0.46 0.00 -1.26 -4.57 105.19 105.98 1maj n GLY 73 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.10 1maj n GLY 73 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1maj n THR 74 N -0.76 2.06 -4.99 2.61 -2.24 -1.26 -3.78 114.28 105.92 1maj n THR 74 Ca 0.00 -1.74 -0.29 0.00 -2.27 0.00 0.00 64.05 59.75 1maj n THR 74 Cb 0.00 -0.13 -0.17 0.00 -2.10 0.00 0.00 70.33 67.94 1maj n THR 74 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1maj s ASP 75 N -1.80 2.57 0.03 3.42 -4.77 -1.26 -0.99 116.67 113.86 1maj s ASP 75 Ca 0.38 -0.45 -0.04 0.00 -3.30 0.00 0.00 52.55 49.15 1maj s ASP 75 Cb 0.30 -1.02 -0.02 0.00 -1.09 0.00 0.00 42.92 41.09 1maj s ASP 75 CO 0.10 0.14 0.06 -0.36 0.70 0.00 0.00 175.17 175.80 1maj s PHE 76 N 0.30 0.24 -0.08 2.11 0.40 -0.22 -0.09 117.98 120.64 1maj s PHE 76 Ca -0.13 -0.55 -0.17 0.00 -0.60 0.00 0.00 56.93 55.49 1maj s PHE 76 Cb -0.16 -0.18 0.04 0.00 0.51 0.00 0.00 43.02 43.23 1maj s PHE 76 CO 0.06 -0.32 0.40 0.99 0.70 0.00 0.00 175.22 177.05 1maj s THR 77 N -2.40 0.03 -0.67 0.64 2.01 0.72 -0.50 115.64 115.47 1maj s THR 77 Ca -0.07 -0.21 -0.11 0.00 0.31 0.00 0.00 61.69 61.61 1maj s THR 77 Cb -0.03 -0.65 0.17 0.00 0.01 0.00 0.00 72.50 72.01 1maj s THR 77 CO -0.04 -0.12 0.56 -0.22 -0.69 0.00 0.00 174.62 174.12 1maj s LEU 78 N -0.64 6.10 -0.27 4.42 2.96 0.76 -1.20 118.68 130.80 1maj s LEU 78 Ca -0.07 -2.45 -0.28 0.00 -0.22 0.00 0.00 54.13 51.11 1maj s LEU 78 Cb -0.04 -2.08 0.01 0.00 0.50 0.00 0.00 46.19 44.58 1maj s LEU 78 CO 0.03 -0.59 1.01 -0.54 -1.32 0.00 0.00 176.35 174.94 1maj s LYS 79 N 0.55 4.15 -0.36 1.98 1.02 0.15 -2.61 119.74 124.63 1maj s LYS 79 Ca 0.13 1.14 -0.02 0.00 0.02 0.00 0.00 55.97 57.24 1maj s LYS 79 Cb -0.19 -3.68 0.09 0.00 -0.52 0.00 0.00 37.83 33.53 1maj s LYS 79 CO -0.04 -0.72 0.11 0.42 -0.92 0.00 0.00 175.35 174.20 1maj s ILE 80 N 3.30 3.05 0.00 2.17 1.01 -0.35 -0.41 121.20 129.96 1maj s ILE 80 Ca 0.42 -1.86 0.00 0.00 0.00 0.00 0.00 60.65 59.21 1maj s ILE 80 Cb -0.14 -2.99 0.00 0.00 0.01 0.00 0.00 42.46 39.34 1maj s ILE 80 CO 0.10 -0.48 1.45 -1.20 0.00 0.00 0.00 174.94 174.82 1maj n SER 81 N 4.56 3.90 0.00 3.58 7.64 -0.71 -1.31 113.62 131.28 1maj n SER 81 Ca -0.05 -2.02 0.00 0.00 1.01 0.00 0.00 58.87 57.81 1maj n SER 81 Cb 0.42 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.80 1maj n SER 81 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1maj n ARG 82 N 1.57 0.00 -3.06 1.43 5.12 -0.72 -4.77 116.66 116.23 1maj n ARG 82 Ca 0.00 0.00 -0.44 0.00 -1.93 0.00 0.00 57.85 55.48 1maj n ARG 82 Cb 0.37 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.63 1maj n ARG 82 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1maj s VAL 83 N 0.00 4.75 0.42 1.55 1.01 0.25 -4.85 120.40 123.52 1maj s VAL 83 Ca 0.00 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.10 1maj s VAL 83 Cb 0.00 -4.54 0.06 0.00 0.00 0.00 0.00 36.38 31.91 1maj s VAL 83 CO 0.00 -1.20 0.52 1.21 0.00 0.00 0.00 175.10 175.63 1maj n GLU 84 N 6.53 0.75 0.13 2.72 0.00 -1.26 0.64 120.64 130.15 1maj n GLU 84 Ca -0.07 -2.31 0.18 0.00 0.00 0.00 0.00 57.16 54.97 1maj n GLU 84 Cb 0.43 -0.08 0.76 0.00 0.00 0.00 0.00 31.44 32.56 1maj n GLU 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1maj h ALA 85 N 0.32 2.07 -0.16 4.31 0.00 -1.95 0.19 119.26 124.04 1maj h ALA 85 Ca -0.21 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.52 1maj h ALA 85 Cb 0.91 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.72 1maj h ALA 85 CO 0.30 -0.47 -0.60 0.93 0.00 0.00 0.00 179.25 179.41 1maj h GLU 86 N 0.00 0.54 -0.55 0.00 4.39 -1.97 -3.16 114.58 113.83 1maj h GLU 86 Ca 0.15 -0.37 -0.03 0.00 0.34 0.00 0.00 59.36 59.46 1maj h GLU 86 Cb 0.76 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.44 1maj h GLU 86 CO -0.00 0.98 0.24 -0.44 -1.16 0.00 0.00 179.01 178.62 1maj h ASP 87 N 0.40 0.74 -2.22 1.42 5.19 -0.96 -3.44 116.42 117.55 1maj h ASP 87 Ca -0.00 -0.15 -0.60 0.00 -0.62 0.00 0.00 57.03 55.65 1maj h ASP 87 Cb 1.16 -0.19 0.16 0.00 0.18 0.00 0.00 39.33 40.64 1maj h ASP 87 CO 0.11 0.69 -0.74 0.18 -3.12 0.00 0.00 179.24 176.36 1maj n LEU 88 N -4.53 -1.55 0.00 1.55 4.77 -1.03 -4.75 117.00 111.45 1maj n LEU 88 Ca 0.03 0.78 0.00 0.00 -0.03 0.00 0.00 56.01 56.78 1maj n LEU 88 Cb 0.14 -1.00 0.00 0.00 -2.33 0.00 0.00 43.42 40.24 1maj n LEU 88 CO 0.38 -3.77 0.00 0.61 -1.33 0.00 0.00 177.39 173.28 1maj n GLY 89 N 2.12 0.63 3.65 -0.72 0.00 -0.66 -4.88 105.19 105.33 1maj n GLY 89 Ca 0.10 -1.96 -0.33 0.00 0.00 0.00 0.00 46.02 43.83 1maj n GLY 89 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1maj s ILE 90 N -1.73 4.03 0.03 -0.61 -1.09 -1.17 -1.01 121.20 119.65 1maj s ILE 90 Ca 0.00 -0.53 0.06 0.00 -2.23 0.00 0.00 60.65 57.95 1maj s ILE 90 Cb 0.00 -2.74 -0.03 0.00 -1.58 0.00 0.00 42.46 38.11 1maj s ILE 90 CO 0.00 0.47 -0.16 -0.31 -1.23 0.00 0.00 174.94 173.71 1maj s TYR 91 N -0.98 2.62 0.09 3.97 1.51 -0.63 -0.90 117.35 123.03 1maj s TYR 91 Ca 0.16 -0.22 0.03 0.00 -1.01 0.00 0.00 57.07 56.04 1maj s TYR 91 Cb -0.11 -1.49 -0.04 0.00 -0.11 0.00 0.00 41.96 40.21 1maj s TYR 91 CO 0.06 0.27 -0.09 -0.06 -1.11 0.00 0.00 175.55 174.62 1maj s PHE 92 N -0.93 1.02 -0.27 2.71 0.40 -0.49 -1.62 117.98 118.79 1maj s PHE 92 Ca 0.15 -0.69 -0.03 0.00 -0.60 0.00 0.00 56.93 55.77 1maj s PHE 92 Cb -0.11 -0.56 0.09 0.00 0.51 0.00 0.00 43.02 42.96 1maj s PHE 92 CO 0.05 -0.02 0.10 0.00 0.70 0.00 0.00 175.22 176.05 1maj s SER 94 N 1.91 6.32 -0.16 0.00 1.04 -0.47 -4.61 113.70 117.72 1maj s SER 94 Ca 0.07 0.16 -0.03 0.00 0.48 0.00 0.00 55.95 56.63 1maj s SER 94 Cb -0.17 -1.90 -0.02 0.00 0.10 0.00 0.00 66.02 64.03 1maj s SER 94 CO -0.27 -0.08 -0.06 0.00 0.98 0.00 0.00 173.24 173.82 1maj s GLN 95 N -3.87 3.55 0.00 4.02 -2.07 -1.26 -1.32 119.66 118.71 1maj s GLN 95 Ca 0.35 -0.58 0.29 0.00 -1.82 0.00 0.00 55.36 53.60 1maj s GLN 95 Cb -0.10 -2.88 1.25 0.00 -1.09 0.00 0.00 33.01 30.20 1maj s GLN 95 CO 0.30 0.15 1.88 2.41 -1.32 0.00 0.00 175.29 178.71 1maj n THR 96 N 3.79 0.00 0.35 3.63 -1.04 -1.26 -4.11 114.28 115.65 1maj n THR 96 Ca -0.18 -0.04 -0.14 0.00 -2.04 0.00 0.00 64.05 61.66 1maj n THR 96 Cb 0.52 -0.19 -0.07 0.00 -1.82 0.00 0.00 70.33 68.78 1maj n THR 96 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1maj h THR 97 N 0.38 0.00 -3.54 12.58 2.02 -1.87 -3.40 112.91 119.07 1maj h THR 97 Ca 0.00 -0.10 -0.62 0.00 0.77 0.00 0.00 66.41 66.46 1maj h THR 97 Cb 0.36 0.00 -0.12 0.00 -1.74 0.00 0.00 68.15 66.65 1maj h THR 97 CO 0.00 0.00 0.26 -1.00 0.37 0.00 0.00 175.52 175.15 1maj s HIS 98 N -4.75 3.14 -0.14 3.16 3.76 -1.26 -5.04 115.29 114.16 1maj s HIS 98 Ca -0.13 0.47 -0.05 0.00 -0.15 0.00 0.00 55.06 55.20 1maj s HIS 98 Cb 0.01 -3.25 -0.04 0.00 1.11 0.00 0.00 32.58 30.42 1maj s HIS 98 CO 0.39 -0.66 0.05 0.08 -0.85 0.00 0.00 174.74 173.75 1maj s VAL 99 N 2.89 4.67 0.67 -0.90 1.01 -1.26 -2.17 120.40 125.31 1maj s VAL 99 Ca 0.28 -0.09 -0.13 0.00 0.00 0.00 0.00 61.98 62.03 1maj s VAL 99 Cb -0.14 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.19 1maj s VAL 99 CO 0.15 0.53 1.08 -2.16 0.00 0.00 0.00 175.10 174.70 1maj s PRO 100 N -0.21 2.87 0.37 2.72 0.04 -1.26 -4.93 135.00 134.60 1maj s PRO 100 Ca 0.07 1.20 -0.28 0.00 0.04 0.00 0.00 61.00 62.03 1maj s PRO 100 Cb -0.12 -1.97 -0.11 0.00 0.04 0.00 0.00 34.50 32.34 1maj s PRO 100 CO 0.02 -1.17 1.46 -1.25 0.04 0.00 0.00 177.00 176.10 1maj s PRO 101 N -4.45 4.14 0.04 0.56 0.04 -0.92 -4.81 135.00 129.59 1maj s PRO 101 Ca 0.63 2.52 -0.18 0.00 0.04 0.00 0.00 61.00 64.01 1maj s PRO 101 Cb -0.17 -2.98 -0.18 0.00 0.04 0.00 0.00 34.50 31.21 1maj s PRO 101 CO 0.46 -0.49 1.23 1.79 0.04 0.00 0.00 177.00 180.03 1maj h THR 102 N 2.99 1.37 -2.10 1.26 1.35 -1.79 -3.49 112.91 112.51 1maj h THR 102 Ca -0.51 -1.80 0.21 0.00 -0.55 0.00 0.00 66.41 63.77 1maj h THR 102 Cb 1.24 2.20 -0.11 0.00 -1.73 0.00 0.00 68.15 69.75 1maj h THR 102 CO 0.65 0.54 -0.74 0.33 -0.25 0.00 0.00 175.52 176.05 1maj n PHE 103 N -4.27 -2.32 0.00 4.73 -0.00 -1.26 -5.07 117.46 109.28 1maj n PHE 103 Ca -0.08 1.27 0.00 0.00 -0.00 0.00 0.00 57.45 58.64 1maj n PHE 103 Cb 0.58 -2.11 0.00 0.00 -0.00 0.00 0.00 39.48 37.95 1maj n PHE 103 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1maj n GLY 104 N -3.44 4.25 0.00 7.13 0.00 -1.26 -4.87 105.19 107.01 1maj n GLY 104 Ca -0.05 -0.81 0.00 0.00 0.00 0.00 0.00 46.02 45.16 1maj n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maj n GLY 105 N -0.15 1.96 0.00 -0.02 0.00 -1.26 -4.40 105.19 101.32 1maj n GLY 105 Ca 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.39 1maj n GLY 105 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1maj n GLY 106 N -1.70 -1.92 3.62 -0.02 0.00 -1.20 -4.83 105.19 99.14 1maj n GLY 106 Ca 0.00 0.94 -0.43 0.00 0.00 0.00 0.00 46.02 46.53 1maj n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1maj s THR 107 N 0.00 4.18 -0.47 2.61 2.01 -0.64 -4.78 115.64 118.55 1maj s THR 107 Ca 0.00 1.31 -0.28 0.00 0.31 0.00 0.00 61.69 63.03 1maj s THR 107 Cb 0.00 -4.28 0.00 0.00 0.01 0.00 0.00 72.50 68.23 1maj s THR 107 CO 0.00 -0.60 1.52 -0.75 -0.69 0.00 0.00 174.62 174.10 1maj s LYS 108 N 4.23 3.34 -0.68 4.92 2.20 0.00 -1.61 119.74 132.14 1maj s LYS 108 Ca 0.54 0.81 -0.14 0.00 -0.36 0.00 0.00 55.97 56.81 1maj s LYS 108 Cb -0.14 -4.12 0.17 0.00 -1.51 0.00 0.00 37.83 32.23 1maj s LYS 108 CO 0.24 -1.86 0.62 -1.17 -0.36 0.00 0.00 175.35 172.82 1maj s LEU 109 N 6.25 6.42 -0.03 5.43 2.96 -0.18 -0.82 118.68 138.72 1maj s LEU 109 Ca 0.62 -2.27 0.04 0.00 -0.22 0.00 0.00 54.13 52.30 1maj s LEU 109 Cb -0.14 -2.19 -0.00 0.00 0.50 0.00 0.00 46.19 44.36 1maj s LEU 109 CO 0.29 -0.70 -0.16 -1.61 -1.32 0.00 0.00 176.35 172.86 1maj s GLU 110 N 0.83 1.53 0.87 1.98 2.02 -1.23 -1.66 118.70 123.04 1maj s GLU 110 Ca 0.11 -0.56 -0.11 0.00 0.02 0.00 0.00 54.97 54.43 1maj s GLU 110 Cb -0.20 -1.38 0.11 0.00 0.10 0.00 0.00 34.13 32.77 1maj s GLU 110 CO -0.03 0.25 1.09 0.42 0.02 0.00 0.00 175.26 177.01 1maj s ILE 111 N -0.05 2.79 0.66 -1.63 1.09 -1.26 -3.07 121.20 119.73 1maj s ILE 111 Ca -0.01 0.26 -0.15 0.00 -1.10 0.00 0.00 60.65 59.65 1maj s ILE 111 Cb -0.10 -2.71 0.00 0.00 -1.06 0.00 0.00 42.46 38.59 1maj s ILE 111 CO 0.01 -0.34 1.11 -0.54 -0.10 0.00 0.00 174.94 175.08 1maj s LYS 112 N -4.90 2.78 0.00 2.79 1.02 0.15 -4.67 119.74 116.91 1maj s LYS 112 Ca 0.63 1.37 0.00 0.00 0.02 0.00 0.00 55.97 57.99 1maj s LYS 112 Cb -0.18 -1.95 0.00 0.00 -0.52 0.00 0.00 37.83 35.18 1maj s LYS 112 CO 0.57 -1.26 0.19 0.54 -0.92 0.00 0.00 175.35 174.47