#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 -0.03 0.18 2.12 1.01 -1.26 -4.92 120.40 117.50 1maj s VAL 2 Ca 0.00 0.10 -0.30 0.00 0.00 0.00 0.00 61.98 61.77 1maj s VAL 2 Cb 0.00 -0.06 -0.09 0.00 0.00 0.00 0.00 36.38 36.24 1maj s VAL 2 CO 0.00 0.04 1.35 -0.69 0.00 0.00 0.00 175.10 175.80 1maj s VAL 3 N 0.49 3.17 -0.42 2.92 1.01 -1.26 -4.66 120.40 121.66 1maj s VAL 3 Ca -0.04 0.92 0.03 0.00 0.00 0.00 0.00 61.98 62.89 1maj s VAL 3 Cb -0.06 -3.59 0.12 0.00 0.00 0.00 0.00 36.38 32.85 1maj s VAL 3 CO -0.01 0.12 0.19 -0.04 0.00 0.00 0.00 175.10 175.35 1maj s MET 4 N 0.27 1.43 -0.31 2.72 -1.94 -1.26 -0.69 119.30 119.52 1maj s MET 4 Ca 0.60 -2.01 -0.29 0.00 -1.71 0.00 0.00 55.69 52.28 1maj s MET 4 Cb -0.37 -2.73 0.01 0.00 2.01 0.00 0.00 34.83 33.75 1maj s MET 4 CO 0.36 -1.08 1.14 0.99 -0.01 0.00 0.00 175.02 176.43 1maj s THR 5 N 0.48 4.40 0.05 2.05 2.01 -0.16 -4.62 115.64 119.84 1maj s THR 5 Ca 0.15 1.60 0.00 0.00 0.31 0.00 0.00 61.69 63.75 1maj s THR 5 Cb -0.23 -4.34 -0.04 0.00 0.01 0.00 0.00 72.50 67.91 1maj s THR 5 CO -0.05 -0.48 0.16 -1.10 -0.69 0.00 0.00 174.62 172.46 1maj s GLN 6 N 3.80 3.26 0.14 4.92 1.11 -1.26 -1.58 119.66 130.05 1maj s GLN 6 Ca 0.49 -0.49 -0.24 0.00 0.01 0.00 0.00 55.36 55.13 1maj s GLN 6 Cb -0.14 -2.95 0.07 0.00 -1.01 0.00 0.00 33.01 28.98 1maj s GLN 6 CO 0.18 0.61 0.74 0.95 0.01 0.00 0.00 175.29 177.78 1maj s THR 7 N -1.42 0.00 1.01 -0.19 -4.23 -0.58 -4.54 115.64 105.70 1maj s THR 7 Ca 0.31 -0.27 -0.16 0.00 -1.18 0.00 0.00 61.69 60.38 1maj s THR 7 Cb -0.13 -1.31 0.21 0.00 1.34 0.00 0.00 72.50 72.61 1maj s THR 7 CO 0.24 0.00 1.26 -2.16 -0.54 0.00 0.00 174.62 173.42 1maj s PRO 8 N -3.57 0.28 0.38 3.99 0.04 -1.26 0.19 135.00 135.05 1maj s PRO 8 Ca 0.05 -0.28 0.19 0.00 0.04 0.00 0.00 61.00 61.00 1maj s PRO 8 Cb -0.02 -1.79 0.75 0.00 0.04 0.00 0.00 34.50 33.48 1maj s PRO 8 CO -0.06 -2.68 1.77 -0.07 0.04 0.00 0.00 177.00 176.00 1maj h LEU 9 N -1.83 0.00 -7.65 -3.56 4.07 -1.85 -3.34 115.31 101.15 1maj h LEU 9 Ca -0.45 0.00 -0.15 0.00 0.08 0.00 0.00 57.88 57.36 1maj h LEU 9 Cb 1.26 0.00 -0.22 0.00 1.08 0.00 0.00 40.66 42.77 1maj h LEU 9 CO 0.39 0.36 -0.47 -0.94 -1.08 0.00 0.00 178.44 176.70 1maj s SER 10 N -6.49 -0.07 -0.55 -0.43 1.04 -1.26 -1.10 113.70 104.84 1maj s SER 10 Ca -0.01 0.02 0.05 0.00 0.48 0.00 0.00 55.95 56.49 1maj s SER 10 Cb 0.12 0.28 0.18 0.00 0.10 0.00 0.00 66.02 66.70 1maj s SER 10 CO 0.68 -0.28 0.46 -0.11 0.98 0.00 0.00 173.24 174.97 1maj n LEU 11 N 1.94 1.37 -4.59 2.42 7.94 0.14 -4.85 117.00 121.37 1maj n LEU 11 Ca -0.19 -4.84 -0.42 0.00 -1.11 0.00 0.00 56.01 49.45 1maj n LEU 11 Cb 0.57 -0.08 -0.03 0.00 0.53 0.00 0.00 43.42 44.41 1maj n LEU 11 CO 0.21 1.86 1.51 -2.16 -1.11 0.00 0.00 177.39 177.70 1maj s PRO 12 N -0.90 3.26 0.03 1.96 0.04 -1.26 -4.38 135.00 133.75 1maj s PRO 12 Ca 0.31 1.27 -0.07 0.00 0.04 0.00 0.00 61.00 62.55 1maj s PRO 12 Cb 0.03 -4.20 -0.01 0.00 0.04 0.00 0.00 34.50 30.36 1maj s PRO 12 CO -0.16 -1.94 0.12 0.14 0.04 0.00 0.00 177.00 175.20 1maj s VAL 13 N 7.04 0.12 0.44 -0.36 -7.23 -1.21 -4.44 120.40 114.75 1maj s VAL 13 Ca 0.76 -0.96 -0.17 0.00 -1.81 0.00 0.00 61.98 59.80 1maj s VAL 13 Cb -0.20 -0.79 -0.09 0.00 0.56 0.00 0.00 36.38 35.86 1maj s VAL 13 CO 0.32 -0.53 0.90 -0.44 -0.31 0.00 0.00 175.10 175.03 1maj s SER 14 N -1.95 6.74 -0.94 4.85 0.01 -1.26 0.79 113.70 121.94 1maj s SER 14 Ca -0.07 1.50 -0.24 0.00 1.31 0.00 0.00 55.95 58.44 1maj s SER 14 Cb -0.03 -2.47 -0.05 0.00 0.21 0.00 0.00 66.02 63.68 1maj s SER 14 CO -0.03 -0.41 1.94 -0.76 0.41 0.00 0.00 173.24 174.38 1maj s LEU 15 N -3.54 3.16 0.00 2.44 1.43 -1.26 -2.23 118.68 118.68 1maj s LEU 15 Ca 0.58 -0.81 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 1maj s LEU 15 Cb -0.10 -2.56 0.00 0.00 0.03 0.00 0.00 46.19 43.56 1maj s LEU 15 CO 0.23 -2.77 0.00 0.61 0.23 0.00 0.00 176.35 174.65 1maj n GLY 16 N 6.72 0.61 3.90 -3.19 0.00 -0.73 -4.83 105.19 107.67 1maj n GLY 16 Ca 0.41 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.14 1maj n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1maj s ASP 17 N 0.00 4.25 0.01 1.61 1.11 -0.95 -4.34 116.67 118.36 1maj s ASP 17 Ca 0.00 0.71 -0.22 0.00 0.18 0.00 0.00 52.55 53.21 1maj s ASP 17 Cb 0.00 -1.13 -0.05 0.00 1.07 0.00 0.00 42.92 42.81 1maj s ASP 17 CO 0.00 -2.06 0.67 -1.10 1.18 0.00 0.00 175.17 173.85 1maj s GLN 18 N -5.62 4.40 0.17 8.23 -0.21 -1.18 -2.40 119.66 123.05 1maj s GLN 18 Ca 0.64 0.87 0.06 0.00 0.02 0.00 0.00 55.36 56.94 1maj s GLN 18 Cb -0.10 -3.36 -0.04 0.00 1.00 0.00 0.00 33.01 30.51 1maj s GLN 18 CO 0.50 0.30 0.11 0.00 -2.12 0.00 0.00 175.29 174.08 1maj s ALA 19 N -0.03 3.48 -0.31 6.09 0.00 -0.74 -4.90 121.76 125.34 1maj s ALA 19 Ca 0.34 -1.27 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1maj s ALA 19 Cb -0.19 -1.27 0.15 0.00 0.00 0.00 0.00 23.12 21.81 1maj s ALA 19 CO 0.19 0.48 0.35 -1.12 0.00 0.00 0.00 175.76 175.67 1maj s SER 20 N -3.11 1.13 0.57 0.00 0.01 -1.24 -0.68 113.70 110.37 1maj s SER 20 Ca 0.30 -0.83 -0.08 0.00 1.31 0.00 0.00 55.95 56.66 1maj s SER 20 Cb -0.10 0.72 -0.02 0.00 0.21 0.00 0.00 66.02 66.83 1maj s SER 20 CO 0.22 -0.35 0.91 -0.63 0.41 0.00 0.00 173.24 173.81 1maj s ILE 21 N 2.21 4.47 0.07 1.44 1.01 -0.62 -4.80 121.20 124.98 1maj s ILE 21 Ca 0.11 0.40 0.09 0.00 0.00 0.00 0.00 60.65 61.25 1maj s ILE 21 Cb -0.14 -3.75 -0.03 0.00 0.01 0.00 0.00 42.46 38.55 1maj s ILE 21 CO -0.25 -0.85 -0.24 -0.55 0.00 0.00 0.00 174.94 173.05 1maj s SER 22 N -4.19 2.88 -0.26 3.58 0.15 0.50 -1.23 113.70 115.13 1maj s SER 22 Ca 0.52 -0.61 -0.01 0.00 0.70 0.00 0.00 55.95 56.55 1maj s SER 22 Cb -0.11 -0.23 0.14 0.00 -1.71 0.00 0.00 66.02 64.11 1maj s SER 22 CO 0.48 0.19 0.36 0.00 1.20 0.00 0.00 173.24 175.47 1maj s ARG 24 N 2.49 3.09 0.13 0.00 0.52 -0.61 -1.46 118.95 123.11 1maj s ARG 24 Ca 0.11 -0.62 -0.00 0.00 -0.52 0.00 0.00 55.73 54.69 1maj s ARG 24 Cb -0.14 -2.62 -0.04 0.00 0.52 0.00 0.00 34.95 32.66 1maj s ARG 24 CO -0.23 0.42 0.30 -1.54 0.02 0.00 0.00 175.30 174.27 1maj s SER 25 N -0.18 6.38 0.18 0.23 1.04 -0.32 -0.99 113.70 120.05 1maj s SER 25 Ca 0.01 0.33 -0.01 0.00 0.48 0.00 0.00 55.95 56.76 1maj s SER 25 Cb -0.13 -1.98 0.08 0.00 0.10 0.00 0.00 66.02 64.08 1maj s SER 25 CO 0.03 0.07 1.45 0.77 0.98 0.00 0.00 173.24 176.54 1maj h SER 26 N 2.55 0.49 -4.05 7.02 4.64 -1.23 -3.45 113.55 119.53 1maj h SER 26 Ca -0.47 -0.31 -0.66 0.00 -0.47 0.00 0.00 61.79 59.88 1maj h SER 26 Cb 1.18 -0.15 -0.23 0.00 -0.31 0.00 0.00 62.40 62.89 1maj h SER 26 CO 0.72 1.04 -0.86 -1.58 -0.87 0.00 0.00 176.83 175.28 1maj s GLN 27 N -3.68 1.42 0.38 4.77 2.00 -1.26 -5.04 119.66 118.24 1maj s GLN 27 Ca -0.06 -1.25 -0.25 0.00 -2.00 0.00 0.00 55.36 51.80 1maj s GLN 27 Cb 0.11 -1.80 -0.12 0.00 0.80 0.00 0.00 33.01 31.99 1maj s GLN 27 CO 0.84 0.44 0.90 0.45 -0.50 0.00 0.00 175.29 177.42 1maj n SER 28 N 1.14 0.78 -2.38 6.67 2.88 -1.26 -4.85 113.62 116.60 1maj n SER 28 Ca -0.18 1.06 -0.32 0.00 -1.33 0.00 0.00 58.87 58.10 1maj n SER 28 Cb 0.53 -1.28 0.04 0.00 -0.75 0.00 0.00 64.21 62.76 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 0.91 6.46 -4.75 2.46 4.77 -1.25 -4.99 117.00 120.60 1maj n LEU 29 Ca 0.10 -4.66 -0.36 0.00 -0.03 0.00 0.00 56.01 51.07 1maj n LEU 29 Cb 0.37 -0.74 -0.08 0.00 -2.33 0.00 0.00 43.42 40.64 1maj n LEU 29 CO 0.57 1.82 -0.22 -0.69 -1.33 0.00 0.00 177.39 177.54 1maj s VAL 30 N -4.91 5.10 0.00 4.08 1.01 -1.26 -3.69 120.40 120.73 1maj s VAL 30 Ca 0.56 0.07 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1maj s VAL 30 Cb 0.45 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.58 1maj s VAL 30 CO -0.10 0.54 0.00 1.57 0.00 0.00 0.00 175.10 177.11 1maj n HIS 31 N 2.70 -0.39 0.37 5.22 -0.00 -0.68 -4.85 115.22 117.58 1maj n HIS 31 Ca -0.18 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.00 1maj n HIS 31 Cb 0.53 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.40 1maj n HIS 31 CO 0.00 0.00 0.00 0.43 0.46 0.00 0.00 176.34 177.23 1maj n SER 32 N -0.30 3.67 0.00 0.26 7.64 -1.26 -4.78 113.62 118.84 1maj n SER 32 Ca 0.00 -2.04 0.00 0.00 1.01 0.00 0.00 58.87 57.84 1maj n SER 32 Cb 0.00 -0.70 0.00 0.00 -1.01 0.00 0.00 64.21 62.50 1maj n SER 32 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1maj n ASN 33 N 0.94 0.00 -2.89 6.43 6.94 -1.26 -5.03 115.26 120.38 1maj n ASN 33 Ca 0.00 0.00 -0.34 0.00 -0.02 0.00 0.00 54.58 54.22 1maj n ASN 33 Cb 0.47 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.87 1maj n ASN 33 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1maj n GLY 34 N 0.00 5.02 2.93 4.83 0.00 -1.26 -4.91 105.19 111.80 1maj n GLY 34 Ca 0.00 -2.16 -0.10 0.00 0.00 0.00 0.00 46.02 43.75 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 -0.25 0.12 -0.15 1.61 -0.87 -1.26 -5.06 114.94 109.08 1maj s ASN 35 Ca 0.54 -0.25 0.01 0.00 -1.57 0.00 0.00 52.86 51.58 1maj s ASN 35 Cb 0.35 0.06 0.02 0.00 -0.02 0.00 0.00 41.25 41.66 1maj s ASN 35 CO -0.25 -0.16 -0.16 -0.89 -2.57 0.00 0.00 177.10 173.07 1maj s THR 36 N -0.76 1.70 -1.31 1.60 2.01 -1.26 -1.69 115.64 115.93 1maj s THR 36 Ca -0.08 -0.71 -0.12 0.00 0.31 0.00 0.00 61.69 61.08 1maj s THR 36 Cb -0.05 -1.57 0.13 0.00 0.01 0.00 0.00 72.50 71.02 1maj s THR 36 CO -0.00 0.48 1.86 -1.22 -0.69 0.00 0.00 174.62 175.04 1maj n TYR 37 N 4.69 3.61 -5.19 4.92 4.01 -1.24 -3.10 117.16 124.85 1maj n TYR 37 Ca -0.18 -2.94 -0.32 0.00 -0.16 0.00 0.00 57.90 54.30 1maj n TYR 37 Cb 0.50 -2.18 -0.16 0.00 -0.31 0.00 0.00 39.34 37.18 1maj n TYR 37 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1maj s LEU 38 N 1.06 2.15 0.28 7.72 0.20 -1.26 0.79 118.68 129.62 1maj s LEU 38 Ca 0.43 -0.51 0.06 0.00 0.69 0.00 0.00 54.13 54.80 1maj s LEU 38 Cb 0.08 -1.41 -0.06 0.00 -0.43 0.00 0.00 46.19 44.36 1maj s LEU 38 CO -0.01 0.20 -0.04 0.54 -0.29 0.00 0.00 176.35 176.75 1maj s ASN 39 N 0.09 2.69 0.18 3.68 2.20 -1.03 -1.16 114.94 121.58 1maj s ASN 39 Ca -0.11 -1.22 0.09 0.00 -0.94 0.00 0.00 52.86 50.69 1maj s ASN 39 Cb -0.16 -0.15 -0.04 0.00 -2.00 0.00 0.00 41.25 38.90 1maj s ASN 39 CO 0.06 -0.38 -0.10 0.26 -2.94 0.00 0.00 177.10 174.00 1maj s TRP 40 N -3.06 2.63 0.17 1.54 0.52 0.36 -1.99 118.94 119.11 1maj s TRP 40 Ca 0.30 -0.22 0.02 0.00 0.02 0.00 0.00 56.10 56.22 1maj s TRP 40 Cb 0.05 -1.29 -0.05 0.00 -1.15 0.00 0.00 33.47 31.03 1maj s TRP 40 CO 0.12 0.51 -0.02 -0.47 0.02 0.00 0.00 176.95 177.11 1maj s TYR 41 N -1.69 1.22 -0.22 -1.98 5.04 0.94 -1.50 117.35 119.16 1maj s TYR 41 Ca 0.25 -0.97 -0.17 0.00 -2.44 0.00 0.00 57.07 53.73 1maj s TYR 41 Cb -0.09 -0.69 0.06 0.00 0.35 0.00 0.00 41.96 41.60 1maj s TYR 41 CO 0.15 -0.15 0.56 -1.17 -1.34 0.00 0.00 175.55 173.59 1maj s LEU 42 N -3.17 -0.26 -0.17 6.97 2.96 -1.23 -1.49 118.68 122.28 1maj s LEU 42 Ca 0.22 1.15 -0.01 0.00 -0.22 0.00 0.00 54.13 55.28 1maj s LEU 42 Cb 0.06 1.91 0.00 0.00 0.50 0.00 0.00 46.19 48.66 1maj s LEU 42 CO 0.03 -0.20 -0.13 -1.58 -1.32 0.00 0.00 176.35 173.14 1maj s GLN 43 N 0.66 3.22 0.39 1.98 2.00 0.04 -3.55 119.66 124.40 1maj s GLN 43 Ca -0.03 -0.73 -0.08 0.00 -2.00 0.00 0.00 55.36 52.52 1maj s GLN 43 Cb -0.05 -2.71 -0.05 0.00 0.80 0.00 0.00 33.01 31.00 1maj s GLN 43 CO -0.04 -0.07 0.71 0.21 -0.50 0.00 0.00 175.29 175.59 1maj s LYS 44 N 1.04 3.68 -0.91 1.67 2.47 -1.26 -1.46 119.74 124.98 1maj s LYS 44 Ca -0.01 0.27 -0.26 0.00 -1.56 0.00 0.00 55.97 54.41 1maj s LYS 44 Cb -0.15 -2.47 -0.15 0.00 -1.46 0.00 0.00 37.83 33.61 1maj s LYS 44 CO -0.03 0.01 2.24 0.00 0.16 0.00 0.00 175.35 177.73 1maj s ALA 45 N -2.36 0.81 -0.67 3.13 0.00 -1.26 -3.06 121.76 118.35 1maj s ALA 45 Ca 0.48 -1.16 -0.01 0.00 0.00 0.00 0.00 51.96 51.28 1maj s ALA 45 Cb -0.10 -4.62 -0.01 0.00 0.00 0.00 0.00 23.12 18.39 1maj s ALA 45 CO 0.34 -6.02 0.56 0.41 0.00 0.00 0.00 175.76 171.05 1maj n GLY 46 N 6.59 -0.09 0.00 0.00 0.00 -1.26 -5.04 105.19 105.39 1maj n GLY 46 Ca 0.44 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.41 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 -2.73 0.00 -3.18 1.61 -0.06 -1.17 -5.12 117.38 106.74 1maj n GLN 47 Ca -0.14 0.00 -0.42 0.00 -2.00 0.00 0.00 57.00 54.44 1maj n GLN 47 Cb 0.59 0.00 -0.07 0.00 -4.06 0.00 0.00 30.24 26.70 1maj n GLN 47 CO 0.00 0.00 0.00 -1.54 -0.20 0.00 0.00 177.06 175.32 1maj s SER 48 N -0.38 6.33 0.78 1.69 1.04 -1.26 -4.74 113.70 117.16 1maj s SER 48 Ca 0.00 -0.15 -0.12 0.00 0.48 0.00 0.00 55.95 56.16 1maj s SER 48 Cb 0.00 -2.29 0.07 0.00 0.10 0.00 0.00 66.02 63.89 1maj s SER 48 CO 0.00 -0.61 1.13 -2.16 0.98 0.00 0.00 173.24 172.58 1maj s PRO 49 N 2.58 2.02 0.16 4.02 0.04 -1.26 -4.81 135.00 137.74 1maj s PRO 49 Ca 0.21 1.40 -0.06 0.00 0.04 0.00 0.00 61.00 62.59 1maj s PRO 49 Cb -0.15 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 1maj s PRO 49 CO 0.16 -1.86 0.21 -1.59 0.04 0.00 0.00 177.00 173.95 1maj s LYS 50 N -4.53 1.10 0.12 4.56 -2.85 -1.23 -5.07 119.74 111.84 1maj s LYS 50 Ca 0.66 -1.29 -0.22 0.00 -1.00 0.00 0.00 55.97 54.11 1maj s LYS 50 Cb -0.21 0.33 -0.07 0.00 -2.06 0.00 0.00 37.83 35.82 1maj s LYS 50 CO 0.52 -0.38 0.67 -1.17 0.10 0.00 0.00 175.35 175.09 1maj s LEU 51 N -3.01 4.56 0.00 2.77 2.96 -1.26 -3.55 118.68 121.14 1maj s LEU 51 Ca 0.21 1.45 0.00 0.00 -0.22 0.00 0.00 54.13 55.57 1maj s LEU 51 Cb 0.05 -3.10 0.00 0.00 0.50 0.00 0.00 46.19 43.64 1maj s LEU 51 CO 0.02 0.24 0.00 0.18 -1.32 0.00 0.00 176.35 175.47 1maj n LEU 52 N 1.63 0.13 -4.53 -0.68 7.99 -0.56 -4.66 117.00 116.31 1maj n LEU 52 Ca -0.08 0.07 -0.26 0.00 -0.01 0.00 0.00 56.01 55.73 1maj n LEU 52 Cb 0.50 -0.38 -0.10 0.00 -0.11 0.00 0.00 43.42 43.32 1maj n LEU 52 CO 0.44 -0.38 -0.39 -0.63 -1.51 0.00 0.00 177.39 174.92 1maj s ILE 53 N -0.76 2.23 0.08 -0.08 -1.09 -1.25 -1.43 121.20 118.90 1maj s ILE 53 Ca 0.00 -2.21 -0.20 0.00 -2.23 0.00 0.00 60.65 56.00 1maj s ILE 53 Cb 0.00 -2.62 0.05 0.00 -1.58 0.00 0.00 42.46 38.31 1maj s ILE 53 CO 0.00 -0.22 0.49 -0.72 -1.23 0.00 0.00 174.94 173.26 1maj s TYR 54 N -2.62 -0.36 -0.88 3.97 1.13 -1.25 -0.48 117.35 116.85 1maj s TYR 54 Ca 0.32 0.29 0.00 0.00 -1.41 0.00 0.00 57.07 56.28 1maj s TYR 54 Cb 0.02 0.33 0.00 0.00 -1.10 0.00 0.00 41.96 41.21 1maj s TYR 54 CO 0.16 -0.67 0.00 1.63 -2.51 0.00 0.00 175.55 174.16 1maj n LYS 55 N 0.20 -1.48 -1.64 -3.49 5.02 -0.74 -3.60 118.16 112.43 1maj n LYS 55 Ca -0.18 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 56.60 1maj n LYS 55 Cb 0.61 -4.75 0.00 0.00 -0.02 0.00 0.00 35.03 30.88 1maj n LYS 55 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1maj n VAL 56 N -1.93 -6.89 -4.09 -0.18 0.31 -0.31 -4.51 118.33 100.74 1maj n VAL 56 Ca -0.09 2.42 -0.40 0.00 -0.01 0.00 0.00 64.34 66.26 1maj n VAL 56 Cb 0.35 -3.60 -0.01 0.00 -0.91 0.00 0.00 33.84 29.67 1maj n VAL 56 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1maj n SER 57 N 0.70 -2.77 0.00 4.52 3.41 0.32 -4.85 113.62 114.95 1maj n SER 57 Ca 0.00 -1.25 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 1maj n SER 57 Cb 0.00 -1.93 0.00 0.00 -0.26 0.00 0.00 64.21 62.02 1maj n SER 57 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1maj n ASN 58 N -2.44 3.08 -2.65 4.04 5.03 -1.24 -4.97 115.26 116.11 1maj n ASN 58 Ca -0.18 0.00 -0.04 0.00 0.87 0.00 0.00 54.58 55.24 1maj n ASN 58 Cb 0.61 0.56 -0.03 0.00 -1.02 0.00 0.00 39.78 39.90 1maj n ASN 58 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1maj n ARG 59 N -1.01 -3.77 -0.68 3.52 1.74 -1.26 -4.89 116.66 110.31 1maj n ARG 59 Ca 0.00 2.87 -0.31 0.00 -0.77 0.00 0.00 57.85 59.64 1maj n ARG 59 Cb 0.05 -3.88 0.17 0.00 -1.02 0.00 0.00 32.46 27.78 1maj n ARG 59 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1maj s PHE 60 N -0.48 1.59 -0.22 -1.55 5.36 -0.51 -4.74 117.98 117.43 1maj s PHE 60 Ca -0.18 1.79 -0.32 0.00 -0.96 0.00 0.00 56.93 57.27 1maj s PHE 60 Cb 0.01 -3.35 -0.08 0.00 -0.34 0.00 0.00 43.02 39.26 1maj s PHE 60 CO 0.48 -2.86 2.14 -1.13 -1.46 0.00 0.00 175.22 172.39 1maj n SER 61 N -4.27 3.00 0.00 6.13 3.41 -1.26 -0.88 113.62 119.75 1maj n SER 61 Ca 0.12 0.45 0.00 0.00 -0.26 0.00 0.00 58.87 59.18 1maj n SER 61 Cb 0.52 -1.43 0.00 0.00 -0.26 0.00 0.00 64.21 63.04 1maj n SER 61 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1maj n GLY 62 N 5.69 1.21 3.18 5.00 0.00 -1.26 -5.03 105.19 113.97 1maj n GLY 62 Ca 0.32 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.00 3.42 0.79 1.61 1.01 -0.06 -5.09 120.40 120.08 1maj s VAL 63 Ca 0.00 -1.66 -0.14 0.00 0.00 0.00 0.00 61.98 60.18 1maj s VAL 63 Cb 0.00 -3.16 0.06 0.00 0.00 0.00 0.00 36.38 33.29 1maj s VAL 63 CO 0.00 -0.45 1.17 -2.65 0.00 0.00 0.00 175.10 173.17 1maj n PRO 64 N 4.68 0.30 0.19 2.72 -0.02 -1.26 -4.76 135.00 136.86 1maj n PRO 64 Ca -0.08 0.18 0.06 0.00 -2.02 0.00 0.00 63.50 61.64 1maj n PRO 64 Cb 0.42 -2.41 0.33 0.00 -0.02 0.00 0.00 33.50 31.82 1maj n PRO 64 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1maj h ASP 65 N -0.70 0.00 -0.90 2.55 5.19 -2.00 -1.60 116.42 118.95 1maj h ASP 65 Ca -0.47 0.00 0.20 0.00 -0.62 0.00 0.00 57.03 56.15 1maj h ASP 65 Cb 1.31 0.00 -0.07 0.00 0.18 0.00 0.00 39.33 40.75 1maj h ASP 65 CO 0.46 0.00 0.60 -0.09 -3.12 0.00 0.00 179.24 177.09 1maj h ARG 66 N 0.00 0.40 -5.52 3.56 9.65 -1.93 -3.40 114.38 117.14 1maj h ARG 66 Ca 0.00 -0.02 -0.59 0.00 -1.10 0.00 0.00 59.98 58.27 1maj h ARG 66 Cb 0.86 -0.09 -0.10 0.00 -1.39 0.00 0.00 29.97 29.25 1maj h ARG 66 CO 0.00 0.26 -0.28 -0.06 2.80 0.00 0.00 179.97 182.70 1maj s PHE 67 N -5.43 3.45 -0.38 2.20 0.40 -0.61 -2.12 117.98 115.50 1maj s PHE 67 Ca -0.08 0.65 0.01 0.00 -0.60 0.00 0.00 56.93 56.90 1maj s PHE 67 Cb 0.23 -2.41 0.12 0.00 0.51 0.00 0.00 43.02 41.47 1maj s PHE 67 CO 0.78 0.18 0.19 -1.12 0.70 0.00 0.00 175.22 175.95 1maj s SER 68 N 0.60 3.68 -0.55 1.36 0.01 -0.85 -4.83 113.70 113.12 1maj s SER 68 Ca 0.18 -2.23 -0.25 0.00 1.31 0.00 0.00 55.95 54.96 1maj s SER 68 Cb -0.14 -0.89 0.04 0.00 0.21 0.00 0.00 66.02 65.24 1maj s SER 68 CO 0.06 -0.32 1.00 -0.83 0.41 0.00 0.00 173.24 173.55 1maj s GLY 69 N 0.88 1.35 0.37 3.44 0.00 -1.26 -3.04 107.32 109.05 1maj s GLY 69 Ca 0.15 -1.10 0.02 0.00 0.00 0.00 0.00 44.72 43.79 1maj s GLY 69 CO -0.08 2.16 0.17 1.44 0.00 0.00 0.00 173.10 176.79 1maj n SER 70 N 7.67 2.49 0.00 1.64 7.64 -0.91 0.12 113.62 132.26 1maj n SER 70 Ca 0.04 -2.39 0.00 0.00 1.01 0.00 0.00 58.87 57.53 1maj n SER 70 Cb 0.48 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.75 1maj n SER 70 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1maj n GLY 71 N 0.59 2.64 2.89 0.23 0.00 -1.25 -1.65 105.19 108.65 1maj n GLY 71 Ca -0.06 0.11 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1maj n GLY 71 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1maj n SER 72 N 0.00 6.50 0.00 1.61 2.88 -1.12 -4.86 113.62 118.63 1maj n SER 72 Ca 0.00 -3.41 0.00 0.00 -1.33 0.00 0.00 58.87 54.13 1maj n SER 72 Cb 0.00 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.18 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 1.28 1.33 1.23 0.46 0.00 -1.26 -4.61 105.19 103.62 1maj n GLY 73 Ca 0.33 -0.98 0.11 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 0.96 -4.86 2.61 -2.24 -1.26 -3.84 114.28 105.66 1maj n THR 74 Ca 0.00 -0.98 -0.33 0.00 -2.27 0.00 0.00 64.05 60.47 1maj n THR 74 Cb 0.00 0.53 -0.13 0.00 -2.10 0.00 0.00 70.33 68.63 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 -1.03 4.10 0.06 3.42 -4.77 -1.26 -1.17 116.67 116.01 1maj s ASP 75 Ca 0.44 -0.18 -0.11 0.00 -3.30 0.00 0.00 52.55 49.41 1maj s ASP 75 Cb 0.23 -0.92 0.01 0.00 -1.09 0.00 0.00 42.92 41.15 1maj s ASP 75 CO 0.31 0.34 0.23 -0.36 0.70 0.00 0.00 175.17 176.38 1maj s PHE 76 N -0.69 0.03 0.02 2.11 0.08 -0.54 -2.80 117.98 116.19 1maj s PHE 76 Ca 0.10 -0.28 -0.15 0.00 0.12 0.00 0.00 56.93 56.73 1maj s PHE 76 Cb -0.11 0.01 0.02 0.00 -0.57 0.00 0.00 43.02 42.37 1maj s PHE 76 CO 0.01 -0.49 0.32 0.99 -0.10 0.00 0.00 175.22 175.95 1maj s THR 77 N -2.92 0.07 -0.53 0.64 2.01 -0.66 -1.48 115.64 112.78 1maj s THR 77 Ca -0.02 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1maj s THR 77 Cb 0.01 -0.80 0.14 0.00 0.01 0.00 0.00 72.50 71.85 1maj s THR 77 CO -0.06 -0.32 0.30 -0.22 -0.69 0.00 0.00 174.62 173.64 1maj s LEU 78 N -1.74 4.88 -0.17 4.42 0.20 -0.37 -2.15 118.68 123.75 1maj s LEU 78 Ca -0.09 -2.72 -0.18 0.00 0.69 0.00 0.00 54.13 51.84 1maj s LEU 78 Cb -0.03 -1.75 -0.04 0.00 -0.43 0.00 0.00 46.19 43.94 1maj s LEU 78 CO 0.00 -0.35 0.48 -0.54 -0.29 0.00 0.00 176.35 175.65 1maj s LYS 79 N 0.13 4.25 -0.11 1.98 1.02 -1.17 -1.59 119.74 124.26 1maj s LYS 79 Ca 0.15 0.39 0.01 0.00 0.02 0.00 0.00 55.97 56.54 1maj s LYS 79 Cb -0.22 -3.50 -0.02 0.00 -0.52 0.00 0.00 37.83 33.57 1maj s LYS 79 CO -0.03 0.00 -0.14 0.42 -0.92 0.00 0.00 175.35 174.68 1maj s ILE 80 N 1.14 3.00 0.00 2.17 1.01 0.14 -2.00 121.20 126.66 1maj s ILE 80 Ca 0.24 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 60.19 1maj s ILE 80 Cb -0.15 -2.23 0.00 0.00 0.01 0.00 0.00 42.46 40.09 1maj s ILE 80 CO 0.09 0.54 0.81 -1.20 0.00 0.00 0.00 174.94 175.19 1maj n SER 81 N 3.22 0.00 -3.94 3.58 7.64 -0.90 -1.80 113.62 121.42 1maj n SER 81 Ca -0.18 0.81 -0.31 0.00 1.01 0.00 0.00 58.87 60.21 1maj n SER 81 Cb 0.53 -0.32 -0.15 0.00 -1.01 0.00 0.00 64.21 63.26 1maj n SER 81 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1maj s ARG 82 N -2.26 1.29 0.49 1.43 1.70 -1.26 -3.09 118.95 117.26 1maj s ARG 82 Ca 0.00 -1.63 -0.22 0.00 -0.47 0.00 0.00 55.73 53.41 1maj s ARG 82 Cb 0.00 -2.86 -0.08 0.00 -0.57 0.00 0.00 34.95 31.44 1maj s ARG 82 CO 0.00 -0.94 1.03 0.28 -1.08 0.00 0.00 175.30 174.59 1maj n VAL 83 N 4.43 2.93 -4.52 4.99 0.31 -1.01 -4.62 118.33 120.84 1maj n VAL 83 Ca 0.02 -0.50 -0.25 0.00 -0.01 0.00 0.00 64.34 63.60 1maj n VAL 83 Cb 0.42 -1.22 -0.10 0.00 -0.91 0.00 0.00 33.84 32.03 1maj n VAL 83 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1maj s GLU 84 N -2.33 1.82 0.54 5.55 0.41 -1.26 -1.76 118.70 121.66 1maj s GLU 84 Ca 0.68 -2.06 0.25 0.00 -0.41 0.00 0.00 54.97 53.43 1maj s GLU 84 Cb -0.49 -0.99 1.41 0.00 -1.78 0.00 0.00 34.13 32.28 1maj s GLU 84 CO 0.53 -0.26 2.00 0.00 -0.49 0.00 0.00 175.26 177.04 1maj h ALA 85 N 1.90 2.46 -0.55 5.21 0.00 -1.95 -0.82 119.26 125.51 1maj h ALA 85 Ca -0.40 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.40 1maj h ALA 85 Cb 1.26 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 1maj h ALA 85 CO 0.69 -0.64 0.00 0.93 0.00 0.00 0.00 179.25 180.23 1maj h GLU 86 N 0.00 0.97 -0.84 0.00 4.39 -2.01 -2.72 114.58 114.37 1maj h GLU 86 Ca 0.24 -0.31 0.21 0.00 0.34 0.00 0.00 59.36 59.84 1maj h GLU 86 Cb 0.99 -0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 29.50 1maj h GLU 86 CO -0.00 0.97 0.57 -0.44 -1.16 0.00 0.00 179.01 178.95 1maj h ASP 87 N 0.85 0.26 -2.22 1.42 5.19 -1.54 -3.42 116.42 116.96 1maj h ASP 87 Ca 0.16 0.02 -0.60 0.00 -0.62 0.00 0.00 57.03 55.99 1maj h ASP 87 Cb 0.54 -0.02 0.06 0.00 0.18 0.00 0.00 39.33 40.08 1maj h ASP 87 CO 0.03 0.11 0.69 0.18 -3.12 0.00 0.00 179.24 177.13 1maj n LEU 88 N -4.43 2.80 0.00 1.55 4.77 -1.03 -4.68 117.00 115.98 1maj n LEU 88 Ca 0.17 1.10 0.00 0.00 -0.03 0.00 0.00 56.01 57.25 1maj n LEU 88 Cb 0.73 -1.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.44 1maj n LEU 88 CO 0.34 -0.48 0.00 0.61 -1.33 0.00 0.00 177.39 176.52 1maj n GLY 89 N 3.02 -0.01 2.98 -0.72 0.00 -0.71 -4.40 105.19 105.34 1maj n GLY 89 Ca 0.16 -0.89 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 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 -4.00 1.48 0.34 -0.61 1.09 -0.53 -0.72 121.20 118.25 1maj s ILE 90 Ca 0.00 -0.78 -0.09 0.00 -1.10 0.00 0.00 60.65 58.68 1maj s ILE 90 Cb 0.00 -1.52 -0.06 0.00 -1.06 0.00 0.00 42.46 39.82 1maj s ILE 90 CO 0.00 0.25 0.68 -0.31 -0.10 0.00 0.00 174.94 175.46 1maj s TYR 91 N 1.49 3.46 0.38 3.97 2.02 0.16 -0.78 117.35 128.05 1maj s TYR 91 Ca 0.01 0.92 -0.09 0.00 -0.37 0.00 0.00 57.07 57.54 1maj s TYR 91 Cb -0.15 -2.33 0.04 0.00 -0.40 0.00 0.00 41.96 39.12 1maj s TYR 91 CO -0.09 0.04 0.67 -0.06 -1.57 0.00 0.00 175.55 174.54 1maj s PHE 92 N -2.18 0.59 0.09 2.71 0.08 -0.55 -2.46 117.98 116.25 1maj s PHE 92 Ca 0.49 -1.08 -0.26 0.00 0.12 0.00 0.00 56.93 56.19 1maj s PHE 92 Cb -0.10 0.44 0.08 0.00 -0.57 0.00 0.00 43.02 42.87 1maj s PHE 92 CO 0.28 -1.43 0.84 0.00 -0.10 0.00 0.00 175.22 174.82 1maj n SER 94 N -0.34 -0.43 -3.68 0.00 2.88 -0.84 -2.49 113.62 108.72 1maj n SER 94 Ca -0.09 -1.67 -0.27 0.00 -1.33 0.00 0.00 58.87 55.50 1maj n SER 94 Cb 0.62 0.82 -0.16 0.00 -0.75 0.00 0.00 64.21 64.74 1maj n SER 94 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1maj s GLN 95 N -2.31 0.43 -0.10 -1.46 -2.07 -1.26 -2.47 119.66 110.41 1maj s GLN 95 Ca 0.11 -0.39 -0.02 0.00 -1.82 0.00 0.00 55.36 53.24 1maj s GLN 95 Cb -0.00 -1.92 -0.03 0.00 -1.09 0.00 0.00 33.01 29.97 1maj s GLN 95 CO 0.08 -0.72 2.53 2.41 -1.32 0.00 0.00 175.29 178.27 1maj n THR 96 N 5.12 2.55 -0.00 3.63 -1.04 0.24 -3.99 114.28 120.79 1maj n THR 96 Ca -0.07 -1.24 -0.04 0.00 -2.04 0.00 0.00 64.05 60.66 1maj n THR 96 Cb 0.47 -1.62 -0.01 0.00 -1.82 0.00 0.00 70.33 67.35 1maj n THR 96 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1maj n THR 97 N 1.50 1.16 -2.39 12.58 -1.04 -1.23 -4.74 114.28 120.12 1maj n THR 97 Ca 0.22 0.25 -0.24 0.00 -2.04 0.00 0.00 64.05 62.24 1maj n THR 97 Cb 0.64 -1.77 0.07 0.00 -1.82 0.00 0.00 70.33 67.44 1maj n THR 97 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1maj s HIS 98 N -2.24 2.59 -0.00 -1.42 3.76 -1.26 -5.05 115.29 111.67 1maj s HIS 98 Ca -0.09 0.16 0.00 0.00 -0.15 0.00 0.00 55.06 54.99 1maj s HIS 98 Cb 0.02 -3.07 0.00 0.00 1.11 0.00 0.00 32.58 30.64 1maj s HIS 98 CO 0.13 -1.36 -0.01 0.08 -0.85 0.00 0.00 174.74 172.73 1maj s VAL 99 N -3.11 0.08 0.50 -0.90 1.01 -1.26 -3.20 120.40 113.52 1maj s VAL 99 Ca 0.61 -0.02 -0.21 0.00 0.00 0.00 0.00 61.98 62.36 1maj s VAL 99 Cb -0.09 -0.09 -0.07 0.00 0.00 0.00 0.00 36.38 36.13 1maj s VAL 99 CO 0.43 0.03 1.11 -2.16 0.00 0.00 0.00 175.10 174.52 1maj s PRO 100 N 0.11 3.62 -0.17 2.72 0.04 -1.26 0.61 135.00 140.68 1maj s PRO 100 Ca -0.01 1.59 -0.29 0.00 0.04 0.00 0.00 61.00 62.33 1maj s PRO 100 Cb -0.02 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 32.30 1maj s PRO 100 CO -0.00 -0.62 2.01 -1.25 0.04 0.00 0.00 177.00 177.17 1maj s PRO 101 N -3.06 3.52 -1.08 0.56 0.04 -1.19 -3.31 135.00 130.47 1maj s PRO 101 Ca 0.68 2.05 -0.22 0.00 0.04 0.00 0.00 61.00 63.55 1maj s PRO 101 Cb -0.23 -4.24 0.04 0.00 0.04 0.00 0.00 34.50 30.10 1maj s PRO 101 CO 0.27 -1.65 1.58 0.95 0.04 0.00 0.00 177.00 178.19 1maj s THR 102 N 6.66 3.91 -0.43 1.26 -4.23 -1.26 -4.94 115.64 116.60 1maj s THR 102 Ca 0.90 -0.99 -0.26 0.00 -1.18 0.00 0.00 61.69 60.16 1maj s THR 102 Cb -0.33 -4.97 0.02 0.00 1.34 0.00 0.00 72.50 68.56 1maj s THR 102 CO 0.36 -1.83 0.98 0.12 -0.54 0.00 0.00 174.62 173.71 1maj s PHE 103 N 5.53 2.95 0.00 3.99 2.19 -1.26 -4.28 117.98 127.10 1maj s PHE 103 Ca 0.51 0.59 0.00 0.00 0.33 0.00 0.00 56.93 58.36 1maj s PHE 103 Cb 0.00 -3.98 0.00 0.00 -1.31 0.00 0.00 43.02 37.73 1maj s PHE 103 CO -0.04 -1.05 0.00 0.41 1.83 0.00 0.00 175.22 176.37 1maj n GLY 104 N 4.73 3.24 0.00 13.12 0.00 -1.04 -5.02 105.19 120.21 1maj n GLY 104 Ca 0.08 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.91 1.90 0.00 -0.02 0.00 -1.26 -4.44 105.19 100.47 1maj n GLY 105 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 0.02 3.10 -0.02 0.00 -1.25 -4.75 105.19 102.29 1maj n GLY 106 Ca 0.00 0.65 0.01 0.00 0.00 0.00 0.00 46.02 46.69 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 -0.92 0.36 2.61 2.01 -1.03 -3.82 115.64 114.84 1maj s THR 107 Ca 0.00 -0.04 -0.06 0.00 0.31 0.00 0.00 61.69 61.90 1maj s THR 107 Cb 0.00 -0.98 -0.05 0.00 0.01 0.00 0.00 72.50 71.48 1maj s THR 107 CO 0.00 -0.04 0.66 -1.59 -0.69 0.00 0.00 174.62 172.95 1maj s LYS 108 N 2.78 3.64 -0.36 4.92 -2.85 -0.26 0.39 119.74 128.00 1maj s LYS 108 Ca 0.14 0.14 0.00 0.00 -1.00 0.00 0.00 55.97 55.25 1maj s LYS 108 Cb -0.12 -2.53 0.12 0.00 -2.06 0.00 0.00 37.83 33.24 1maj s LYS 108 CO -0.24 0.06 0.18 -1.17 0.10 0.00 0.00 175.35 174.28 1maj s LEU 109 N -3.93 1.87 -0.40 2.77 2.96 0.10 0.28 118.68 122.33 1maj s LEU 109 Ca 0.46 -2.08 0.05 0.00 -0.22 0.00 0.00 54.13 52.34 1maj s LEU 109 Cb -0.10 -0.74 0.56 0.00 0.50 0.00 0.00 46.19 46.40 1maj s LEU 109 CO 0.34 -0.34 1.69 -1.84 -1.32 0.00 0.00 176.35 174.88 1maj n GLU 110 N 4.23 2.22 -1.34 1.98 0.28 -1.26 -1.73 120.64 125.02 1maj n GLU 110 Ca 0.05 -3.21 0.17 0.00 -0.16 0.00 0.00 57.16 54.02 1maj n GLU 110 Cb 0.38 -2.05 -0.06 0.00 1.43 0.00 0.00 31.44 31.14 1maj n GLU 110 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 177.13 178.48 1maj n ILE 111 N -1.08 0.00 -2.62 3.84 3.06 -1.26 -4.78 119.36 116.52 1maj n ILE 111 Ca 0.48 0.43 -0.40 0.00 -2.50 0.00 0.00 62.75 60.76 1maj n ILE 111 Cb 1.23 -0.89 -0.05 0.00 0.54 0.00 0.00 39.64 40.48 1maj n ILE 111 CO 0.00 0.00 0.00 -0.75 -2.50 0.00 0.00 176.55 173.30 1maj s LYS 112 N -3.13 4.73 0.00 9.51 2.20 0.24 -3.35 119.74 129.93 1maj s LYS 112 Ca 0.00 1.63 0.03 0.00 -0.36 0.00 0.00 55.97 57.27 1maj s LYS 112 Cb 0.00 -3.26 0.03 0.00 -1.51 0.00 0.00 37.83 33.08 1maj s LYS 112 CO 0.00 0.31 0.60 0.54 -0.36 0.00 0.00 175.35 176.44