#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 4.26 0.05 2.12 1.01 -1.26 -5.01 120.40 121.56 1maj s VAL 2 Ca 0.00 -0.84 -0.31 0.00 0.00 0.00 0.00 61.98 60.84 1maj s VAL 2 Cb 0.00 -3.32 -0.08 0.00 0.00 0.00 0.00 36.38 32.98 1maj s VAL 2 CO 0.00 -0.12 1.59 -0.69 0.00 0.00 0.00 175.10 175.88 1maj s VAL 3 N 1.51 3.21 -0.32 2.92 1.01 -1.26 -4.68 120.40 122.80 1maj s VAL 3 Ca 0.02 0.64 0.03 0.00 0.00 0.00 0.00 61.98 62.67 1maj s VAL 3 Cb -0.19 -3.41 0.09 0.00 0.00 0.00 0.00 36.38 32.87 1maj s VAL 3 CO 0.05 -0.00 0.02 -0.04 0.00 0.00 0.00 175.10 175.12 1maj s MET 4 N 2.61 1.61 0.25 2.72 -1.94 -1.26 -0.85 119.30 122.44 1maj s MET 4 Ca 0.71 -1.71 -0.00 0.00 -1.71 0.00 0.00 55.69 52.98 1maj s MET 4 Cb -0.38 -3.07 -0.04 0.00 2.01 0.00 0.00 34.83 33.35 1maj s MET 4 CO 0.31 -0.85 0.45 0.99 -0.01 0.00 0.00 175.02 175.90 1maj s THR 5 N 0.99 5.17 0.09 2.05 2.01 -0.94 -3.99 115.64 121.01 1maj s THR 5 Ca 0.06 -0.43 0.05 0.00 0.31 0.00 0.00 61.69 61.69 1maj s THR 5 Cb -0.19 -3.78 -0.03 0.00 0.01 0.00 0.00 72.50 68.50 1maj s THR 5 CO -0.08 -0.31 -0.14 -1.58 -0.69 0.00 0.00 174.62 171.82 1maj s GLN 6 N -3.70 0.88 0.08 4.92 0.74 -1.26 -1.76 119.66 119.56 1maj s GLN 6 Ca 0.39 -1.04 -0.23 0.00 0.05 0.00 0.00 55.36 54.53 1maj s GLN 6 Cb -0.10 -0.84 0.06 0.00 1.10 0.00 0.00 33.01 33.23 1maj s GLN 6 CO 0.31 0.18 0.56 0.95 -0.55 0.00 0.00 175.29 176.73 1maj s THR 7 N -1.56 0.02 1.00 -0.34 -4.23 -0.17 -4.67 115.64 105.70 1maj s THR 7 Ca 0.01 -0.16 -0.16 0.00 -1.18 0.00 0.00 61.69 60.20 1maj s THR 7 Cb -0.08 -1.01 0.21 0.00 1.34 0.00 0.00 72.50 72.95 1maj s THR 7 CO 0.02 -0.09 1.25 -2.16 -0.54 0.00 0.00 174.62 173.11 1maj s PRO 8 N -2.89 0.36 0.41 3.99 0.04 -1.26 0.17 135.00 135.81 1maj s PRO 8 Ca -0.03 -0.25 0.27 0.00 0.04 0.00 0.00 61.00 61.03 1maj s PRO 8 Cb -0.00 -1.80 0.87 0.00 0.04 0.00 0.00 34.50 33.61 1maj s PRO 8 CO -0.05 -2.63 1.78 -0.07 0.04 0.00 0.00 177.00 176.07 1maj h LEU 9 N -1.80 0.00 -7.15 -3.56 4.07 -1.85 -3.39 115.31 101.63 1maj h LEU 9 Ca -0.45 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 57.43 1maj h LEU 9 Cb 1.26 0.00 -0.22 0.00 1.08 0.00 0.00 40.66 42.78 1maj h LEU 9 CO 0.41 0.00 -0.04 -0.94 -1.08 0.00 0.00 178.44 176.79 1maj s SER 10 N -5.44 -0.59 -0.41 -0.43 1.04 -1.26 -0.34 113.70 106.27 1maj s SER 10 Ca 0.05 1.12 0.01 0.00 0.48 0.00 0.00 55.95 57.61 1maj s SER 10 Cb 0.08 1.13 0.13 0.00 0.10 0.00 0.00 66.02 67.46 1maj s SER 10 CO 0.57 -0.22 0.21 -0.22 0.98 0.00 0.00 173.24 174.56 1maj s LEU 11 N 0.20 2.35 -0.47 2.42 2.96 -0.82 -4.90 118.68 120.42 1maj s LEU 11 Ca -0.01 -2.41 -0.28 0.00 -0.22 0.00 0.00 54.13 51.22 1maj s LEU 11 Cb -0.04 -0.91 -0.01 0.00 0.50 0.00 0.00 46.19 45.73 1maj s LEU 11 CO 0.01 -0.30 1.73 -2.16 -1.32 0.00 0.00 176.35 174.32 1maj s PRO 12 N 0.66 3.10 0.00 0.98 0.04 -1.25 -3.73 135.00 134.80 1maj s PRO 12 Ca 0.17 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.16 1maj s PRO 12 Cb -0.23 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.07 1maj s PRO 12 CO -0.03 -2.15 0.00 1.33 0.04 0.00 0.00 177.00 176.19 1maj n VAL 13 N 7.24 0.00 -4.23 -0.36 0.24 -1.13 -4.73 118.33 115.36 1maj n VAL 13 Ca 0.20 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.36 1maj n VAL 13 Cb 0.49 -0.05 -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 0.77 1.65 -1.00 -1.34 0.15 -1.26 -0.68 113.70 111.99 1maj s SER 14 Ca 0.00 -0.99 -0.23 0.00 0.70 0.00 0.00 55.95 55.43 1maj s SER 14 Cb 0.00 0.01 0.00 0.00 -1.71 0.00 0.00 66.02 64.32 1maj s SER 14 CO 0.00 -0.34 1.69 -0.76 1.20 0.00 0.00 173.24 175.03 1maj s LEU 15 N -3.06 3.36 0.00 3.45 1.43 -1.26 -2.08 118.68 120.52 1maj s LEU 15 Ca 0.15 -1.20 0.00 0.00 -1.03 0.00 0.00 54.13 52.04 1maj s LEU 15 Cb 0.02 -2.57 0.00 0.00 0.03 0.00 0.00 46.19 43.68 1maj s LEU 15 CO -0.00 -2.07 0.00 0.61 0.23 0.00 0.00 176.35 175.12 1maj n GLY 16 N 6.74 0.16 3.12 -3.19 0.00 0.40 -4.94 105.19 107.48 1maj n GLY 16 Ca 0.37 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.22 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 1.33 -4.86 1.61 8.00 -0.88 -4.57 116.55 117.17 1maj n ASP 17 Ca 0.00 -2.04 -0.22 0.00 0.71 0.00 0.00 54.79 53.24 1maj n ASP 17 Cb 0.00 -0.45 0.09 0.00 -0.02 0.00 0.00 41.12 40.74 1maj n ASP 17 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1maj s GLN 18 N -4.38 1.94 0.18 -1.24 1.11 -1.24 -0.62 119.66 115.41 1maj s GLN 18 Ca 0.51 -1.48 -0.16 0.00 0.01 0.00 0.00 55.36 54.24 1maj s GLN 18 Cb -0.03 -2.50 0.03 0.00 -1.01 0.00 0.00 33.01 29.49 1maj s GLN 18 CO 0.33 -1.20 0.48 0.00 0.01 0.00 0.00 175.29 174.92 1maj s ALA 19 N -2.91 -0.83 -0.34 6.09 0.00 0.33 -4.79 121.76 119.31 1maj s ALA 19 Ca 0.65 -0.26 0.05 0.00 0.00 0.00 0.00 51.96 52.39 1maj s ALA 19 Cb -0.05 0.83 0.17 0.00 0.00 0.00 0.00 23.12 24.07 1maj s ALA 19 CO 0.42 -0.76 0.50 -1.12 0.00 0.00 0.00 175.76 174.80 1maj s SER 20 N -2.87 -0.42 0.64 0.00 0.01 -1.26 -0.48 113.70 109.32 1maj s SER 20 Ca 0.09 -0.63 -0.08 0.00 1.31 0.00 0.00 55.95 56.65 1maj s SER 20 Cb -0.00 1.43 0.02 0.00 0.21 0.00 0.00 66.02 67.68 1maj s SER 20 CO -0.04 -0.27 0.98 -0.63 0.41 0.00 0.00 173.24 173.68 1maj s ILE 21 N 2.17 3.35 0.11 1.44 1.01 -0.04 -4.81 121.20 124.44 1maj s ILE 21 Ca 0.13 0.08 0.05 0.00 0.00 0.00 0.00 60.65 60.91 1maj s ILE 21 Cb -0.10 -3.38 -0.04 0.00 0.01 0.00 0.00 42.46 38.96 1maj s ILE 21 CO -0.17 -0.42 -0.12 -0.44 0.00 0.00 0.00 174.94 173.78 1maj s SER 22 N -4.36 1.73 -0.28 3.58 0.01 0.45 -1.75 113.70 113.08 1maj s SER 22 Ca 0.56 -0.79 -0.14 0.00 1.31 0.00 0.00 55.95 56.89 1maj s SER 22 Cb -0.11 -0.03 0.10 0.00 0.21 0.00 0.00 66.02 66.18 1maj s SER 22 CO 0.47 -0.19 0.66 0.00 0.41 0.00 0.00 173.24 174.59 1maj s ARG 24 N 2.06 1.68 -0.20 0.00 0.52 -0.72 -0.61 118.95 121.67 1maj s ARG 24 Ca -0.08 -1.18 -0.05 0.00 -0.52 0.00 0.00 55.73 53.89 1maj s ARG 24 Cb -0.08 -1.95 -0.03 0.00 0.52 0.00 0.00 34.95 33.42 1maj s ARG 24 CO -0.19 0.49 0.01 -1.54 0.02 0.00 0.00 175.30 174.09 1maj s SER 25 N -1.48 4.97 0.00 0.23 1.04 -0.41 -2.21 113.70 115.84 1maj s SER 25 Ca 0.12 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.39 1maj s SER 25 Cb -0.10 -1.85 0.00 0.00 0.10 0.00 0.00 66.02 64.17 1maj s SER 25 CO 0.03 0.07 0.88 -0.24 0.98 0.00 0.00 173.24 174.97 1maj n SER 26 N 4.18 2.52 0.00 7.02 2.88 -0.03 -4.37 113.62 125.81 1maj n SER 26 Ca -0.17 -1.54 0.00 0.00 -1.33 0.00 0.00 58.87 55.83 1maj n SER 26 Cb 0.52 -0.46 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 1maj n SER 26 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1maj n GLN 27 N 0.93 0.00 0.00 -1.46 -0.06 -1.26 -4.76 117.38 110.77 1maj n GLN 27 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1maj n GLN 27 Cb 0.35 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.53 1maj n GLN 27 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 1maj n SER 28 N -0.41 0.00 -1.43 1.69 2.88 -1.26 -4.90 113.62 110.19 1maj n SER 28 Ca 0.00 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.45 1maj n SER 28 Cb 0.00 0.00 0.19 0.00 -0.75 0.00 0.00 64.21 63.65 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 4.76 -4.71 2.46 4.77 -1.20 -4.94 117.00 118.14 1maj n LEU 29 Ca 0.00 -3.76 -0.31 0.00 -0.03 0.00 0.00 56.01 51.91 1maj n LEU 29 Cb 0.00 -0.69 -0.08 0.00 -2.33 0.00 0.00 43.42 40.32 1maj n LEU 29 CO 0.00 1.23 -0.31 -0.69 -1.33 0.00 0.00 177.39 176.29 1maj s VAL 30 N -3.27 4.25 0.36 4.08 1.01 -1.25 -1.38 120.40 124.20 1maj s VAL 30 Ca 0.48 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.80 1maj s VAL 30 Cb 0.43 -2.97 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 1maj s VAL 30 CO 0.02 0.25 0.37 -2.28 0.00 0.00 0.00 175.10 173.46 1maj s HIS 31 N -1.22 2.91 0.52 5.22 2.46 -1.26 -4.93 115.29 118.98 1maj s HIS 31 Ca 0.24 -0.32 0.35 0.00 0.47 0.00 0.00 55.06 55.79 1maj s HIS 31 Cb -0.12 -1.96 1.50 0.00 -0.13 0.00 0.00 32.58 31.87 1maj s HIS 31 CO 0.15 0.03 1.77 1.03 -2.47 0.00 0.00 174.74 175.26 1maj h SER 32 N 1.07 0.08 -0.01 9.88 0.87 -2.00 -2.66 113.55 120.78 1maj h SER 32 Ca -0.44 0.02 -0.16 0.00 -1.23 0.00 0.00 61.79 59.98 1maj h SER 32 Cb 1.26 0.01 -0.27 0.00 -0.44 0.00 0.00 62.40 62.96 1maj h SER 32 CO 0.56 0.00 -0.69 -0.46 -0.53 0.00 0.00 176.83 175.71 1maj n ASN 33 N -4.25 0.08 0.00 6.23 6.94 -1.26 -5.08 115.26 117.91 1maj n ASN 33 Ca 0.28 -2.01 0.00 0.00 -0.02 0.00 0.00 54.58 52.83 1maj n ASN 33 Cb 1.26 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 38.67 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 0.19 0.53 0.00 4.83 0.00 -1.00 -5.14 105.19 104.59 1maj n GLY 34 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1maj n GLY 34 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1maj n ASN 35 N 0.00 0.00 -3.35 1.61 3.02 -1.26 -4.77 115.26 110.51 1maj n ASN 35 Ca 0.00 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.40 1maj n ASN 35 Cb 0.00 0.00 -0.08 0.00 -0.61 0.00 0.00 39.78 39.09 1maj n ASN 35 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1maj s THR 36 N 0.78 -0.44 0.23 3.41 2.01 -1.25 -3.88 115.64 116.49 1maj s THR 36 Ca 0.00 -0.67 -0.22 0.00 0.31 0.00 0.00 61.69 61.11 1maj s THR 36 Cb 0.00 -0.79 -0.08 0.00 0.01 0.00 0.00 72.50 71.64 1maj s THR 36 CO 0.00 -0.47 0.77 -0.31 -0.69 0.00 0.00 174.62 173.92 1maj s TYR 37 N 1.92 3.69 -0.18 4.92 2.02 -0.48 -4.58 117.35 124.67 1maj s TYR 37 Ca 0.13 1.50 -0.28 0.00 -0.37 0.00 0.00 57.07 58.05 1maj s TYR 37 Cb -0.14 -2.70 0.11 0.00 -0.40 0.00 0.00 41.96 38.83 1maj s TYR 37 CO -0.17 0.34 0.90 -1.17 -1.57 0.00 0.00 175.55 173.88 1maj s LEU 38 N -1.87 -0.50 0.09 -1.29 2.96 -1.26 -4.43 118.68 112.37 1maj s LEU 38 Ca 0.43 0.73 0.02 0.00 -0.22 0.00 0.00 54.13 55.09 1maj s LEU 38 Cb -0.18 2.10 -0.04 0.00 0.50 0.00 0.00 46.19 48.57 1maj s LEU 38 CO 0.22 -0.34 -0.07 0.20 -1.32 0.00 0.00 176.35 175.03 1maj s ASN 39 N -0.60 1.13 0.05 3.68 -0.87 -0.23 -1.89 114.94 116.20 1maj s ASN 39 Ca -0.02 -0.87 0.01 0.00 -1.57 0.00 0.00 52.86 50.41 1maj s ASN 39 Cb -0.02 0.07 -0.03 0.00 -0.02 0.00 0.00 41.25 41.25 1maj s ASN 39 CO 0.01 -0.37 -0.06 0.26 -2.57 0.00 0.00 177.10 174.37 1maj s TRP 40 N -2.90 0.59 0.04 2.20 0.52 0.19 -0.80 118.94 118.78 1maj s TRP 40 Ca 0.06 -0.63 -0.07 0.00 0.02 0.00 0.00 56.10 55.48 1maj s TRP 40 Cb 0.00 -0.37 -0.01 0.00 -1.15 0.00 0.00 33.47 31.95 1maj s TRP 40 CO -0.03 -0.15 0.12 0.71 0.02 0.00 0.00 176.95 177.63 1maj s TYR 41 N -2.03 0.15 -0.26 -1.98 1.51 0.24 -3.10 117.35 111.89 1maj s TYR 41 Ca -0.06 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.58 1maj s TYR 41 Cb -0.06 -0.11 0.08 0.00 -0.11 0.00 0.00 41.96 41.76 1maj s TYR 41 CO -0.02 -0.38 0.01 -1.17 -1.11 0.00 0.00 175.55 172.89 1maj s LEU 42 N -2.06 2.65 -0.46 -1.29 2.96 -1.26 -0.54 118.68 118.68 1maj s LEU 42 Ca -0.06 -1.40 -0.28 0.00 -0.22 0.00 0.00 54.13 52.18 1maj s LEU 42 Cb -0.02 -1.10 -0.02 0.00 0.50 0.00 0.00 46.19 45.56 1maj s LEU 42 CO -0.04 -0.31 1.77 -1.10 -1.32 0.00 0.00 176.35 175.35 1maj s GLN 43 N 1.43 3.08 0.00 1.98 1.11 0.25 -4.89 119.66 122.61 1maj s GLN 43 Ca 0.01 1.03 0.00 0.00 0.01 0.00 0.00 55.36 56.41 1maj s GLN 43 Cb -0.18 -4.25 0.00 0.00 -1.01 0.00 0.00 33.01 27.57 1maj s GLN 43 CO -0.11 -2.18 0.00 1.17 0.01 0.00 0.00 175.29 174.18 1maj n LYS 44 N 8.69 2.95 0.00 2.91 3.00 -1.26 -2.80 118.16 131.65 1maj n LYS 44 Ca 0.21 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.52 1maj n LYS 44 Cb 0.49 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.52 1maj n LYS 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1maj n ALA 45 N -3.00 0.00 -1.20 3.14 0.00 -1.26 -4.66 120.51 113.53 1maj n ALA 45 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 1maj n ALA 45 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.33 1maj n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1maj n GLY 46 N 4.77 3.55 3.87 0.00 0.00 -1.26 -4.91 105.19 111.21 1maj n GLY 46 Ca 0.00 -1.48 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 1maj n GLY 46 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1maj s GLN 47 N 0.01 3.84 -0.17 1.61 0.74 -1.26 -5.03 119.66 119.41 1maj s GLN 47 Ca 0.64 0.35 -0.14 0.00 0.05 0.00 0.00 55.36 56.26 1maj s GLN 47 Cb 0.34 -2.62 -0.08 0.00 1.10 0.00 0.00 33.01 31.74 1maj s GLN 47 CO -0.08 0.30 -0.08 0.43 -0.55 0.00 0.00 175.29 175.30 1maj n SER 48 N -0.14 1.84 -4.76 6.67 7.64 -1.26 -4.93 113.62 118.67 1maj n SER 48 Ca 0.01 0.55 -0.39 0.00 1.01 0.00 0.00 58.87 60.04 1maj n SER 48 Cb 0.52 -0.89 0.03 0.00 -1.01 0.00 0.00 64.21 62.87 1maj n SER 48 CO 0.00 0.00 0.00 -2.84 -3.01 0.00 0.00 175.04 169.19 1maj s PRO 49 N -2.33 3.36 -0.42 1.43 0.02 -1.26 -4.96 135.00 130.84 1maj s PRO 49 Ca -0.21 2.29 0.06 0.00 0.02 0.00 0.00 61.00 63.16 1maj s PRO 49 Cb 0.04 -2.41 0.32 0.00 0.02 0.00 0.00 34.50 32.47 1maj s PRO 49 CO 0.35 -1.03 1.21 1.17 -0.33 0.00 0.00 177.00 178.37 1maj n LYS 50 N -0.70 0.84 -3.11 5.54 3.00 -1.26 -4.92 118.16 117.54 1maj n LYS 50 Ca 0.08 -1.62 0.04 0.00 -0.00 0.00 0.00 58.31 56.81 1maj n LYS 50 Cb 0.44 -0.65 -0.00 0.00 0.00 0.00 0.00 35.03 34.82 1maj n LYS 50 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.40 176.23 1maj s LEU 51 N -2.21 -1.11 -0.01 3.14 2.96 -1.26 -4.59 118.68 115.61 1maj s LEU 51 Ca 0.21 -0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 54.04 1maj s LEU 51 Cb 0.30 1.61 -0.00 0.00 0.50 0.00 0.00 46.19 48.59 1maj s LEU 51 CO -0.08 -0.18 -0.00 -0.07 -1.32 0.00 0.00 176.35 174.69 1maj h LEU 52 N 7.28 0.00 -8.76 -0.68 -0.00 -1.85 -3.40 115.31 107.89 1maj h LEU 52 Ca -0.03 0.00 -0.64 0.00 -0.00 0.00 0.00 57.88 57.21 1maj h LEU 52 Cb 1.19 0.00 -0.22 0.00 -0.00 0.00 0.00 40.66 41.63 1maj h LEU 52 CO 0.04 0.04 -0.67 -0.63 -0.00 0.00 0.00 178.44 177.22 1maj s ILE 53 N -1.05 3.90 -0.05 1.22 -1.09 -1.26 -0.57 121.20 122.30 1maj s ILE 53 Ca -0.00 -0.34 0.15 0.00 -2.23 0.00 0.00 60.65 58.23 1maj s ILE 53 Cb 0.00 -2.74 0.29 0.00 -1.58 0.00 0.00 42.46 38.43 1maj s ILE 53 CO 0.00 0.46 1.13 0.00 -1.23 0.00 0.00 174.94 175.30 1maj n TYR 54 N 3.89 0.00 -1.66 3.97 4.11 -1.25 0.53 117.16 126.75 1maj n TYR 54 Ca -0.17 -0.59 -0.02 0.00 -0.00 0.00 0.00 57.90 57.12 1maj n TYR 54 Cb 0.52 -0.14 -0.02 0.00 -0.00 0.00 0.00 39.34 39.70 1maj n TYR 54 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.86 178.49 1maj n LYS 55 N -0.16 0.00 -1.89 -3.48 5.02 -0.79 -4.67 118.16 112.19 1maj n LYS 55 Ca 0.08 -0.35 0.00 0.00 -2.02 0.00 0.00 58.31 56.02 1maj n LYS 55 Cb 0.88 0.40 0.00 0.00 -0.02 0.00 0.00 35.03 36.28 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 0.00-12.19 -2.49 -0.18 0.31 -1.25 -4.29 118.33 98.25 1maj n VAL 56 Ca -0.10 3.01 -0.10 0.00 -0.01 0.00 0.00 64.34 67.14 1maj n VAL 56 Cb 0.40 -5.15 -0.02 0.00 -0.91 0.00 0.00 33.84 28.16 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 1.66 -0.91 -0.07 4.52 3.41 0.12 -4.65 113.62 117.71 1maj n SER 57 Ca 0.00 -0.04 -0.08 0.00 -0.26 0.00 0.00 58.87 58.49 1maj n SER 57 Cb 0.00 -0.85 -0.09 0.00 -0.26 0.00 0.00 64.21 63.00 1maj n SER 57 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1maj n ASN 58 N -1.22 2.09 -1.82 4.04 0.23 -1.26 -4.94 115.26 112.38 1maj n ASN 58 Ca 0.03 -0.03 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 1maj n ASN 58 Cb 0.35 0.50 0.00 0.00 -2.08 0.00 0.00 39.78 38.55 1maj n ASN 58 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1maj n ARG 59 N -2.62 -3.70 -0.62 -3.83 1.74 -1.26 -4.96 116.66 101.40 1maj n ARG 59 Ca -0.23 2.81 -0.29 0.00 -0.77 0.00 0.00 57.85 59.37 1maj n ARG 59 Cb 0.89 -3.27 0.23 0.00 -1.02 0.00 0.00 32.46 29.29 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 -0.40 1.46 0.28 -1.55 5.36 0.26 -4.88 117.98 118.51 1maj s PHE 60 Ca 0.00 1.30 0.01 0.00 -0.96 0.00 0.00 56.93 57.27 1maj s PHE 60 Cb 0.00 -3.15 0.54 0.00 -0.34 0.00 0.00 43.02 40.07 1maj s PHE 60 CO 0.00 -3.59 1.82 1.03 -1.46 0.00 0.00 175.22 173.02 1maj h SER 61 N -2.43 0.85 -1.11 6.13 0.87 -1.90 -2.92 113.55 113.04 1maj h SER 61 Ca -0.57 0.06 -0.74 0.00 -1.23 0.00 0.00 61.79 59.30 1maj h SER 61 Cb 1.32 -0.11 -0.12 0.00 -0.44 0.00 0.00 62.40 63.05 1maj h SER 61 CO 0.49 0.44 2.41 0.61 -0.53 0.00 0.00 176.83 180.25 1maj n GLY 62 N -1.34 4.96 2.81 5.77 0.00 -1.26 -4.89 105.19 111.24 1maj n GLY 62 Ca 0.18 -2.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.23 -0.00 -1.56 1.61 1.01 -1.11 -4.80 120.40 115.32 1maj s VAL 63 Ca 0.50 0.13 0.00 0.00 0.00 0.00 0.00 61.98 62.61 1maj s VAL 63 Cb 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 36.38 36.44 1maj s VAL 63 CO -0.06 0.07 0.29 -0.81 0.00 0.00 0.00 175.10 174.59 1maj n PRO 64 N 3.83 0.37 0.00 2.72 -0.04 -1.26 -4.79 135.00 135.83 1maj n PRO 64 Ca -0.23 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.23 1maj n PRO 64 Cb 0.53 -1.08 0.00 0.00 -0.04 0.00 0.00 33.50 32.91 1maj n PRO 64 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1maj n ASP 65 N -0.14 0.00 0.05 3.54 8.00 -1.26 -4.66 116.55 122.07 1maj n ASP 65 Ca 0.00 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.56 1maj n ASP 65 Cb 0.04 -0.21 0.29 0.00 -0.02 0.00 0.00 41.12 41.22 1maj n ASP 65 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1maj n ARG 66 N -0.74 0.06 -3.52 -1.24 1.85 -1.26 -4.62 116.66 107.19 1maj n ARG 66 Ca 0.00 0.42 -0.37 0.00 -1.00 0.00 0.00 57.85 56.90 1maj n ARG 66 Cb 0.00 -1.64 -0.07 0.00 -1.05 0.00 0.00 32.46 29.70 1maj n ARG 66 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1maj s PHE 67 N -3.15 3.53 -0.41 2.89 0.08 -1.26 -0.73 117.98 118.94 1maj s PHE 67 Ca 0.03 0.71 0.04 0.00 0.12 0.00 0.00 56.93 57.83 1maj s PHE 67 Cb 0.06 -2.33 0.17 0.00 -0.57 0.00 0.00 43.02 40.34 1maj s PHE 67 CO 0.20 0.35 0.43 -1.12 -0.10 0.00 0.00 175.22 174.97 1maj s SER 68 N 0.07 0.79 -0.52 1.36 0.01 -0.32 -4.74 113.70 110.34 1maj s SER 68 Ca 0.19 -2.02 -0.24 0.00 1.31 0.00 0.00 55.95 55.18 1maj s SER 68 Cb -0.14 0.52 0.04 0.00 0.21 0.00 0.00 66.02 66.65 1maj s SER 68 CO 0.07 -0.20 0.93 -0.83 0.41 0.00 0.00 173.24 173.62 1maj s GLY 69 N 0.95 1.43 0.73 3.44 0.00 -1.26 -3.04 107.32 109.58 1maj s GLY 69 Ca 0.24 -1.11 -0.11 0.00 0.00 0.00 0.00 44.72 43.73 1maj s GLY 69 CO -0.07 2.04 1.08 -0.45 0.00 0.00 0.00 173.10 175.69 1maj s SER 70 N 2.66 5.11 -0.31 1.64 0.15 -1.08 0.13 113.70 122.00 1maj s SER 70 Ca 0.32 1.35 -0.02 0.00 0.70 0.00 0.00 55.95 58.31 1maj s SER 70 Cb -0.12 -2.17 0.12 0.00 -1.71 0.00 0.00 66.02 62.14 1maj s SER 70 CO 0.21 -1.58 0.21 -0.83 1.20 0.00 0.00 173.24 172.45 1maj s GLY 71 N -4.01 0.43 -1.09 9.45 0.00 -1.26 -2.62 107.32 108.22 1maj s GLY 71 Ca 0.59 -1.16 -0.13 0.00 0.00 0.00 0.00 44.72 44.02 1maj s GLY 71 CO 0.54 2.25 1.20 -0.45 0.00 0.00 0.00 173.10 176.63 1maj s SER 72 N 1.80 7.05 0.00 1.64 0.15 0.16 -4.87 113.70 119.63 1maj s SER 72 Ca 0.12 -3.02 0.00 0.00 0.70 0.00 0.00 55.95 53.76 1maj s SER 72 Cb -0.17 -2.31 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 1maj s SER 72 CO -0.22 -0.62 0.00 0.61 1.20 0.00 0.00 173.24 174.21 1maj n GLY 73 N 3.83 1.04 0.07 9.45 0.00 -1.26 -1.94 105.19 116.38 1maj n GLY 73 Ca 0.28 0.51 0.04 0.00 0.00 0.00 0.00 46.02 46.84 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 1.20 -5.02 2.61 -2.24 -1.26 -3.25 114.28 106.31 1maj n THR 74 Ca 0.00 -1.35 -0.29 0.00 -2.27 0.00 0.00 64.05 60.14 1maj n THR 74 Cb 0.00 0.24 -0.17 0.00 -2.10 0.00 0.00 70.33 68.31 1maj n THR 74 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1maj s ASP 75 N -1.68 2.63 0.01 3.42 -1.08 -0.82 -1.29 116.67 117.87 1maj s ASP 75 Ca 0.13 -0.46 0.01 0.00 -0.52 0.00 0.00 52.55 51.71 1maj s ASP 75 Cb 0.11 -1.03 -0.01 0.00 -1.46 0.00 0.00 42.92 40.54 1maj s ASP 75 CO 0.01 0.15 -0.03 -0.36 0.52 0.00 0.00 175.17 175.46 1maj s PHE 76 N 0.25 0.27 -0.14 -5.34 0.08 0.22 0.40 117.98 113.72 1maj s PHE 76 Ca -0.12 -0.22 -0.04 0.00 0.12 0.00 0.00 56.93 56.66 1maj s PHE 76 Cb -0.15 -0.17 0.05 0.00 -0.57 0.00 0.00 43.02 42.17 1maj s PHE 76 CO 0.06 -0.06 0.08 0.99 -0.10 0.00 0.00 175.22 176.19 1maj s THR 77 N -0.58 -0.09 -0.73 0.64 2.01 -1.08 -0.19 115.64 115.62 1maj s THR 77 Ca -0.05 -0.03 -0.27 0.00 0.31 0.00 0.00 61.69 61.66 1maj s THR 77 Cb -0.04 -0.48 0.03 0.00 0.01 0.00 0.00 72.50 72.02 1maj s THR 77 CO -0.00 -0.17 1.25 -0.22 -0.69 0.00 0.00 174.62 174.78 1maj s LEU 78 N 2.15 3.28 -0.10 4.42 0.20 -0.72 -2.62 118.68 125.28 1maj s LEU 78 Ca 0.03 -0.47 -0.14 0.00 0.69 0.00 0.00 54.13 54.24 1maj s LEU 78 Cb -0.15 -2.58 -0.05 0.00 -0.43 0.00 0.00 46.19 42.98 1maj s LEU 78 CO -0.08 -1.79 0.34 -0.54 -0.29 0.00 0.00 176.35 174.00 1maj s LYS 79 N 5.56 4.08 -0.08 1.98 1.02 -1.17 -0.86 119.74 130.27 1maj s LYS 79 Ca 0.34 0.23 0.02 0.00 0.02 0.00 0.00 55.97 56.58 1maj s LYS 79 Cb -0.09 -3.34 -0.02 0.00 -0.52 0.00 0.00 37.83 33.86 1maj s LYS 79 CO 0.15 0.43 -0.12 0.42 -0.92 0.00 0.00 175.35 175.31 1maj s ILE 80 N -0.16 3.24 -0.12 2.17 1.01 0.37 -1.18 121.20 126.53 1maj s ILE 80 Ca 0.20 -0.64 -0.16 0.00 0.00 0.00 0.00 60.65 60.06 1maj s ILE 80 Cb -0.14 -2.31 -0.26 0.00 0.01 0.00 0.00 42.46 39.76 1maj s ILE 80 CO 0.08 0.57 0.49 -1.28 0.00 0.00 0.00 174.94 174.80 1maj h SER 81 N 5.69 0.32 -3.53 3.58 0.87 -1.22 0.96 113.55 120.22 1maj h SER 81 Ca -0.42 -0.82 -0.63 0.00 -1.23 0.00 0.00 61.79 58.70 1maj h SER 81 Cb 1.17 -0.10 -0.40 0.00 -0.44 0.00 0.00 62.40 62.63 1maj h SER 81 CO 0.53 1.62 -0.75 -0.13 -0.53 0.00 0.00 176.83 177.57 1maj s ARG 82 N -2.47 1.31 -0.57 2.24 1.81 -1.26 -3.70 118.95 116.31 1maj s ARG 82 Ca -0.21 -1.44 -0.22 0.00 -1.72 0.00 0.00 55.73 52.13 1maj s ARG 82 Cb 0.05 -2.71 0.06 0.00 -0.45 0.00 0.00 34.95 31.90 1maj s ARG 82 CO 0.74 -0.87 0.85 0.08 -0.68 0.00 0.00 175.30 175.42 1maj s VAL 83 N 1.22 4.52 0.54 3.52 1.01 0.21 -4.90 120.40 126.53 1maj s VAL 83 Ca 0.07 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.93 1maj s VAL 83 Cb -0.18 -4.52 0.06 0.00 0.00 0.00 0.00 36.38 31.74 1maj s VAL 83 CO -0.13 -1.14 0.65 -1.61 0.00 0.00 0.00 175.10 172.87 1maj s GLU 84 N 3.56 2.36 0.57 2.72 2.02 -1.26 -0.45 118.70 128.22 1maj s GLU 84 Ca 0.23 -1.69 0.28 0.00 0.02 0.00 0.00 54.97 53.80 1maj s GLU 84 Cb -0.16 -2.50 1.50 0.00 0.10 0.00 0.00 34.13 33.07 1maj s GLU 84 CO 0.14 -0.70 1.98 0.00 0.02 0.00 0.00 175.26 176.69 1maj h ALA 85 N 0.42 2.19 0.19 5.21 0.00 -1.95 -0.41 119.26 124.91 1maj h ALA 85 Ca -0.33 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.25 1maj h ALA 85 Cb 1.29 0.03 0.03 0.00 0.00 0.00 0.00 17.79 19.15 1maj h ALA 85 CO 0.46 -0.60 -1.35 0.93 0.00 0.00 0.00 179.25 178.70 1maj h GLU 86 N 0.00 0.58 -0.01 0.00 4.39 -1.98 -3.20 114.58 114.36 1maj h GLU 86 Ca 0.20 -0.88 0.00 0.00 0.34 0.00 0.00 59.36 59.02 1maj h GLU 86 Cb 0.96 0.31 -0.00 0.00 -0.10 0.00 0.00 28.75 29.92 1maj h GLU 86 CO -0.00 1.41 0.15 -0.44 -1.16 0.00 0.00 179.01 178.97 1maj h ASP 87 N 0.19 0.00 -3.57 1.42 5.19 -1.42 -3.43 116.42 114.81 1maj h ASP 87 Ca -0.22 0.00 -0.46 0.00 -0.62 0.00 0.00 57.03 55.73 1maj h ASP 87 Cb 2.03 0.00 0.20 0.00 0.18 0.00 0.00 39.33 41.74 1maj h ASP 87 CO 0.26 0.00 0.09 -0.76 -3.12 0.00 0.00 179.24 175.70 1maj s LEU 88 N -6.05 1.36 0.00 1.55 1.43 -1.12 -4.93 118.68 110.92 1maj s LEU 88 Ca -0.04 1.59 0.00 0.00 -1.03 0.00 0.00 54.13 54.65 1maj s LEU 88 Cb 0.11 -3.65 0.00 0.00 0.03 0.00 0.00 46.19 42.68 1maj s LEU 88 CO 0.36 -3.79 0.00 0.61 0.23 0.00 0.00 176.35 173.76 1maj n GLY 89 N 0.33 0.93 3.59 -3.19 0.00 -0.52 -4.89 105.19 101.45 1maj n GLY 89 Ca 0.05 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.45 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 -1.00 4.79 0.15 -0.61 -1.09 -1.12 -1.15 121.20 121.16 1maj s ILE 90 Ca 0.00 0.93 -0.17 0.00 -2.23 0.00 0.00 60.65 59.18 1maj s ILE 90 Cb 0.00 -4.16 -0.07 0.00 -1.58 0.00 0.00 42.46 36.65 1maj s ILE 90 CO 0.00 -0.34 0.60 -0.31 -1.23 0.00 0.00 174.94 173.66 1maj s TYR 91 N 2.97 3.68 0.09 3.97 2.02 -0.28 -0.59 117.35 129.21 1maj s TYR 91 Ca 0.30 1.21 0.02 0.00 -0.37 0.00 0.00 57.07 58.23 1maj s TYR 91 Cb -0.14 -2.47 -0.04 0.00 -0.40 0.00 0.00 41.96 38.91 1maj s TYR 91 CO 0.15 0.45 -0.07 -0.06 -1.57 0.00 0.00 175.55 174.45 1maj s PHE 92 N -1.38 0.90 0.04 2.71 0.40 0.29 -1.53 117.98 119.42 1maj s PHE 92 Ca 0.37 -0.85 -0.00 0.00 -0.60 0.00 0.00 56.93 55.84 1maj s PHE 92 Cb -0.17 -0.51 -0.03 0.00 0.51 0.00 0.00 43.02 42.81 1maj s PHE 92 CO 0.20 -0.12 -0.03 0.00 0.70 0.00 0.00 175.22 175.96 1maj n SER 94 N 0.59 -1.13 -3.88 0.00 2.88 0.02 -2.89 113.62 109.22 1maj n SER 94 Ca -0.17 -2.34 -0.28 0.00 -1.33 0.00 0.00 58.87 54.74 1maj n SER 94 Cb 0.59 2.04 -0.16 0.00 -0.75 0.00 0.00 64.21 65.93 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 -2.48 1.36 -0.12 -1.46 -2.07 -1.26 -1.07 119.66 112.56 1maj s GLN 95 Ca 0.19 -0.57 0.00 0.00 -1.82 0.00 0.00 55.36 53.16 1maj s GLN 95 Cb -0.01 -2.10 0.12 0.00 -1.09 0.00 0.00 33.01 29.93 1maj s GLN 95 CO 0.14 -0.48 1.58 -2.37 -1.32 0.00 0.00 175.29 172.83 1maj n THR 96 N 4.87 1.89 0.00 3.63 5.66 -1.26 -4.26 114.28 124.80 1maj n THR 96 Ca -0.11 -0.70 0.00 0.00 -3.05 0.00 0.00 64.05 60.18 1maj n THR 96 Cb 0.47 -1.14 0.00 0.00 -1.55 0.00 0.00 70.33 68.11 1maj n THR 96 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1maj n THR 97 N 0.53 0.00 -1.77 1.09 -1.04 -1.26 -4.86 114.28 106.98 1maj n THR 97 Ca 0.13 0.38 -0.31 0.00 -2.04 0.00 0.00 64.05 62.22 1maj n THR 97 Cb 0.65 -1.38 0.04 0.00 -1.82 0.00 0.00 70.33 67.82 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 -0.77 3.31 -0.01 -1.42 3.76 -1.26 -5.05 115.29 113.85 1maj s HIS 98 Ca 0.00 1.22 0.01 0.00 -0.15 0.00 0.00 55.06 56.14 1maj s HIS 98 Cb 0.00 -2.92 0.00 0.00 1.11 0.00 0.00 32.58 30.77 1maj s HIS 98 CO 0.00 -1.11 -0.02 0.08 -0.85 0.00 0.00 174.74 172.84 1maj s VAL 99 N -3.20 0.20 0.69 -0.90 1.01 -1.26 -3.59 120.40 113.35 1maj s VAL 99 Ca 0.57 -0.07 -0.12 0.00 0.00 0.00 0.00 61.98 62.37 1maj s VAL 99 Cb -0.12 -0.21 0.01 0.00 0.00 0.00 0.00 36.38 36.06 1maj s VAL 99 CO 0.54 0.08 1.07 -2.16 0.00 0.00 0.00 175.10 174.62 1maj s PRO 100 N 0.19 2.87 0.66 2.72 0.04 -1.26 -5.07 135.00 135.16 1maj s PRO 100 Ca -0.02 1.08 -0.17 0.00 0.04 0.00 0.00 61.00 61.93 1maj s PRO 100 Cb -0.04 -1.98 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1maj s PRO 100 CO -0.01 -1.16 1.23 -1.25 0.04 0.00 0.00 177.00 175.86 1maj s PRO 101 N -4.75 2.53 -0.12 0.56 0.04 -1.24 -4.92 135.00 127.11 1maj s PRO 101 Ca 0.60 1.87 -0.07 0.00 0.04 0.00 0.00 61.00 63.44 1maj s PRO 101 Cb -0.15 -1.87 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 1maj s PRO 101 CO 0.51 -1.56 -0.15 1.79 0.04 0.00 0.00 177.00 177.63 1maj h THR 102 N 0.33 0.00 -1.41 1.26 1.35 -1.83 -3.50 112.91 109.11 1maj h THR 102 Ca -0.49 -0.84 0.00 0.00 -0.55 0.00 0.00 66.41 64.53 1maj h THR 102 Cb 1.31 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.73 1maj h THR 102 CO 0.52 0.00 -0.36 0.33 -0.25 0.00 0.00 175.52 175.77 1maj n PHE 103 N -4.24 -1.63 0.00 4.73 -0.00 -1.26 -5.03 117.46 110.03 1maj n PHE 103 Ca -0.06 0.88 0.00 0.00 -0.00 0.00 0.00 57.45 58.27 1maj n PHE 103 Cb 0.22 -1.76 0.00 0.00 -0.00 0.00 0.00 39.48 37.94 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 -1.61 1.49 0.00 7.13 0.00 -1.14 -4.74 105.19 106.32 1maj n GLY 104 Ca 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.71 0.42 0.00 -0.02 0.00 -1.26 -3.43 105.19 100.20 1maj n GLY 105 Ca 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 46.02 43.83 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 -0.88 3.58 -0.02 0.00 -1.22 -4.91 105.19 101.74 1maj n GLY 106 Ca 0.00 0.10 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 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 4.22 -0.90 2.61 2.01 -0.58 -4.74 115.64 118.26 1maj s THR 107 Ca 0.00 0.92 -0.25 0.00 0.31 0.00 0.00 61.69 62.67 1maj s THR 107 Cb 0.00 -4.61 -0.06 0.00 0.01 0.00 0.00 72.50 67.85 1maj s THR 107 CO 0.00 -1.10 1.98 -0.54 -0.69 0.00 0.00 174.62 174.28 1maj s LYS 108 N 4.42 2.48 -1.08 4.92 -0.14 0.54 -1.13 119.74 129.76 1maj s LYS 108 Ca 0.42 -0.25 -0.21 0.00 -1.36 0.00 0.00 55.97 54.57 1maj s LYS 108 Cb -0.08 -5.05 0.07 0.00 -1.68 0.00 0.00 37.83 31.09 1maj s LYS 108 CO 0.27 -3.48 1.48 -1.17 -0.76 0.00 0.00 175.35 171.69 1maj s LEU 109 N 10.49 3.76 0.03 3.17 2.96 -0.30 -1.94 118.68 136.84 1maj s LEU 109 Ca 0.72 -1.77 0.08 0.00 -0.22 0.00 0.00 54.13 52.94 1maj s LEU 109 Cb -0.07 -2.55 -0.03 0.00 0.50 0.00 0.00 46.19 44.04 1maj s LEU 109 CO 0.00 -1.37 -0.25 -0.70 -1.32 0.00 0.00 176.35 172.71 1maj s GLU 110 N 4.51 1.77 0.22 1.98 -6.30 -1.24 -1.43 118.70 118.20 1maj s GLU 110 Ca 0.46 -1.01 -0.15 0.00 -2.50 0.00 0.00 54.97 51.77 1maj s GLU 110 Cb 0.00 -1.87 -0.08 0.00 0.00 0.00 0.00 34.13 32.19 1maj s GLU 110 CO -0.06 0.49 0.63 0.42 0.02 0.00 0.00 175.26 176.76 1maj s ILE 111 N -0.74 4.76 -0.51 -3.70 1.01 -1.26 -2.84 121.20 117.93 1maj s ILE 111 Ca 0.10 0.89 -0.27 0.00 0.00 0.00 0.00 60.65 61.37 1maj s ILE 111 Cb -0.10 -3.71 -0.02 0.00 0.01 0.00 0.00 42.46 38.64 1maj s ILE 111 CO 0.01 0.08 1.89 -0.54 0.00 0.00 0.00 174.94 176.38 1maj s LYS 112 N -2.35 2.80 0.00 2.79 1.02 0.14 -4.81 119.74 119.33 1maj s LYS 112 Ca 0.44 0.94 0.00 0.00 0.02 0.00 0.00 55.97 57.37 1maj s LYS 112 Cb -0.14 -4.35 0.00 0.00 -0.52 0.00 0.00 37.83 32.83 1maj s LYS 112 CO 0.20 -2.51 0.19 2.89 -0.92 0.00 0.00 175.35 175.20