#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k75 s ASP 2 N 0.00 -0.24 -0.02 4.04 2.15 -1.26 -5.03 116.67 116.31 2k75 s ASP 2 Ca 0.00 0.31 -0.28 0.00 0.43 0.00 0.00 52.55 53.01 2k75 s ASP 2 Cb 0.00 0.27 -0.03 0.00 -0.30 0.00 0.00 42.92 42.85 2k75 s ASP 2 CO 0.00 -0.19 0.90 -0.76 -0.17 0.00 0.00 175.17 174.95 2k75 s LEU 3 N -0.79 4.35 0.15 -1.34 2.01 -1.26 -2.13 118.68 119.68 2k75 s LEU 3 Ca 0.03 1.52 0.01 0.00 0.01 0.00 0.00 54.13 55.71 2k75 s LEU 3 Cb -0.02 -3.43 -0.04 0.00 0.01 0.00 0.00 46.19 42.71 2k75 s LEU 3 CO -0.04 -0.22 0.00 0.68 1.01 0.00 0.00 176.35 177.78 2k75 s VAL 4 N 0.95 0.59 0.56 -1.59 -7.23 -1.02 -4.96 120.40 107.69 2k75 s VAL 4 Ca 0.48 -1.96 -0.15 0.00 -1.81 0.00 0.00 61.98 58.54 2k75 s VAL 4 Cb -0.20 -2.04 -0.06 0.00 0.56 0.00 0.00 36.38 34.64 2k75 s VAL 4 CO 0.25 -0.54 1.01 -0.54 -0.31 0.00 0.00 175.10 174.97 2k75 s LYS 5 N -3.92 3.78 0.16 4.82 1.02 -1.26 -4.71 119.74 119.63 2k75 s LYS 5 Ca 0.22 0.90 -0.13 0.00 0.02 0.00 0.00 55.97 56.98 2k75 s LYS 5 Cb 0.06 -2.11 0.05 0.00 -0.52 0.00 0.00 37.83 35.32 2k75 s LYS 5 CO 0.02 -0.42 1.71 0.82 -0.92 0.00 0.00 175.35 176.56 2k75 h ILE 6 N 0.44 1.22 0.00 2.17 2.04 -1.96 -1.70 117.51 119.72 2k75 h ILE 6 Ca -0.46 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 64.69 2k75 h ILE 6 Cb 1.19 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.94 2k75 h ILE 6 CO 0.61 0.27 0.00 -2.11 0.00 0.00 0.00 178.15 176.92 2k75 n ARG 7 N -4.50 0.18 0.00 2.37 1.85 -1.26 -1.25 116.66 114.05 2k75 n ARG 7 Ca 0.02 0.48 0.14 0.00 -1.00 0.00 0.00 57.85 57.50 2k75 n ARG 7 Cb 0.17 -1.90 0.54 0.00 -1.05 0.00 0.00 32.46 30.22 2k75 n ARG 7 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 2k75 n ASP 8 N -2.25 1.45 -4.73 2.89 8.00 -0.65 -4.89 116.55 116.37 2k75 n ASP 8 Ca 0.01 -1.48 -0.42 0.00 0.71 0.00 0.00 54.79 53.61 2k75 n ASP 8 Cb 0.18 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.25 2k75 n ASP 8 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2k75 s VAL 9 N -2.00 2.94 0.28 2.53 1.01 -0.38 -4.93 120.40 119.85 2k75 s VAL 9 Ca 0.38 0.74 -0.20 0.00 0.00 0.00 0.00 61.98 62.90 2k75 s VAL 9 Cb 0.21 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 33.14 2k75 s VAL 9 CO 0.34 0.09 0.68 -0.55 0.00 0.00 0.00 175.10 175.66 2k75 s SER 10 N 0.69 -0.22 0.31 3.32 0.15 -1.26 -5.03 113.70 111.65 2k75 s SER 10 Ca 0.62 -0.67 0.02 0.00 0.70 0.00 0.00 55.95 56.61 2k75 s SER 10 Cb -0.40 0.71 0.50 0.00 -1.71 0.00 0.00 66.02 65.12 2k75 s SER 10 CO 0.36 -1.33 1.83 -0.07 1.20 0.00 0.00 173.24 175.24 2k75 h LEU 11 N 2.04 0.60 -2.66 3.45 -0.00 -1.94 -1.73 115.31 115.07 2k75 h LEU 11 Ca -0.20 -0.12 0.00 0.00 -0.00 0.00 0.00 57.88 57.56 2k75 h LEU 11 Cb 1.25 -0.16 -0.00 0.00 -0.00 0.00 0.00 40.66 41.75 2k75 h LEU 11 CO 0.25 0.66 0.10 0.77 -0.00 0.00 0.00 178.44 180.23 2k75 h SER 12 N 0.60 0.00 -3.18 -0.43 4.64 -1.97 -3.17 113.55 110.04 2k75 h SER 12 Ca 0.13 0.00 -0.68 0.00 -0.47 0.00 0.00 61.79 60.77 2k75 h SER 12 Cb 0.37 0.00 -0.37 0.00 -0.31 0.00 0.00 62.40 62.09 2k75 h SER 12 CO 0.01 0.00 -0.22 0.35 -0.87 0.00 0.00 176.83 176.10 2k75 n THR 13 N -3.09 2.70 0.24 2.95 -2.24 -0.65 -4.90 114.28 109.28 2k75 n THR 13 Ca -0.02 -5.08 0.11 0.00 -2.27 0.00 0.00 64.05 56.78 2k75 n THR 13 Cb 0.17 -2.30 0.58 0.00 -2.10 0.00 0.00 70.33 66.68 2k75 n THR 13 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 2k75 h PRO 14 N 5.70 0.00 -4.37 -0.78 0.13 -1.74 -3.41 132.00 127.54 2k75 h PRO 14 Ca 0.16 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.68 2k75 h PRO 14 Cb 0.78 0.00 -0.38 0.00 0.13 0.00 0.00 31.00 31.53 2k75 h PRO 14 CO 0.84 0.19 -0.79 0.71 -0.23 0.00 0.00 178.00 178.72 2k75 s TYR 15 N -3.96 2.41 0.09 1.56 2.02 -1.26 -2.32 117.35 115.90 2k75 s TYR 15 Ca -0.01 -1.76 -0.03 0.00 -0.37 0.00 0.00 57.07 54.90 2k75 s TYR 15 Cb 0.12 -1.58 -0.03 0.00 -0.40 0.00 0.00 41.96 40.06 2k75 s TYR 15 CO 0.62 -0.78 0.05 0.14 -1.57 0.00 0.00 175.55 174.02 2k75 s VAL 16 N 1.39 0.16 -0.07 0.71 -7.23 -1.02 -4.78 120.40 109.55 2k75 s VAL 16 Ca -0.06 -1.71 0.04 0.00 -1.81 0.00 0.00 61.98 58.44 2k75 s VAL 16 Cb -0.19 -1.68 -0.02 0.00 0.56 0.00 0.00 36.38 35.05 2k75 s VAL 16 CO -0.06 -0.73 -0.20 -0.55 -0.31 0.00 0.00 175.10 173.26 2k75 s SER 17 N -2.95 3.51 0.11 4.85 0.15 -0.91 -1.00 113.70 117.47 2k75 s SER 17 Ca 0.13 -0.39 0.01 0.00 0.70 0.00 0.00 55.95 56.40 2k75 s SER 17 Cb 0.07 -1.00 -0.04 0.00 -1.71 0.00 0.00 66.02 63.34 2k75 s SER 17 CO -0.06 0.26 -0.04 0.68 1.20 0.00 0.00 173.24 175.28 2k75 s VAL 18 N -0.21 0.62 0.00 4.45 -7.23 -0.71 -2.44 120.40 114.87 2k75 s VAL 18 Ca -0.01 -1.94 0.00 0.00 -1.81 0.00 0.00 61.98 58.23 2k75 s VAL 18 Cb -0.13 -1.79 -0.00 0.00 0.56 0.00 0.00 36.38 35.01 2k75 s VAL 18 CO 0.03 -0.77 -0.01 -0.51 -0.31 0.00 0.00 175.10 173.54 2k75 s ILE 19 N -3.68 0.07 -0.92 -0.62 2.07 -1.26 -0.98 121.20 115.88 2k75 s ILE 19 Ca 0.15 -0.10 0.00 0.00 -1.41 0.00 0.00 60.65 59.29 2k75 s ILE 19 Cb 0.06 -0.08 0.00 0.00 0.13 0.00 0.00 42.46 42.57 2k75 s ILE 19 CO -0.03 -0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.59 2k75 n GLY 20 N 2.95 -0.98 3.58 1.50 0.00 -1.07 -4.84 105.19 106.32 2k75 n GLY 20 Ca -0.13 -0.80 -0.34 0.00 0.00 0.00 0.00 46.02 44.75 2k75 n GLY 20 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k75 s LYS 21 N -0.37 3.74 -0.16 1.61 2.20 -0.77 -2.13 119.74 123.86 2k75 s LYS 21 Ca 0.00 -0.43 -0.07 0.00 -0.36 0.00 0.00 55.97 55.11 2k75 s LYS 21 Cb 0.00 -3.04 -0.04 0.00 -1.51 0.00 0.00 37.83 33.24 2k75 s LYS 21 CO 0.00 0.31 0.08 0.42 -0.36 0.00 0.00 175.35 175.80 2k75 s ILE 22 N 0.22 5.01 0.10 5.43 1.01 -1.05 -1.80 121.20 130.12 2k75 s ILE 22 Ca 0.01 0.04 0.02 0.00 0.00 0.00 0.00 60.65 60.71 2k75 s ILE 22 Cb -0.13 -3.23 -0.04 0.00 0.01 0.00 0.00 42.46 39.07 2k75 s ILE 22 CO 0.02 0.51 -0.07 0.42 0.00 0.00 0.00 174.94 175.82 2k75 s THR 23 N -0.14 0.73 0.00 2.92 -4.23 -0.71 0.80 115.64 115.01 2k75 s THR 23 Ca 0.08 -1.91 0.00 0.00 -1.18 0.00 0.00 61.69 58.68 2k75 s THR 23 Cb -0.12 -1.65 0.00 0.00 1.34 0.00 0.00 72.50 72.07 2k75 s THR 23 CO 0.01 -0.84 0.00 0.61 -0.54 0.00 0.00 174.62 173.85 2k75 n GLY 24 N 0.01 1.64 2.41 3.99 0.00 -1.26 -2.53 105.19 109.44 2k75 n GLY 24 Ca -0.12 -0.46 -0.01 0.00 0.00 0.00 0.00 46.02 45.42 2k75 n GLY 24 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2k75 n ILE 25 N 0.00-10.95 -4.63 -0.61 2.08 -1.22 -4.76 119.36 99.28 2k75 n ILE 25 Ca 0.00 2.52 -0.22 0.00 0.56 0.00 0.00 62.75 65.60 2k75 n ILE 25 Cb 0.00 -5.41 -0.15 0.00 -0.75 0.00 0.00 39.64 33.32 2k75 n ILE 25 CO 0.00 0.00 0.00 -1.00 0.56 0.00 0.00 176.55 176.11 2k75 s HIS 26 N -0.50 1.27 -0.00 1.39 3.76 0.61 -4.93 115.29 116.88 2k75 s HIS 26 Ca -0.07 -0.28 -0.18 0.00 -0.15 0.00 0.00 55.06 54.38 2k75 s HIS 26 Cb 0.00 -0.84 -0.06 0.00 1.11 0.00 0.00 32.58 32.80 2k75 s HIS 26 CO 0.18 -0.06 0.53 0.21 -0.85 0.00 0.00 174.74 174.75 2k75 s LYS 27 N -0.18 4.20 0.00 1.40 2.20 -1.26 -1.49 119.74 124.62 2k75 s LYS 27 Ca 0.02 0.61 -0.13 0.00 -0.36 0.00 0.00 55.97 56.12 2k75 s LYS 27 Cb -0.07 -3.30 0.02 0.00 -1.51 0.00 0.00 37.83 32.96 2k75 s LYS 27 CO 0.00 0.47 0.27 0.21 -0.36 0.00 0.00 175.35 175.95 2k75 s LYS 28 N -0.48 0.67 0.04 4.03 2.20 -0.59 -5.00 119.74 120.61 2k75 s LYS 28 Ca 0.28 -0.32 0.08 0.00 -0.36 0.00 0.00 55.97 55.65 2k75 s LYS 28 Cb -0.18 0.29 -0.03 0.00 -1.51 0.00 0.00 37.83 36.40 2k75 s LYS 28 CO 0.16 -0.19 -0.22 -1.21 -0.36 0.00 0.00 175.35 173.53 2k75 s GLU 29 N -1.66 1.95 0.11 4.03 2.02 -1.26 -0.51 118.70 123.38 2k75 s GLU 29 Ca -0.12 -1.04 -0.06 0.00 0.02 0.00 0.00 54.97 53.78 2k75 s GLU 29 Cb -0.04 -2.10 -0.02 0.00 0.10 0.00 0.00 34.13 32.07 2k75 s GLU 29 CO 0.02 0.53 0.15 1.52 0.02 0.00 0.00 175.26 177.50 2k75 s TYR 30 N -0.87 0.40 0.25 1.61 1.13 -0.93 -4.98 117.35 113.97 2k75 s TYR 30 Ca 0.13 -0.83 -0.27 0.00 -1.41 0.00 0.00 57.07 54.69 2k75 s TYR 30 Cb -0.10 -0.19 -0.09 0.00 -1.10 0.00 0.00 41.96 40.48 2k75 s TYR 30 CO 0.04 -0.56 0.90 -1.21 -2.51 0.00 0.00 175.55 172.21 2k75 s GLU 31 N -3.93 4.69 -0.23 -3.49 2.02 -1.26 -1.43 118.70 115.07 2k75 s GLU 31 Ca 0.12 1.35 -0.03 0.00 0.02 0.00 0.00 54.97 56.43 2k75 s GLU 31 Cb 0.05 -3.10 0.10 0.00 0.10 0.00 0.00 34.13 31.28 2k75 s GLU 31 CO -0.06 0.45 0.22 0.45 0.02 0.00 0.00 175.26 176.34 2k75 s SER 32 N -1.34 1.74 -1.55 -0.19 0.15 0.82 -4.87 113.70 108.46 2k75 s SER 32 Ca 0.43 -0.49 -0.04 0.00 0.70 0.00 0.00 55.95 56.55 2k75 s SER 32 Cb -0.23 0.30 0.01 0.00 -1.71 0.00 0.00 66.02 64.40 2k75 s SER 32 CO 0.28 -0.36 0.39 -0.67 1.20 0.00 0.00 173.24 174.08 2k75 n ASP 33 N 5.31 -5.62 0.00 5.45 2.03 -1.26 -0.62 116.55 121.83 2k75 n ASP 33 Ca -0.05 -0.19 0.00 0.00 0.52 0.00 0.00 54.79 55.08 2k75 n ASP 33 Cb 0.48 -4.60 0.00 0.00 -0.72 0.00 0.00 41.12 36.28 2k75 n ASP 33 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k75 n GLY 34 N -1.29 0.72 3.05 0.27 0.00 -1.26 -5.02 105.19 101.65 2k75 n GLY 34 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 2k75 n GLY 34 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k75 s THR 35 N -2.65 1.35 0.17 2.61 2.01 0.21 -5.11 115.64 114.22 2k75 s THR 35 Ca 0.00 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.12 2k75 s THR 35 Cb 0.00 -1.24 -0.08 0.00 0.01 0.00 0.00 72.50 71.20 2k75 s THR 35 CO 0.00 0.41 1.20 -0.89 -0.69 0.00 0.00 174.62 174.64 2k75 s THR 36 N 0.84 3.64 0.02 -0.82 2.01 -1.26 -0.13 115.64 119.93 2k75 s THR 36 Ca -0.10 1.35 0.04 0.00 0.31 0.00 0.00 61.69 63.28 2k75 s THR 36 Cb -0.15 -3.86 -0.01 0.00 0.01 0.00 0.00 72.50 68.48 2k75 s THR 36 CO 0.01 0.20 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.49 2k75 s LYS 37 N -0.07 0.83 0.22 4.92 -0.14 -0.51 -4.90 119.74 120.09 2k75 s LYS 37 Ca 0.53 -0.56 -0.17 0.00 -1.36 0.00 0.00 55.97 54.42 2k75 s LYS 37 Cb -0.32 -0.79 -0.08 0.00 -1.68 0.00 0.00 37.83 34.96 2k75 s LYS 37 CO 0.35 0.20 0.67 -1.54 -0.76 0.00 0.00 175.35 174.28 2k75 s SER 38 N -0.74 6.91 -0.01 2.83 1.04 -1.26 -2.19 113.70 120.27 2k75 s SER 38 Ca 0.01 1.27 -0.01 0.00 0.48 0.00 0.00 55.95 57.70 2k75 s SER 38 Cb -0.06 -2.36 0.00 0.00 0.10 0.00 0.00 66.02 63.70 2k75 s SER 38 CO 0.00 -0.00 0.03 0.54 0.98 0.00 0.00 173.24 174.79 2k75 s VAL 39 N -1.62 0.00 -0.17 5.02 0.11 0.33 -2.37 120.40 121.71 2k75 s VAL 39 Ca 0.44 -0.02 -0.06 0.00 -2.93 0.00 0.00 61.98 59.40 2k75 s VAL 39 Cb -0.15 -0.06 -0.04 0.00 -1.53 0.00 0.00 36.38 34.61 2k75 s VAL 39 CO 0.20 -0.01 0.04 -0.31 -3.33 0.00 0.00 175.10 171.69 2k75 s TYR 40 N -0.02 3.21 0.16 1.54 1.51 0.32 -1.54 117.35 122.53 2k75 s TYR 40 Ca -0.00 0.01 0.10 0.00 -1.01 0.00 0.00 57.07 56.17 2k75 s TYR 40 Cb -0.00 -2.04 -0.04 0.00 -0.11 0.00 0.00 41.96 39.76 2k75 s TYR 40 CO 0.00 0.14 -0.24 -0.65 -1.11 0.00 0.00 175.55 173.69 2k75 s GLN 41 N 0.29 1.40 0.00 -0.62 -0.21 -0.55 0.11 119.66 120.08 2k75 s GLN 41 Ca 0.02 -1.42 0.00 0.00 0.02 0.00 0.00 55.36 53.98 2k75 s GLN 41 Cb -0.13 -1.73 0.00 0.00 1.00 0.00 0.00 33.01 32.15 2k75 s GLN 41 CO 0.01 0.38 0.00 0.41 -2.12 0.00 0.00 175.29 173.97 2k75 n GLY 42 N 0.53 1.15 3.23 3.09 0.00 -0.98 -0.28 105.19 111.93 2k75 n GLY 42 Ca -0.15 -0.88 -0.28 0.00 0.00 0.00 0.00 46.02 44.71 2k75 n GLY 42 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k75 s TYR 43 N -4.91 1.99 0.02 1.61 1.51 -1.05 -2.11 117.35 114.40 2k75 s TYR 43 Ca 0.00 -0.42 0.08 0.00 -1.01 0.00 0.00 57.07 55.71 2k75 s TYR 43 Cb 0.00 -1.29 -0.03 0.00 -0.11 0.00 0.00 41.96 40.53 2k75 s TYR 43 CO 0.00 -0.07 -0.22 -1.50 -1.11 0.00 0.00 175.55 172.65 2k75 s ILE 44 N -0.42 2.43 0.08 2.71 2.07 -1.05 -1.74 121.20 125.30 2k75 s ILE 44 Ca 0.06 -1.19 0.04 0.00 -1.41 0.00 0.00 60.65 58.14 2k75 s ILE 44 Cb -0.09 -1.95 -0.03 0.00 0.13 0.00 0.00 42.46 40.51 2k75 s ILE 44 CO -0.00 0.43 -0.10 -0.70 -1.91 0.00 0.00 174.94 172.66 2k75 s GLU 45 N -1.11 0.77 0.00 3.50 2.12 -0.74 -2.14 118.70 121.10 2k75 s GLU 45 Ca 0.12 -1.03 0.00 0.00 0.36 0.00 0.00 54.97 54.42 2k75 s GLU 45 Cb -0.10 -0.52 0.00 0.00 0.26 0.00 0.00 34.13 33.76 2k75 s GLU 45 CO 0.02 0.09 0.00 -3.47 -0.54 0.00 0.00 175.26 171.36 2k75 n ASP 46 N 0.89 0.00 0.04 -1.70 2.03 -0.66 -1.85 116.55 115.30 2k75 n ASP 46 Ca -0.18 -0.40 0.00 0.00 0.52 0.00 0.00 54.79 54.73 2k75 n ASP 46 Cb 0.56 0.00 0.32 0.00 -0.72 0.00 0.00 41.12 41.28 2k75 n ASP 46 CO 0.00 0.00 0.00 -0.78 -1.92 0.00 0.00 177.20 174.50 2k75 h ASP 47 N 0.00 0.41 0.00 1.67 1.82 -2.02 -3.36 116.42 114.94 2k75 h ASP 47 Ca 0.00 -0.08 0.00 0.00 -0.39 0.00 0.00 57.03 56.56 2k75 h ASP 47 Cb 0.00 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 39.90 2k75 h ASP 47 CO 0.00 0.52 0.00 0.35 -1.61 0.00 0.00 179.24 178.50 2k75 n THR 48 N -4.27 0.00 -1.34 2.25 -2.24 -1.26 -5.08 114.28 102.34 2k75 n THR 48 Ca 0.01 0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 2k75 n THR 48 Cb 0.26 -0.22 0.00 0.00 -2.10 0.00 0.00 70.33 68.27 2k75 n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k75 n ALA 49 N -2.22 0.00 -2.50 6.98 0.00 -1.26 -5.05 120.51 116.46 2k75 n ALA 49 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2k75 n ALA 49 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 2k75 n ALA 49 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2k75 s ARG 50 N 2.88 0.68 0.15 0.00 1.70 -1.26 -1.64 118.95 121.46 2k75 s ARG 50 Ca 0.00 -0.94 -0.16 0.00 -0.47 0.00 0.00 55.73 54.16 2k75 s ARG 50 Cb 0.00 0.26 0.03 0.00 -0.57 0.00 0.00 34.95 34.67 2k75 s ARG 50 CO 0.00 -0.18 0.42 -1.50 -1.08 0.00 0.00 175.30 172.96 2k75 s ILE 51 N -3.38 0.06 0.40 4.99 2.07 -0.91 -4.98 121.20 119.44 2k75 s ILE 51 Ca 0.02 -0.68 -0.24 0.00 -1.41 0.00 0.00 60.65 58.33 2k75 s ILE 51 Cb 0.03 -1.31 -0.09 0.00 0.13 0.00 0.00 42.46 41.22 2k75 s ILE 51 CO -0.08 -0.26 1.08 -0.13 -1.91 0.00 0.00 174.94 173.64 2k75 s ARG 52 N -3.83 4.14 0.06 3.50 0.52 -1.26 -2.51 118.95 119.57 2k75 s ARG 52 Ca 0.05 1.61 0.02 0.00 -0.52 0.00 0.00 55.73 56.90 2k75 s ARG 52 Cb 0.01 -2.60 -0.03 0.00 0.52 0.00 0.00 34.95 32.86 2k75 s ARG 52 CO -0.09 -0.19 -0.08 0.96 0.02 0.00 0.00 175.30 175.92 2k75 s ILE 53 N -1.57 0.66 -0.05 1.52 -4.36 -0.90 -1.75 121.20 114.76 2k75 s ILE 53 Ca 0.57 -1.36 -0.02 0.00 -0.26 0.00 0.00 60.65 59.58 2k75 s ILE 53 Cb -0.25 -0.98 0.04 0.00 1.25 0.00 0.00 42.46 42.52 2k75 s ILE 53 CO 0.31 -0.51 0.11 -0.94 0.24 0.00 0.00 174.94 174.15 2k75 s SER 54 N -2.04 -0.02 -0.20 4.36 1.04 0.53 -2.33 113.70 115.04 2k75 s SER 54 Ca -0.02 0.21 -0.02 0.00 0.48 0.00 0.00 55.95 56.59 2k75 s SER 54 Cb -0.06 0.10 -0.00 0.00 0.10 0.00 0.00 66.02 66.16 2k75 s SER 54 CO -0.01 -0.15 -0.09 -0.55 0.98 0.00 0.00 173.24 173.43 2k75 s SER 55 N 1.18 4.01 -0.26 7.02 0.15 0.12 -0.69 113.70 125.22 2k75 s SER 55 Ca -0.09 -0.44 -0.14 0.00 0.70 0.00 0.00 55.95 55.98 2k75 s SER 55 Cb -0.12 -1.67 -0.04 0.00 -1.71 0.00 0.00 66.02 62.48 2k75 s SER 55 CO -0.05 0.00 0.34 -0.36 1.20 0.00 0.00 173.24 174.37 2k75 s PHE 56 N 1.32 3.27 0.00 3.44 0.08 -0.96 -0.52 117.98 124.61 2k75 s PHE 56 Ca 0.04 0.40 0.00 0.00 0.12 0.00 0.00 56.93 57.49 2k75 s PHE 56 Cb -0.14 -2.52 0.00 0.00 -0.57 0.00 0.00 43.02 39.79 2k75 s PHE 56 CO -0.05 -0.17 0.00 0.41 -0.10 0.00 0.00 175.22 175.32 2k75 n GLY 57 N 4.59 1.28 3.75 4.36 0.00 -1.00 -4.59 105.19 113.57 2k75 n GLY 57 Ca -0.09 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.50 2k75 n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k75 s LYS 58 N 0.00 4.75 0.20 1.61 -0.14 -1.26 -5.04 119.74 119.86 2k75 s LYS 58 Ca 0.00 1.59 -0.05 0.00 -1.36 0.00 0.00 55.97 56.15 2k75 s LYS 58 Cb 0.00 -3.27 -0.06 0.00 -1.68 0.00 0.00 37.83 32.82 2k75 s LYS 58 CO 0.00 0.35 0.45 -1.14 -0.76 0.00 0.00 175.35 174.25 2k75 s GLN 59 N -0.99 3.64 0.13 1.68 0.74 -1.26 -4.64 119.66 118.96 2k75 s GLN 59 Ca 0.44 -0.04 0.05 0.00 0.05 0.00 0.00 55.36 55.86 2k75 s GLN 59 Cb -0.28 -2.76 -0.04 0.00 1.10 0.00 0.00 33.01 31.03 2k75 s GLN 59 CO 0.34 0.37 -0.11 -0.51 -0.55 0.00 0.00 175.29 174.83 2k75 s LEU 60 N -3.00 2.46 -0.08 3.68 1.43 -1.26 -5.15 118.68 116.77 2k75 s LEU 60 Ca 0.43 -0.90 0.01 0.00 -1.03 0.00 0.00 54.13 52.63 2k75 s LEU 60 Cb -0.11 -0.41 -0.03 0.00 0.03 0.00 0.00 46.19 45.67 2k75 s LEU 60 CO 0.26 -0.25 -0.10 -1.10 0.23 0.00 0.00 176.35 175.39 2k75 s GLN 61 N -3.18 2.91 0.42 1.70 -0.21 -1.26 -5.02 119.66 115.01 2k75 s GLN 61 Ca 0.12 -0.62 -0.26 0.00 0.02 0.00 0.00 55.36 54.62 2k75 s GLN 61 Cb -0.01 -2.57 -0.09 0.00 1.00 0.00 0.00 33.01 31.34 2k75 s GLN 61 CO 0.01 0.52 1.33 0.16 -2.12 0.00 0.00 175.29 175.19 2k75 s ASP 62 N -0.43 6.21 -0.41 5.90 -4.77 -1.26 -4.11 116.67 117.80 2k75 s ASP 62 Ca 0.06 2.71 -0.16 0.00 -3.30 0.00 0.00 52.55 51.86 2k75 s ASP 62 Cb -0.12 -2.64 0.02 0.00 -1.09 0.00 0.00 42.92 39.09 2k75 s ASP 62 CO 0.02 -0.93 0.53 -0.24 0.70 0.00 0.00 175.17 175.26 2k75 n SER 63 N 0.04 -7.78 -3.62 2.11 2.88 0.24 -4.95 113.62 102.54 2k75 n SER 63 Ca 0.04 0.59 -0.04 0.00 -1.33 0.00 0.00 58.87 58.13 2k75 n SER 63 Cb 0.43 -5.09 -0.06 0.00 -0.75 0.00 0.00 64.21 58.75 2k75 n SER 63 CO 0.00 0.00 0.00 1.51 -1.23 0.00 0.00 175.04 175.32 2k75 s ASP 64 N -2.40 -0.88 -0.20 -3.46 -4.77 -1.00 -4.95 116.67 99.00 2k75 s ASP 64 Ca 0.23 1.33 -0.29 0.00 -3.30 0.00 0.00 52.55 50.52 2k75 s ASP 64 Cb -0.06 1.60 0.00 0.00 -1.09 0.00 0.00 42.92 43.37 2k75 s ASP 64 CO 0.77 -0.20 1.13 -0.69 0.70 0.00 0.00 175.17 176.88 2k75 s VAL 65 N 1.96 4.52 0.11 2.11 1.01 -1.26 -2.52 120.40 126.34 2k75 s VAL 65 Ca -0.08 1.84 -0.01 0.00 0.00 0.00 0.00 61.98 63.73 2k75 s VAL 65 Cb -0.07 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2k75 s VAL 65 CO -0.19 -0.16 0.03 0.68 0.00 0.00 0.00 175.10 175.46 2k75 s VAL 66 N 3.29 0.20 -0.12 2.92 -7.23 -0.91 -2.33 120.40 116.23 2k75 s VAL 66 Ca 0.48 -1.89 0.03 0.00 -1.81 0.00 0.00 61.98 58.79 2k75 s VAL 66 Cb -0.18 -1.91 0.00 0.00 0.56 0.00 0.00 36.38 34.85 2k75 s VAL 66 CO 0.10 -0.61 -0.22 -0.60 -0.31 0.00 0.00 175.10 173.46 2k75 s ARG 67 N -4.00 3.08 -0.17 4.82 3.52 -0.23 -2.61 118.95 123.36 2k75 s ARG 67 Ca 0.19 -0.85 -0.05 0.00 -0.13 0.00 0.00 55.73 54.90 2k75 s ARG 67 Cb 0.07 -2.39 -0.03 0.00 -1.56 0.00 0.00 34.95 31.04 2k75 s ARG 67 CO -0.01 0.12 -0.00 0.42 -0.81 0.00 0.00 175.30 175.01 2k75 s ILE 68 N 0.51 4.17 -0.01 4.11 1.01 -0.16 -1.55 121.20 129.28 2k75 s ILE 68 Ca -0.14 -0.26 0.05 0.00 0.00 0.00 0.00 60.65 60.30 2k75 s ILE 68 Cb -0.17 -2.85 -0.03 0.00 0.01 0.00 0.00 42.46 39.42 2k75 s ILE 68 CO 0.05 0.48 -0.15 -0.62 0.00 0.00 0.00 174.94 174.69 2k75 s ASP 69 N 0.44 3.99 -1.13 3.58 -1.08 -0.63 -1.74 116.67 120.09 2k75 s ASP 69 Ca -0.01 -0.27 -0.07 0.00 -0.52 0.00 0.00 52.55 51.67 2k75 s ASP 69 Cb -0.14 -0.78 0.01 0.00 -1.46 0.00 0.00 42.92 40.55 2k75 s ASP 69 CO 0.02 0.31 0.98 -3.20 0.52 0.00 0.00 175.17 173.80 2k75 n ASN 70 N 1.99 -5.47 -4.79 -0.34 5.15 -1.23 -2.60 115.26 107.97 2k75 n ASN 70 Ca -0.17 -0.45 -0.35 0.00 -0.60 0.00 0.00 54.58 53.01 2k75 n ASN 70 Cb 0.52 -4.29 -0.03 0.00 -0.53 0.00 0.00 39.78 35.45 2k75 n ASN 70 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k75 s ALA 71 N -3.27 2.89 -0.23 5.20 0.00 -0.17 -4.63 121.76 121.55 2k75 s ALA 71 Ca 0.46 0.70 -0.10 0.00 0.00 0.00 0.00 51.96 53.03 2k75 s ALA 71 Cb -0.20 -3.29 -0.05 0.00 0.00 0.00 0.00 23.12 19.58 2k75 s ALA 71 CO 0.61 -0.42 0.14 0.50 0.00 0.00 0.00 175.76 176.59 2k75 s ARG 72 N -3.05 4.04 -0.00 0.00 3.52 -0.47 -2.44 118.95 120.55 2k75 s ARG 72 Ca 0.66 -0.29 -0.20 0.00 -0.13 0.00 0.00 55.73 55.77 2k75 s ARG 72 Cb -0.20 -3.48 -0.05 0.00 -1.56 0.00 0.00 34.95 29.66 2k75 s ARG 72 CO 0.24 0.08 0.58 0.08 -0.81 0.00 0.00 175.30 175.47 2k75 s VAL 73 N 0.98 4.91 0.06 7.11 1.01 -0.98 0.19 120.40 133.68 2k75 s VAL 73 Ca 0.07 1.21 -0.08 0.00 0.00 0.00 0.00 61.98 63.18 2k75 s VAL 73 Cb -0.13 -3.92 -0.00 0.00 0.00 0.00 0.00 36.38 32.33 2k75 s VAL 73 CO 0.04 0.43 0.16 0.00 0.00 0.00 0.00 175.10 175.72 2k75 s ALA 74 N -0.25 -0.19 -0.24 5.51 0.00 -0.94 -4.89 121.76 120.75 2k75 s ALA 74 Ca 0.30 -0.52 -0.03 0.00 0.00 0.00 0.00 51.96 51.72 2k75 s ALA 74 Cb -0.18 0.35 0.01 0.00 0.00 0.00 0.00 23.12 23.30 2k75 s ALA 74 CO 0.17 -0.41 -0.04 -1.14 0.00 0.00 0.00 175.76 174.34 2k75 s GLN 75 N -3.13 3.05 -0.02 0.00 0.74 -1.26 -1.65 119.66 117.39 2k75 s GLN 75 Ca -0.01 -0.84 0.05 0.00 0.05 0.00 0.00 55.36 54.62 2k75 s GLN 75 Cb 0.02 -3.03 -0.01 0.00 1.10 0.00 0.00 33.01 31.09 2k75 s GLN 75 CO -0.07 -0.33 -0.18 -0.06 -0.55 0.00 0.00 175.29 174.10 2k75 s PHE 76 N 1.40 1.66 -1.77 1.67 0.08 0.00 -4.68 117.98 116.34 2k75 s PHE 76 Ca 0.03 -0.36 0.00 0.00 0.12 0.00 0.00 56.93 56.72 2k75 s PHE 76 Cb -0.16 -1.08 0.00 0.00 -0.57 0.00 0.00 43.02 41.21 2k75 s PHE 76 CO -0.03 -0.07 0.00 -1.71 -0.10 0.00 0.00 175.22 173.31 2k75 n ASN 77 N 2.77 -4.89 0.00 1.36 2.85 -1.26 0.20 115.26 116.29 2k75 n ASN 77 Ca -0.16 0.31 0.00 0.00 -0.11 0.00 0.00 54.58 54.62 2k75 n ASN 77 Cb 0.53 -4.28 0.00 0.00 1.24 0.00 0.00 39.78 37.27 2k75 n ASN 77 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2k75 n GLY 78 N -0.55 0.58 3.34 8.20 0.00 -1.26 -5.01 105.19 110.49 2k75 n GLY 78 Ca -0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.51 2k75 n GLY 78 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k75 s TYR 79 N -2.36 2.49 0.43 1.61 2.02 0.13 -5.12 117.35 116.55 2k75 s TYR 79 Ca 0.00 -0.48 -0.22 0.00 -0.37 0.00 0.00 57.07 56.00 2k75 s TYR 79 Cb 0.00 -1.59 -0.10 0.00 -0.40 0.00 0.00 41.96 39.88 2k75 s TYR 79 CO 0.00 -0.06 1.00 -0.51 -1.57 0.00 0.00 175.55 174.42 2k75 s LEU 80 N -0.43 3.99 0.15 -1.29 1.43 -1.26 -0.82 118.68 120.46 2k75 s LEU 80 Ca 0.04 1.87 -0.17 0.00 -1.03 0.00 0.00 54.13 54.84 2k75 s LEU 80 Cb -0.12 -4.41 0.04 0.00 0.03 0.00 0.00 46.19 41.73 2k75 s LEU 80 CO 0.01 -0.51 0.47 -0.94 0.23 0.00 0.00 176.35 175.61 2k75 s SER 81 N -1.91 -0.28 -0.20 2.29 1.04 -0.66 -4.12 113.70 109.85 2k75 s SER 81 Ca 0.62 -0.34 -0.06 0.00 0.48 0.00 0.00 55.95 56.64 2k75 s SER 81 Cb -0.16 0.52 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 2k75 s SER 81 CO 0.20 -0.94 0.04 -0.76 0.98 0.00 0.00 173.24 172.76 2k75 s LEU 82 N -2.82 3.49 -0.22 2.42 1.43 -0.72 -2.23 118.68 120.03 2k75 s LEU 82 Ca 0.05 -0.10 -0.07 0.00 -1.03 0.00 0.00 54.13 52.98 2k75 s LEU 82 Cb 0.01 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 2k75 s LEU 82 CO -0.09 0.08 0.06 -0.44 0.23 0.00 0.00 176.35 176.20 2k75 s SER 83 N 0.91 5.24 -0.36 2.29 0.01 0.13 -0.35 113.70 121.58 2k75 s SER 83 Ca 0.03 -0.13 -0.14 0.00 1.31 0.00 0.00 55.95 57.02 2k75 s SER 83 Cb -0.14 -1.92 -0.01 0.00 0.21 0.00 0.00 66.02 64.16 2k75 s SER 83 CO 0.02 0.03 0.30 -0.69 0.41 0.00 0.00 173.24 173.32 2k75 s VAL 84 N 1.20 5.24 0.51 3.43 1.01 0.13 -1.36 120.40 130.56 2k75 s VAL 84 Ca 0.04 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 61.83 2k75 s VAL 84 Cb -0.14 -3.80 0.10 0.00 0.00 0.00 0.00 36.38 32.53 2k75 s VAL 84 CO 0.03 -0.11 0.70 0.61 0.00 0.00 0.00 175.10 176.34 2k75 n GLY 85 N 5.07 1.20 0.22 4.51 0.00 -1.26 -2.25 105.19 112.68 2k75 n GLY 85 Ca -0.11 -2.09 0.07 0.00 0.00 0.00 0.00 46.02 43.89 2k75 n GLY 85 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2k75 h ASP 86 N -0.24 0.00 0.61 1.61 3.58 -1.98 -1.79 116.42 118.22 2k75 h ASP 86 Ca -0.23 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.22 2k75 h ASP 86 Cb 0.94 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.99 2k75 h ASP 86 CO 0.28 0.27 0.00 -1.20 -2.88 0.00 0.00 179.24 175.71 2k75 n SER 87 N -3.83 0.00 -4.91 2.28 7.64 -1.26 -4.82 113.62 108.73 2k75 n SER 87 Ca -0.01 -0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.58 2k75 n SER 87 Cb 0.36 -0.33 0.04 0.00 -1.01 0.00 0.00 64.21 63.28 2k75 n SER 87 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2k75 s SER 88 N -2.65 5.39 -0.00 6.43 0.01 -0.67 -4.99 113.70 117.22 2k75 s SER 88 Ca 0.24 0.83 0.05 0.00 1.31 0.00 0.00 55.95 58.38 2k75 s SER 88 Cb 0.19 -1.69 -0.01 0.00 0.21 0.00 0.00 66.02 64.72 2k75 s SER 88 CO 0.45 -1.27 -0.16 -0.13 0.41 0.00 0.00 173.24 172.54 2k75 s ARG 89 N -5.18 1.26 -0.08 12.44 0.52 -1.07 -4.93 118.95 121.90 2k75 s ARG 89 Ca 0.56 -0.62 0.04 0.00 -0.52 0.00 0.00 55.73 55.19 2k75 s ARG 89 Cb -0.11 -1.24 0.00 0.00 0.52 0.00 0.00 34.95 34.13 2k75 s ARG 89 CO 0.48 0.33 -0.21 0.42 0.02 0.00 0.00 175.30 176.33 2k75 s ILE 90 N -0.46 1.84 -0.19 1.52 1.01 -1.26 -1.61 121.20 122.05 2k75 s ILE 90 Ca 0.06 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 59.81 2k75 s ILE 90 Cb -0.07 -1.60 0.04 0.00 0.01 0.00 0.00 42.46 40.84 2k75 s ILE 90 CO -0.00 0.51 -0.12 -0.70 0.00 0.00 0.00 174.94 174.63 2k75 s GLU 91 N 0.32 2.20 0.26 2.79 2.12 -0.60 -4.98 118.70 120.82 2k75 s GLU 91 Ca -0.15 -0.79 -0.30 0.00 0.36 0.00 0.00 54.97 54.09 2k75 s GLU 91 Cb -0.17 -2.37 -0.09 0.00 0.26 0.00 0.00 34.13 31.76 2k75 s GLU 91 CO 0.07 -0.36 1.01 -1.12 -0.54 0.00 0.00 175.26 174.31 2k75 s SER 92 N 1.39 7.47 -0.06 -1.70 0.01 -1.26 -1.07 113.70 118.49 2k75 s SER 92 Ca 0.01 2.08 0.02 0.00 1.31 0.00 0.00 55.95 59.37 2k75 s SER 92 Cb -0.15 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.47 2k75 s SER 92 CO -0.09 0.02 -0.11 0.68 0.41 0.00 0.00 173.24 174.15 2k75 s VAL 93 N -1.19 1.03 -0.19 3.43 -7.23 -0.98 -4.93 120.40 110.33 2k75 s VAL 93 Ca 0.43 -0.43 0.01 0.00 -1.81 0.00 0.00 61.98 60.18 2k75 s VAL 93 Cb -0.28 -0.95 -0.12 0.00 0.56 0.00 0.00 36.38 35.59 2k75 s VAL 93 CO 0.36 0.33 -0.17 -3.20 -0.31 0.00 0.00 175.10 172.10 2k75 n ASN 94 N 3.76 2.49 0.00 4.85 5.15 -1.26 -4.51 115.26 125.75 2k75 n ASN 94 Ca -0.23 -0.09 0.00 0.00 -0.60 0.00 0.00 54.58 53.66 2k75 n ASN 94 Cb 0.52 -0.31 0.00 0.00 -0.53 0.00 0.00 39.78 39.46 2k75 n ASN 94 CO 0.00 0.00 0.00 0.52 1.40 0.00 0.00 177.26 179.18 2k75 n VAL 95 N -3.08 0.00 0.00 3.44 0.31 -1.26 -5.09 118.33 112.65 2k75 n VAL 95 Ca -0.34 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 2k75 n VAL 95 Cb 0.85 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.78 2k75 n VAL 95 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2k75 n ASN 96 N 0.00 0.00 -3.11 4.52 5.03 -1.26 -4.86 115.26 115.58 2k75 n ASN 96 Ca 0.00 0.14 -0.21 0.00 0.87 0.00 0.00 54.58 55.38 2k75 n ASN 96 Cb 0.00 -0.15 -0.05 0.00 -1.02 0.00 0.00 39.78 38.57 2k75 n ASN 96 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 2k75 n ILE 97 N -0.97 -0.59 1.11 2.41 -5.35 -1.26 -4.93 119.36 109.77 2k75 n ILE 97 Ca 0.00 -3.44 0.13 0.00 -0.27 0.00 0.00 62.75 59.17 2k75 n ILE 97 Cb 0.00 -1.22 0.62 0.00 -1.74 0.00 0.00 39.64 37.29 2k75 n ILE 97 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 2k75 n PRO 98 N 1.58 0.25 -2.92 6.28 -0.04 -1.26 -4.76 135.00 134.12 2k75 n PRO 98 Ca 0.19 0.05 -0.41 0.00 -0.04 0.00 0.00 63.50 63.29 2k75 n PRO 98 Cb 0.55 -1.50 -0.04 0.00 -0.04 0.00 0.00 33.50 32.47 2k75 n PRO 98 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2k75 s LEU 99 N -2.71 4.29 0.00 1.53 2.96 -1.26 -4.81 118.68 118.68 2k75 s LEU 99 Ca 0.20 1.30 0.00 0.00 -0.22 0.00 0.00 54.13 55.41 2k75 s LEU 99 Cb 0.17 -3.24 0.00 0.00 0.50 0.00 0.00 46.19 43.62 2k75 s LEU 99 CO 0.42 -0.22 0.02 -1.84 -1.32 0.00 0.00 176.35 173.41 2k75 n GLU 100 N 4.18 0.00 -0.19 1.98 0.28 -1.26 -4.91 120.64 120.72 2k75 n GLU 100 Ca 0.02 -0.02 -0.10 0.00 -0.16 0.00 0.00 57.16 56.90 2k75 n GLU 100 Cb 0.51 -0.17 0.01 0.00 1.43 0.00 0.00 31.44 33.22 2k75 n GLU 100 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 2k75 h HIS 101 N 0.00 1.07 -3.33 -1.84 3.86 -2.01 -3.42 115.15 109.49 2k75 h HIS 101 Ca 0.00 -0.19 -0.64 0.00 -1.16 0.00 0.00 60.37 58.38 2k75 h HIS 101 Cb 0.57 -0.28 -0.20 0.00 1.06 0.00 0.00 27.41 28.56 2k75 h HIS 101 CO 0.00 0.98 -0.66 -1.01 0.86 0.00 0.00 177.93 178.10 2k75 s HIS 102 N -4.99 3.05 0.19 2.45 3.76 -1.26 -5.10 115.29 113.39 2k75 s HIS 102 Ca -0.12 -0.21 -0.12 0.00 -0.15 0.00 0.00 55.06 54.47 2k75 s HIS 102 Cb 0.13 -1.94 -0.00 0.00 1.11 0.00 0.00 32.58 31.88 2k75 s HIS 102 CO 0.84 0.05 0.38 -1.58 -0.85 0.00 0.00 174.74 173.58 2k75 s HIS 103 N 0.18 0.29 0.00 1.40 5.04 -1.26 -4.84 115.29 116.11 2k75 s HIS 103 Ca -0.01 -0.65 0.00 0.00 -1.54 0.00 0.00 55.06 52.86 2k75 s HIS 103 Cb -0.14 0.09 0.00 0.00 0.04 0.00 0.00 32.58 32.58 2k75 s HIS 103 CO 0.03 -0.83 0.00 1.58 -2.34 0.00 0.00 174.74 173.17 2k75 n HIS 104 N -0.29 0.00 -4.15 3.88 -0.00 -1.26 -4.85 115.22 108.55 2k75 n HIS 104 Ca -0.06 0.00 -0.15 0.00 -0.00 0.00 0.00 57.72 57.50 2k75 n HIS 104 Cb 0.63 -1.32 -0.13 0.00 -0.00 0.00 0.00 29.99 29.17 2k75 n HIS 104 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2k75 s HIS 105 N -0.56 0.69 0.00 1.57 3.76 -1.26 -5.35 115.29 114.14 2k75 s HIS 105 Ca 0.00 -0.31 0.00 0.00 -0.15 0.00 0.00 55.06 54.60 2k75 s HIS 105 Cb 0.00 -0.42 0.00 0.00 1.11 0.00 0.00 32.58 33.27 2k75 s HIS 105 CO 0.00 -0.03 0.00 -2.39 -0.85 0.00 0.00 174.74 171.47