#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 6.11 0.17 4.04 2.15 -1.26 -3.95 116.67 123.93 2k75 s ASP 2 Ca 0.00 2.05 -0.30 0.00 0.43 0.00 0.00 52.55 54.73 2k75 s ASP 2 Cb 0.00 -2.57 -0.08 0.00 -0.30 0.00 0.00 42.92 39.97 2k75 s ASP 2 CO 0.00 -0.94 1.26 -0.22 -0.17 0.00 0.00 175.17 175.10 2k75 s LEU 3 N -3.54 4.42 0.14 -1.34 0.20 -1.26 -1.84 118.68 115.46 2k75 s LEU 3 Ca 0.69 2.29 0.01 0.00 0.69 0.00 0.00 54.13 57.82 2k75 s LEU 3 Cb -0.20 -3.60 -0.04 0.00 -0.43 0.00 0.00 46.19 41.91 2k75 s LEU 3 CO 0.24 -0.47 -0.02 0.68 -0.29 0.00 0.00 176.35 176.49 2k75 s VAL 4 N 0.23 0.61 0.56 1.68 -7.23 -0.98 -4.91 120.40 110.36 2k75 s VAL 4 Ca 0.56 -1.95 -0.15 0.00 -1.81 0.00 0.00 61.98 58.63 2k75 s VAL 4 Cb -0.34 -1.95 -0.06 0.00 0.56 0.00 0.00 36.38 34.59 2k75 s VAL 4 CO 0.36 -0.62 1.01 -0.54 -0.31 0.00 0.00 175.10 175.00 2k75 s LYS 5 N -3.90 3.74 0.15 4.82 3.01 -1.26 -4.77 119.74 121.54 2k75 s LYS 5 Ca 0.19 0.94 -0.14 0.00 -1.01 0.00 0.00 55.97 55.96 2k75 s LYS 5 Cb 0.06 -2.10 0.03 0.00 -1.01 0.00 0.00 37.83 34.81 2k75 s LYS 5 CO 0.00 -0.44 1.69 0.82 0.51 0.00 0.00 175.35 177.93 2k75 h ILE 6 N 0.51 1.22 0.00 2.17 2.04 -1.93 -2.02 117.51 119.50 2k75 h ILE 6 Ca -0.46 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 64.70 2k75 h ILE 6 Cb 1.19 0.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2k75 h ILE 6 CO 0.61 0.26 0.00 -2.11 0.00 0.00 0.00 178.15 176.91 2k75 n ARG 7 N -4.53 0.20 -0.06 2.37 1.85 -1.26 -2.07 116.66 113.16 2k75 n ARG 7 Ca 0.02 0.36 0.12 0.00 -1.00 0.00 0.00 57.85 57.35 2k75 n ARG 7 Cb 0.17 -1.83 0.35 0.00 -1.05 0.00 0.00 32.46 30.09 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 -2.20 2.13 -4.73 2.89 8.00 -0.78 -4.92 116.55 116.95 2k75 n ASP 8 Ca 0.03 -1.74 -0.42 0.00 0.71 0.00 0.00 54.79 53.38 2k75 n ASP 8 Cb 0.27 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.27 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 -1.85 2.75 0.23 2.53 1.01 -0.88 -4.87 120.40 119.31 2k75 s VAL 9 Ca 0.34 0.57 -0.21 0.00 0.00 0.00 0.00 61.98 62.68 2k75 s VAL 9 Cb 0.20 -3.36 0.04 0.00 0.00 0.00 0.00 36.38 33.25 2k75 s VAL 9 CO 0.30 0.06 0.65 -0.94 0.00 0.00 0.00 175.10 175.18 2k75 s SER 10 N 0.82 -0.37 0.54 3.32 1.04 -1.26 -5.01 113.70 112.77 2k75 s SER 10 Ca 0.65 -0.38 0.35 0.00 0.48 0.00 0.00 55.95 57.04 2k75 s SER 10 Cb -0.42 0.66 1.62 0.00 0.10 0.00 0.00 66.02 67.99 2k75 s SER 10 CO 0.36 -1.18 2.05 -0.07 0.98 0.00 0.00 173.24 175.38 2k75 h LEU 11 N 2.03 0.00 -2.30 2.42 3.38 -1.94 -2.42 115.31 116.48 2k75 h LEU 11 Ca -0.26 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.75 2k75 h LEU 11 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 2k75 h LEU 11 CO 0.30 0.00 0.15 0.28 0.09 0.00 0.00 178.44 179.27 2k75 h SER 12 N 0.00 0.00 -3.26 -0.43 0.02 -1.97 -3.20 113.55 104.71 2k75 h SER 12 Ca 0.00 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 60.33 2k75 h SER 12 Cb 0.32 0.00 -0.41 0.00 0.14 0.00 0.00 62.40 62.45 2k75 h SER 12 CO 0.00 0.00 -0.65 0.42 -1.14 0.00 0.00 176.83 175.46 2k75 s THR 13 N -4.61 2.41 0.29 -2.27 -4.23 -0.91 -4.96 115.64 101.35 2k75 s THR 13 Ca -0.05 -3.78 0.03 0.00 -1.18 0.00 0.00 61.69 56.72 2k75 s THR 13 Cb 0.15 -2.61 0.29 0.00 1.34 0.00 0.00 72.50 71.67 2k75 s THR 13 CO 0.54 -0.99 1.79 -0.65 -0.54 0.00 0.00 174.62 174.77 2k75 h PRO 14 N 5.72 0.80 -5.29 3.99 0.11 -1.76 -3.40 132.00 132.17 2k75 h PRO 14 Ca 0.11 -0.05 -0.66 0.00 0.11 0.00 0.00 66.00 65.51 2k75 h PRO 14 Cb 0.81 -0.18 -0.29 0.00 0.11 0.00 0.00 31.00 31.45 2k75 h PRO 14 CO 0.65 0.53 -0.80 0.71 -0.21 0.00 0.00 178.00 178.88 2k75 s TYR 15 N -5.91 2.75 0.24 0.65 2.02 -1.26 -2.32 117.35 113.53 2k75 s TYR 15 Ca -0.12 -0.83 -0.04 0.00 -0.37 0.00 0.00 57.07 55.71 2k75 s TYR 15 Cb 0.24 -1.83 0.02 0.00 -0.40 0.00 0.00 41.96 39.99 2k75 s TYR 15 CO 0.80 -0.32 0.40 1.33 -1.57 0.00 0.00 175.55 176.19 2k75 n VAL 16 N 3.67 0.00 -4.41 0.71 0.24 -0.97 -4.39 118.33 113.18 2k75 n VAL 16 Ca -0.19 -0.98 -0.20 0.00 -2.04 0.00 0.00 64.34 60.94 2k75 n VAL 16 Cb 0.52 0.70 -0.14 0.00 -1.47 0.00 0.00 33.84 33.45 2k75 n VAL 16 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2k75 s SER 17 N -2.41 1.61 0.09 -1.34 0.01 -0.76 0.51 113.70 111.41 2k75 s SER 17 Ca 0.16 -0.40 -0.01 0.00 1.31 0.00 0.00 55.95 57.01 2k75 s SER 17 Cb -0.02 -0.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.05 2k75 s SER 17 CO 0.11 0.06 0.01 0.68 0.41 0.00 0.00 173.24 174.52 2k75 s VAL 18 N -0.71 0.18 -0.04 3.43 -7.23 0.28 -2.32 120.40 113.97 2k75 s VAL 18 Ca 0.02 -1.86 -0.02 0.00 -1.81 0.00 0.00 61.98 58.32 2k75 s VAL 18 Cb -0.07 -1.78 0.03 0.00 0.56 0.00 0.00 36.38 35.12 2k75 s VAL 18 CO 0.01 -0.74 0.09 -0.51 -0.31 0.00 0.00 175.10 173.64 2k75 s ILE 19 N -3.97 -0.08 0.00 -0.62 1.10 -1.26 -1.20 121.20 115.16 2k75 s ILE 19 Ca 0.15 0.24 0.00 0.00 -0.51 0.00 0.00 60.65 60.54 2k75 s ILE 19 Cb 0.08 -0.16 0.00 0.00 0.15 0.00 0.00 42.46 42.52 2k75 s ILE 19 CO -0.04 0.10 0.00 0.61 -2.11 0.00 0.00 174.94 173.50 2k75 n GLY 20 N 4.43 0.55 3.61 1.50 0.00 -1.14 -4.72 105.19 109.42 2k75 n GLY 20 Ca -0.22 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.69 2k75 n GLY 20 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k75 s LYS 21 N -1.56 2.61 -0.11 1.61 -2.85 -0.97 -2.19 119.74 116.28 2k75 s LYS 21 Ca 0.00 -0.69 -0.14 0.00 -1.00 0.00 0.00 55.97 54.14 2k75 s LYS 21 Cb 0.00 -2.54 -0.05 0.00 -2.06 0.00 0.00 37.83 33.18 2k75 s LYS 21 CO 0.00 0.61 0.34 0.42 0.10 0.00 0.00 175.35 176.82 2k75 s ILE 22 N -1.01 5.23 0.05 3.79 -1.09 -1.03 -2.52 121.20 124.63 2k75 s ILE 22 Ca 0.17 0.66 -0.04 0.00 -2.23 0.00 0.00 60.65 59.21 2k75 s ILE 22 Cb -0.11 -3.66 -0.02 0.00 -1.58 0.00 0.00 42.46 37.09 2k75 s ILE 22 CO 0.08 0.45 0.07 0.28 -1.23 0.00 0.00 174.94 174.58 2k75 s THR 23 N -0.03 0.16 -0.58 2.92 -1.32 -0.41 0.98 115.64 117.36 2k75 s THR 23 Ca 0.20 -1.30 -0.03 0.00 -1.21 0.00 0.00 61.69 59.35 2k75 s THR 23 Cb -0.14 -1.10 -0.03 0.00 -1.51 0.00 0.00 72.50 69.71 2k75 s THR 23 CO 0.07 -0.71 0.52 0.61 -2.21 0.00 0.00 174.62 172.90 2k75 n GLY 24 N 0.50 -0.44 3.71 6.08 0.00 -1.26 -0.90 105.19 112.88 2k75 n GLY 24 Ca -0.17 0.23 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 2k75 n GLY 24 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k75 s ILE 25 N -3.18 4.43 -0.10 -0.61 -1.09 -1.26 -3.82 121.20 115.57 2k75 s ILE 25 Ca 0.21 1.74 0.00 0.00 -2.23 0.00 0.00 60.65 60.38 2k75 s ILE 25 Cb -0.03 -4.12 0.02 0.00 -1.58 0.00 0.00 42.46 36.76 2k75 s ILE 25 CO 0.44 0.13 -0.08 -1.00 -1.23 0.00 0.00 174.94 173.20 2k75 s HIS 26 N 1.09 1.37 0.07 3.97 3.76 0.10 -4.95 115.29 120.70 2k75 s HIS 26 Ca 0.55 -0.62 -0.23 0.00 -0.15 0.00 0.00 55.06 54.61 2k75 s HIS 26 Cb -0.25 -1.13 -0.06 0.00 1.11 0.00 0.00 32.58 32.24 2k75 s HIS 26 CO 0.28 -0.43 0.69 0.21 -0.85 0.00 0.00 174.74 174.64 2k75 s LYS 27 N 1.46 4.42 -0.09 1.40 2.20 -1.26 -0.85 119.74 127.01 2k75 s LYS 27 Ca -0.00 0.95 -0.08 0.00 -0.36 0.00 0.00 55.97 56.47 2k75 s LYS 27 Cb -0.13 -3.31 0.02 0.00 -1.51 0.00 0.00 37.83 32.90 2k75 s LYS 27 CO -0.05 0.44 0.24 0.21 -0.36 0.00 0.00 175.35 175.83 2k75 s LYS 28 N -0.54 0.28 0.08 4.03 2.47 -0.39 -4.98 119.74 120.69 2k75 s LYS 28 Ca 0.34 0.34 0.08 0.00 -1.56 0.00 0.00 55.97 55.16 2k75 s LYS 28 Cb -0.20 0.13 -0.04 0.00 -1.46 0.00 0.00 37.83 36.26 2k75 s LYS 28 CO 0.22 -0.04 -0.15 -1.21 0.16 0.00 0.00 175.35 174.33 2k75 s GLU 29 N 0.14 2.00 0.08 4.03 2.02 -1.26 -0.75 118.70 124.96 2k75 s GLU 29 Ca -0.00 -1.05 -0.09 0.00 0.02 0.00 0.00 54.97 53.84 2k75 s GLU 29 Cb -0.02 -2.21 0.00 0.00 0.10 0.00 0.00 34.13 32.01 2k75 s GLU 29 CO 0.00 0.51 0.20 1.52 0.02 0.00 0.00 175.26 177.52 2k75 s TYR 30 N -1.09 0.12 -0.24 1.61 1.13 -0.94 -4.96 117.35 112.98 2k75 s TYR 30 Ca 0.18 -0.51 -0.25 0.00 -1.41 0.00 0.00 57.07 55.07 2k75 s TYR 30 Cb -0.11 -0.04 -0.00 0.00 -1.10 0.00 0.00 41.96 40.71 2k75 s TYR 30 CO 0.09 -0.54 0.87 -2.00 -2.51 0.00 0.00 175.55 171.46 2k75 s GLU 31 N -3.68 4.20 -0.23 -3.49 2.12 -1.26 -1.63 118.70 114.72 2k75 s GLU 31 Ca 0.03 1.02 0.02 0.00 0.36 0.00 0.00 54.97 56.40 2k75 s GLU 31 Cb 0.04 -3.64 0.04 0.00 0.26 0.00 0.00 34.13 30.83 2k75 s GLU 31 CO -0.10 -0.54 -0.14 -1.12 -0.54 0.00 0.00 175.26 172.82 2k75 s SER 32 N 1.32 3.96 -1.40 -1.70 0.01 0.11 -4.67 113.70 111.33 2k75 s SER 32 Ca 0.36 -1.07 -0.02 0.00 1.31 0.00 0.00 55.95 56.53 2k75 s SER 32 Cb -0.15 -1.54 0.01 0.00 0.21 0.00 0.00 66.02 64.55 2k75 s SER 32 CO 0.07 -0.12 0.20 0.47 0.41 0.00 0.00 173.24 174.28 2k75 n ASP 33 N 4.53 -4.91 0.00 2.44 8.00 -1.26 0.24 116.55 125.59 2k75 n ASP 33 Ca -0.17 -0.06 0.00 0.00 0.71 0.00 0.00 54.79 55.28 2k75 n ASP 33 Cb 0.45 -4.08 0.00 0.00 -0.02 0.00 0.00 41.12 37.47 2k75 n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k75 n GLY 34 N -1.07 0.70 3.19 0.44 0.00 -1.26 -5.02 105.19 102.16 2k75 n GLY 34 Ca -0.15 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.62 1.97 0.22 2.61 2.01 0.14 -5.10 115.64 114.87 2k75 s THR 35 Ca 0.00 -0.95 -0.30 0.00 0.31 0.00 0.00 61.69 60.75 2k75 s THR 35 Cb 0.00 -1.72 -0.09 0.00 0.01 0.00 0.00 72.50 70.70 2k75 s THR 35 CO 0.00 0.54 1.35 -0.89 -0.69 0.00 0.00 174.62 174.93 2k75 s THR 36 N 0.51 3.03 0.05 -0.82 2.01 -1.26 0.05 115.64 119.21 2k75 s THR 36 Ca -0.15 0.86 0.04 0.00 0.31 0.00 0.00 61.69 62.75 2k75 s THR 36 Cb -0.17 -3.55 -0.02 0.00 0.01 0.00 0.00 72.50 68.77 2k75 s THR 36 CO 0.05 0.13 -0.13 -0.54 -0.69 0.00 0.00 174.62 173.45 2k75 s LYS 37 N -0.23 0.80 -0.16 4.92 -0.14 -0.65 -4.89 119.74 119.40 2k75 s LYS 37 Ca 0.57 -0.78 -0.09 0.00 -1.36 0.00 0.00 55.97 54.32 2k75 s LYS 37 Cb -0.38 -0.77 -0.04 0.00 -1.68 0.00 0.00 37.83 34.95 2k75 s LYS 37 CO 0.40 0.18 0.14 0.45 -0.76 0.00 0.00 175.35 175.76 2k75 s SER 38 N -1.32 6.31 -0.01 2.83 0.15 -1.26 -2.22 113.70 118.18 2k75 s SER 38 Ca -0.01 0.36 0.02 0.00 0.70 0.00 0.00 55.95 57.02 2k75 s SER 38 Cb -0.08 -2.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.14 2k75 s SER 38 CO 0.01 0.30 -0.06 0.54 1.20 0.00 0.00 173.24 175.23 2k75 s VAL 39 N -0.35 0.51 -0.14 4.45 0.11 0.07 -2.16 120.40 122.90 2k75 s VAL 39 Ca 0.12 -0.25 -0.05 0.00 -2.93 0.00 0.00 61.98 58.87 2k75 s VAL 39 Cb -0.12 -0.45 -0.04 0.00 -1.53 0.00 0.00 36.38 34.25 2k75 s VAL 39 CO 0.01 0.16 0.03 -0.31 -3.33 0.00 0.00 175.10 171.66 2k75 s TYR 40 N 0.05 3.21 0.12 1.54 2.02 0.03 -1.26 117.35 123.05 2k75 s TYR 40 Ca -0.00 0.09 0.09 0.00 -0.37 0.00 0.00 57.07 56.88 2k75 s TYR 40 Cb -0.05 -1.94 -0.04 0.00 -0.40 0.00 0.00 41.96 39.53 2k75 s TYR 40 CO -0.00 0.29 -0.22 -0.65 -1.57 0.00 0.00 175.55 173.39 2k75 s GLN 41 N -0.20 1.23 0.00 -0.62 -0.21 -0.03 0.22 119.66 120.06 2k75 s GLN 41 Ca 0.06 -1.26 0.00 0.00 0.02 0.00 0.00 55.36 54.18 2k75 s GLN 41 Cb -0.12 -1.54 0.00 0.00 1.00 0.00 0.00 33.01 32.35 2k75 s GLN 41 CO 0.02 0.35 0.00 0.41 -2.12 0.00 0.00 175.29 173.95 2k75 n GLY 42 N 0.90 1.72 3.04 3.09 0.00 -1.03 0.02 105.19 112.94 2k75 n GLY 42 Ca -0.18 -0.23 -0.18 0.00 0.00 0.00 0.00 46.02 45.43 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 -0.57 0.85 -0.08 1.61 1.51 -0.08 -2.30 117.35 118.29 2k75 s TYR 43 Ca 0.00 -0.21 0.03 0.00 -1.01 0.00 0.00 57.07 55.88 2k75 s TYR 43 Cb 0.00 -0.54 -0.02 0.00 -0.11 0.00 0.00 41.96 41.30 2k75 s TYR 43 CO 0.00 -0.01 -0.17 -1.50 -1.11 0.00 0.00 175.55 172.75 2k75 s ILE 44 N -0.39 2.73 0.06 2.71 2.07 0.07 -1.29 121.20 127.16 2k75 s ILE 44 Ca 0.02 -0.81 0.04 0.00 -1.41 0.00 0.00 60.65 58.49 2k75 s ILE 44 Cb -0.05 -2.08 -0.03 0.00 0.13 0.00 0.00 42.46 40.44 2k75 s ILE 44 CO -0.00 0.56 -0.11 -0.70 -1.91 0.00 0.00 174.94 172.78 2k75 s GLU 45 N -0.11 0.68 -0.33 3.50 2.12 -1.05 -1.61 118.70 121.91 2k75 s GLU 45 Ca -0.03 -0.87 -0.01 0.00 0.36 0.00 0.00 54.97 54.42 2k75 s GLU 45 Cb -0.14 -0.56 0.19 0.00 0.26 0.00 0.00 34.13 33.87 2k75 s GLU 45 CO 0.04 0.12 0.82 0.34 -0.54 0.00 0.00 175.26 176.03 2k75 s ASP 46 N -1.70 -1.01 0.00 -1.70 -1.08 -1.00 -2.28 116.67 107.91 2k75 s ASP 46 Ca -0.05 -0.15 0.00 0.00 -0.52 0.00 0.00 52.55 51.82 2k75 s ASP 46 Cb -0.10 1.47 0.00 0.00 -1.46 0.00 0.00 42.92 42.84 2k75 s ASP 46 CO 0.01 -0.15 0.00 -0.67 0.52 0.00 0.00 175.17 174.88 2k75 n ASP 47 N 4.74 0.00 0.00 -0.34 2.03 -1.26 -3.80 116.55 117.92 2k75 n ASP 47 Ca 0.08 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.39 2k75 n ASP 47 Cb 0.58 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.98 2k75 n ASP 47 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2k75 n THR 48 N 0.00 0.00 -1.45 5.18 -1.04 -1.26 -4.92 114.28 110.79 2k75 n THR 48 Ca 0.00 0.92 0.00 0.00 -2.04 0.00 0.00 64.05 62.93 2k75 n THR 48 Cb 0.00 -1.33 0.00 0.00 -1.82 0.00 0.00 70.33 67.18 2k75 n THR 48 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2k75 n ALA 49 N -1.42 0.00 -2.77 2.41 0.00 -1.25 -4.99 120.51 112.49 2k75 n ALA 49 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2k75 n ALA 49 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 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 1.60 0.43 0.16 0.00 1.70 -1.26 -2.37 118.95 119.21 2k75 s ARG 50 Ca 0.00 -0.78 -0.12 0.00 -0.47 0.00 0.00 55.73 54.36 2k75 s ARG 50 Cb 0.00 0.03 0.01 0.00 -0.57 0.00 0.00 34.95 34.42 2k75 s ARG 50 CO 0.00 -0.04 0.35 -1.50 -1.08 0.00 0.00 175.30 173.04 2k75 s ILE 51 N -1.95 0.07 0.42 4.99 2.07 -0.63 -4.95 121.20 121.22 2k75 s ILE 51 Ca -0.10 -1.06 -0.22 0.00 -1.41 0.00 0.00 60.65 57.86 2k75 s ILE 51 Cb -0.06 -1.59 -0.11 0.00 0.13 0.00 0.00 42.46 40.83 2k75 s ILE 51 CO -0.02 -0.30 0.96 -0.13 -1.91 0.00 0.00 174.94 173.54 2k75 s ARG 52 N -3.90 4.22 0.13 3.50 0.52 -1.26 -0.75 118.95 121.41 2k75 s ARG 52 Ca 0.11 1.18 -0.03 0.00 -0.52 0.00 0.00 55.73 56.47 2k75 s ARG 52 Cb 0.02 -2.26 -0.03 0.00 0.52 0.00 0.00 34.95 33.20 2k75 s ARG 52 CO -0.04 -0.04 0.10 0.96 0.02 0.00 0.00 175.30 176.29 2k75 s ILE 53 N -2.07 0.11 -0.03 1.52 -0.00 -0.97 -2.18 121.20 117.58 2k75 s ILE 53 Ca 0.61 -1.76 -0.01 0.00 -0.00 0.00 0.00 60.65 59.49 2k75 s ILE 53 Cb -0.11 -1.91 0.03 0.00 -0.00 0.00 0.00 42.46 40.47 2k75 s ILE 53 CO 0.15 -0.51 0.05 -0.94 -0.00 0.00 0.00 174.94 173.70 2k75 s SER 54 N -3.01 0.35 -0.25 4.36 1.04 0.56 -2.45 113.70 114.30 2k75 s SER 54 Ca 0.20 0.08 -0.05 0.00 0.48 0.00 0.00 55.95 56.66 2k75 s SER 54 Cb 0.07 -0.05 -0.00 0.00 0.10 0.00 0.00 66.02 66.13 2k75 s SER 54 CO -0.01 -0.17 0.01 -0.55 0.98 0.00 0.00 173.24 173.51 2k75 s SER 55 N 1.41 4.71 -0.22 7.02 0.15 0.13 -0.76 113.70 126.14 2k75 s SER 55 Ca -0.05 -0.49 -0.15 0.00 0.70 0.00 0.00 55.95 55.96 2k75 s SER 55 Cb -0.13 -1.81 -0.04 0.00 -1.71 0.00 0.00 66.02 62.33 2k75 s SER 55 CO -0.03 -0.08 0.36 -0.36 1.20 0.00 0.00 173.24 174.33 2k75 s PHE 56 N 1.50 3.33 0.00 3.44 0.08 -0.95 -0.79 117.98 124.58 2k75 s PHE 56 Ca 0.04 0.51 0.00 0.00 0.12 0.00 0.00 56.93 57.61 2k75 s PHE 56 Cb -0.15 -2.51 0.00 0.00 -0.57 0.00 0.00 43.02 39.79 2k75 s PHE 56 CO -0.00 -0.06 0.00 0.41 -0.10 0.00 0.00 175.22 175.47 2k75 n GLY 57 N 4.17 1.20 3.72 4.36 0.00 -0.92 -4.63 105.19 113.08 2k75 n GLY 57 Ca -0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.54 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 4.41 0.17 1.61 -0.14 -1.26 -5.05 119.74 119.48 2k75 s LYS 58 Ca 0.00 0.77 -0.13 0.00 -1.36 0.00 0.00 55.97 55.25 2k75 s LYS 58 Cb 0.00 -3.44 -0.07 0.00 -1.68 0.00 0.00 37.83 32.64 2k75 s LYS 58 CO 0.00 0.10 0.55 -1.14 -0.76 0.00 0.00 175.35 174.09 2k75 s GLN 59 N 0.73 3.93 0.07 1.68 0.74 -1.26 -4.71 119.66 120.83 2k75 s GLN 59 Ca 0.35 0.43 0.04 0.00 0.05 0.00 0.00 55.36 56.22 2k75 s GLN 59 Cb -0.17 -2.85 -0.03 0.00 1.10 0.00 0.00 33.01 31.06 2k75 s GLN 59 CO 0.16 0.43 -0.11 -0.51 -0.55 0.00 0.00 175.29 174.71 2k75 s LEU 60 N -2.21 2.31 0.07 3.68 1.43 -1.26 -5.15 118.68 117.55 2k75 s LEU 60 Ca 0.41 -0.65 0.06 0.00 -1.03 0.00 0.00 54.13 52.92 2k75 s LEU 60 Cb -0.14 -0.37 -0.04 0.00 0.03 0.00 0.00 46.19 45.67 2k75 s LEU 60 CO 0.20 -0.16 -0.09 -1.10 0.23 0.00 0.00 176.35 175.43 2k75 s GLN 61 N -1.97 2.26 0.28 1.70 -0.21 -1.26 -5.03 119.66 115.43 2k75 s GLN 61 Ca -0.02 -0.93 -0.30 0.00 0.02 0.00 0.00 55.36 54.13 2k75 s GLN 61 Cb -0.08 -2.36 -0.10 0.00 1.00 0.00 0.00 33.01 31.46 2k75 s GLN 61 CO 0.01 0.53 1.41 0.34 -2.12 0.00 0.00 175.29 175.47 2k75 s ASP 62 N -1.97 6.65 0.00 5.90 -1.08 -1.26 -2.12 116.67 122.79 2k75 s ASP 62 Ca 0.20 2.71 0.00 0.00 -0.52 0.00 0.00 52.55 54.94 2k75 s ASP 62 Cb -0.11 -2.63 0.00 0.00 -1.46 0.00 0.00 42.92 38.72 2k75 s ASP 62 CO 0.12 -0.68 0.00 -1.54 0.52 0.00 0.00 175.17 173.59 2k75 n SER 63 N 1.79 -2.50 -4.66 -0.34 3.41 0.28 -4.97 113.62 106.62 2k75 n SER 63 Ca 0.05 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.24 2k75 n SER 63 Cb 0.40 -1.01 -0.04 0.00 -0.26 0.00 0.00 64.21 63.31 2k75 n SER 63 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2k75 s ASP 64 N -2.25 6.95 -0.26 4.04 -1.08 -0.90 -4.80 116.67 118.37 2k75 s ASP 64 Ca 0.00 1.17 -0.24 0.00 -0.52 0.00 0.00 52.55 52.96 2k75 s ASP 64 Cb 0.00 -2.46 -0.00 0.00 -1.46 0.00 0.00 42.92 38.99 2k75 s ASP 64 CO 0.00 -0.45 0.81 -0.69 0.52 0.00 0.00 175.17 175.36 2k75 s VAL 65 N 2.38 4.83 0.09 1.11 1.01 -1.26 -2.46 120.40 126.10 2k75 s VAL 65 Ca 0.38 1.45 0.01 0.00 0.00 0.00 0.00 61.98 63.82 2k75 s VAL 65 Cb -0.16 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 2k75 s VAL 65 CO 0.11 -0.12 -0.04 0.68 0.00 0.00 0.00 175.10 175.72 2k75 s VAL 66 N 2.87 0.50 -0.17 2.92 -7.23 -0.93 -2.06 120.40 116.30 2k75 s VAL 66 Ca 0.34 -1.89 -0.00 0.00 -1.81 0.00 0.00 61.98 58.61 2k75 s VAL 66 Cb -0.15 -1.67 0.00 0.00 0.56 0.00 0.00 36.38 35.13 2k75 s VAL 66 CO 0.09 -0.88 -0.14 -0.60 -0.31 0.00 0.00 175.10 173.26 2k75 s ARG 67 N -3.88 3.20 -0.16 4.82 3.52 -0.08 -2.88 118.95 123.49 2k75 s ARG 67 Ca 0.11 -0.75 -0.05 0.00 -0.13 0.00 0.00 55.73 54.92 2k75 s ARG 67 Cb 0.06 -2.67 -0.03 0.00 -1.56 0.00 0.00 34.95 30.75 2k75 s ARG 67 CO -0.06 -0.06 -0.01 0.42 -0.81 0.00 0.00 175.30 174.78 2k75 s ILE 68 N 1.01 4.17 0.04 4.11 1.01 -0.34 -1.36 121.20 129.84 2k75 s ILE 68 Ca -0.01 -0.26 0.07 0.00 0.00 0.00 0.00 60.65 60.45 2k75 s ILE 68 Cb -0.15 -2.84 -0.03 0.00 0.01 0.00 0.00 42.46 39.45 2k75 s ILE 68 CO -0.03 0.49 -0.20 -1.81 0.00 0.00 0.00 174.94 173.39 2k75 s ASP 69 N 0.31 3.66 -1.18 3.58 1.01 -0.68 -0.56 116.67 122.82 2k75 s ASP 69 Ca -0.01 -0.45 -0.04 0.00 0.71 0.00 0.00 52.55 52.75 2k75 s ASP 69 Cb -0.14 -0.55 0.00 0.00 1.01 0.00 0.00 42.92 43.25 2k75 s ASP 69 CO 0.02 0.26 0.53 -3.20 0.21 0.00 0.00 175.17 172.99 2k75 n ASN 70 N 1.65 -5.12 -4.77 0.27 5.15 0.80 -2.43 115.26 110.81 2k75 n ASN 70 Ca -0.16 -0.25 -0.37 0.00 -0.60 0.00 0.00 54.58 53.20 2k75 n ASN 70 Cb 0.52 -3.94 -0.01 0.00 -0.53 0.00 0.00 39.78 35.83 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 -3.06 2.97 -0.24 5.20 0.00 0.18 -4.61 121.76 122.21 2k75 s ALA 71 Ca 0.26 0.98 -0.10 0.00 0.00 0.00 0.00 51.96 53.10 2k75 s ALA 71 Cb -0.12 -3.40 -0.05 0.00 0.00 0.00 0.00 23.12 19.55 2k75 s ALA 71 CO 0.33 -0.72 0.15 0.50 0.00 0.00 0.00 175.76 176.02 2k75 s ARG 72 N -2.69 4.06 0.01 0.00 3.52 -0.75 -2.30 118.95 120.81 2k75 s ARG 72 Ca 0.64 -0.28 -0.24 0.00 -0.13 0.00 0.00 55.73 55.72 2k75 s ARG 72 Cb -0.30 -3.52 -0.05 0.00 -1.56 0.00 0.00 34.95 29.52 2k75 s ARG 72 CO 0.36 0.07 0.75 0.08 -0.81 0.00 0.00 175.30 175.75 2k75 s VAL 73 N 1.03 4.83 0.15 7.11 1.01 -0.98 0.12 120.40 133.67 2k75 s VAL 73 Ca 0.07 1.58 -0.07 0.00 0.00 0.00 0.00 61.98 63.57 2k75 s VAL 73 Cb -0.13 -4.09 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 2k75 s VAL 73 CO 0.04 0.33 0.21 0.00 0.00 0.00 0.00 175.10 175.69 2k75 s ALA 74 N 0.19 0.23 -0.33 5.51 0.00 -0.65 -4.94 121.76 121.76 2k75 s ALA 74 Ca 0.38 -1.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.21 2k75 s ALA 74 Cb -0.20 0.83 -0.00 0.00 0.00 0.00 0.00 23.12 23.75 2k75 s ALA 74 CO 0.22 -0.59 0.19 -0.65 0.00 0.00 0.00 175.76 174.92 2k75 s GLN 75 N -3.98 3.26 -0.21 0.00 -0.21 -1.26 -1.47 119.66 115.78 2k75 s GLN 75 Ca 0.18 -0.78 -0.04 0.00 0.02 0.00 0.00 55.36 54.73 2k75 s GLN 75 Cb 0.05 -3.66 -0.02 0.00 1.00 0.00 0.00 33.01 30.38 2k75 s GLN 75 CO -0.00 -0.49 -0.02 -0.06 -2.12 0.00 0.00 175.29 172.60 2k75 s PHE 76 N 1.63 2.99 -1.45 0.91 0.08 0.15 -4.49 117.98 117.80 2k75 s PHE 76 Ca 0.04 -0.71 -0.02 0.00 0.12 0.00 0.00 56.93 56.36 2k75 s PHE 76 Cb -0.18 -2.10 0.01 0.00 -0.57 0.00 0.00 43.02 40.18 2k75 s PHE 76 CO 0.07 -0.42 0.14 0.09 -0.10 0.00 0.00 175.22 175.00 2k75 n ASN 77 N 4.59 -5.05 -0.03 1.36 5.03 -1.26 0.07 115.26 119.98 2k75 n ASN 77 Ca -0.18 -0.01 -0.00 0.00 0.87 0.00 0.00 54.58 55.26 2k75 n ASN 77 Cb 0.51 -4.20 -0.00 0.00 -1.02 0.00 0.00 39.78 35.07 2k75 n ASN 77 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2k75 n GLY 78 N -1.03 0.47 3.26 7.41 0.00 -1.26 -5.02 105.19 109.02 2k75 n GLY 78 Ca -0.17 -0.32 -0.30 0.00 0.00 0.00 0.00 46.02 45.23 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 -1.97 2.19 0.30 1.61 2.02 0.11 -5.09 117.35 116.52 2k75 s TYR 79 Ca 0.00 -0.49 -0.29 0.00 -0.37 0.00 0.00 57.07 55.92 2k75 s TYR 79 Cb 0.00 -1.42 -0.10 0.00 -0.40 0.00 0.00 41.96 40.04 2k75 s TYR 79 CO 0.00 -0.09 1.18 -0.51 -1.57 0.00 0.00 175.55 174.56 2k75 s LEU 80 N -0.42 4.50 0.17 -1.29 1.43 -1.26 0.34 118.68 122.15 2k75 s LEU 80 Ca 0.05 2.43 -0.18 0.00 -1.03 0.00 0.00 54.13 55.41 2k75 s LEU 80 Cb -0.11 -3.63 0.03 0.00 0.03 0.00 0.00 46.19 42.51 2k75 s LEU 80 CO 0.00 -0.30 0.50 -0.55 0.23 0.00 0.00 176.35 176.23 2k75 s SER 81 N -0.69 -0.29 -0.20 2.29 0.15 -0.54 -4.26 113.70 110.16 2k75 s SER 81 Ca 0.46 -0.39 -0.08 0.00 0.70 0.00 0.00 55.95 56.65 2k75 s SER 81 Cb -0.35 0.56 -0.04 0.00 -1.71 0.00 0.00 66.02 64.48 2k75 s SER 81 CO 0.45 -1.00 0.08 -0.76 1.20 0.00 0.00 173.24 173.21 2k75 s LEU 82 N -2.84 3.80 -0.19 3.45 1.43 -0.92 -1.64 118.68 121.76 2k75 s LEU 82 Ca 0.07 0.04 -0.05 0.00 -1.03 0.00 0.00 54.13 53.16 2k75 s LEU 82 Cb -0.00 -1.98 -0.03 0.00 0.03 0.00 0.00 46.19 44.21 2k75 s LEU 82 CO -0.06 0.13 0.01 -0.55 0.23 0.00 0.00 176.35 176.11 2k75 s SER 83 N 0.64 5.03 -0.43 2.29 0.15 0.12 -0.32 113.70 121.17 2k75 s SER 83 Ca 0.04 -0.12 -0.12 0.00 0.70 0.00 0.00 55.95 56.45 2k75 s SER 83 Cb -0.13 -1.85 0.07 0.00 -1.71 0.00 0.00 66.02 62.39 2k75 s SER 83 CO 0.01 0.11 0.31 -0.69 1.20 0.00 0.00 173.24 174.18 2k75 s VAL 84 N 0.73 4.73 0.78 4.45 1.01 0.06 -1.80 120.40 130.36 2k75 s VAL 84 Ca 0.01 -1.15 -0.02 0.00 0.00 0.00 0.00 61.98 60.81 2k75 s VAL 84 Cb -0.14 -3.81 0.16 0.00 0.00 0.00 0.00 36.38 32.58 2k75 s VAL 84 CO 0.02 -0.49 1.07 -0.83 0.00 0.00 0.00 175.10 174.87 2k75 s GLY 85 N 2.20 1.76 0.24 4.51 0.00 -1.26 -2.25 107.32 112.52 2k75 s GLY 85 Ca 0.03 -1.80 -0.04 0.00 0.00 0.00 0.00 44.72 42.92 2k75 s GLY 85 CO 0.05 -1.15 1.73 -1.80 0.00 0.00 0.00 173.10 171.93 2k75 h ASP 86 N -0.75 0.83 -0.58 1.64 3.58 -1.98 -2.68 116.42 116.48 2k75 h ASP 86 Ca -0.36 -0.21 -0.00 0.00 0.42 0.00 0.00 57.03 56.88 2k75 h ASP 86 Cb 1.25 -0.22 -0.03 0.00 1.72 0.00 0.00 39.33 42.05 2k75 h ASP 86 CO 0.36 0.89 0.35 0.28 -2.88 0.00 0.00 179.24 178.25 2k75 h SER 87 N 0.80 0.71 -3.99 2.28 0.02 -1.99 -3.43 113.55 107.95 2k75 h SER 87 Ca 0.15 -0.04 -0.49 0.00 -0.84 0.00 0.00 61.79 60.57 2k75 h SER 87 Cb 0.48 -0.18 0.18 0.00 0.14 0.00 0.00 62.40 63.02 2k75 h SER 87 CO 0.02 0.55 0.18 -0.94 -1.14 0.00 0.00 176.83 175.50 2k75 s SER 88 N -6.51 2.69 -0.06 3.07 1.04 -1.01 -5.02 113.70 107.89 2k75 s SER 88 Ca -0.10 1.86 0.02 0.00 0.48 0.00 0.00 55.95 58.21 2k75 s SER 88 Cb 0.17 -2.43 -0.03 0.00 0.10 0.00 0.00 66.02 63.83 2k75 s SER 88 CO 0.77 -3.19 -0.09 -0.13 0.98 0.00 0.00 173.24 171.58 2k75 s ARG 89 N -4.68 2.68 -0.08 4.02 0.52 -1.02 -4.90 118.95 115.50 2k75 s ARG 89 Ca 0.66 -0.59 0.04 0.00 -0.52 0.00 0.00 55.73 55.32 2k75 s ARG 89 Cb -0.22 -2.54 0.00 0.00 0.52 0.00 0.00 34.95 32.72 2k75 s ARG 89 CO 0.59 0.65 -0.20 0.42 0.02 0.00 0.00 175.30 176.79 2k75 s ILE 90 N -0.79 1.71 -0.24 1.52 1.01 -1.26 -1.68 121.20 121.47 2k75 s ILE 90 Ca 0.12 -0.83 -0.00 0.00 0.00 0.00 0.00 60.65 59.94 2k75 s ILE 90 Cb -0.11 -1.49 0.07 0.00 0.01 0.00 0.00 42.46 40.94 2k75 s ILE 90 CO 0.01 0.48 -0.01 -0.70 0.00 0.00 0.00 174.94 174.72 2k75 s GLU 91 N 0.33 1.30 0.31 2.79 2.12 -0.46 -5.01 118.70 120.07 2k75 s GLU 91 Ca -0.14 -0.90 -0.28 0.00 0.36 0.00 0.00 54.97 54.01 2k75 s GLU 91 Cb -0.16 -2.45 -0.10 0.00 0.26 0.00 0.00 34.13 31.69 2k75 s GLU 91 CO 0.06 -0.66 1.14 0.45 -0.54 0.00 0.00 175.26 175.71 2k75 s SER 92 N 1.50 7.06 -0.23 -1.70 0.15 -1.26 -0.90 113.70 118.33 2k75 s SER 92 Ca -0.03 2.33 -0.12 0.00 0.70 0.00 0.00 55.95 58.84 2k75 s SER 92 Cb -0.18 -2.63 -0.10 0.00 -1.71 0.00 0.00 66.02 61.40 2k75 s SER 92 CO -0.08 -0.29 -0.30 0.52 1.20 0.00 0.00 173.24 174.28 2k75 n VAL 93 N 0.91 1.30 -2.75 4.45 0.31 -0.87 -4.88 118.33 116.79 2k75 n VAL 93 Ca 0.00 -0.28 -0.02 0.00 -0.01 0.00 0.00 64.34 64.03 2k75 n VAL 93 Cb 0.45 -1.85 -0.02 0.00 -0.91 0.00 0.00 33.84 31.50 2k75 n VAL 93 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2k75 n ASN 94 N -4.07 -4.32 -4.59 4.52 5.03 -1.08 -4.73 115.26 106.02 2k75 n ASN 94 Ca -0.43 1.18 -0.42 0.00 0.87 0.00 0.00 54.58 55.78 2k75 n ASN 94 Cb 0.79 -3.22 -0.03 0.00 -1.02 0.00 0.00 39.78 36.30 2k75 n ASN 94 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2k75 s VAL 95 N -0.30 3.73 -0.28 2.41 1.01 -1.26 -4.92 120.40 120.79 2k75 s VAL 95 Ca -0.11 0.68 -0.03 0.00 0.00 0.00 0.00 61.98 62.52 2k75 s VAL 95 Cb 0.01 -4.15 0.16 0.00 0.00 0.00 0.00 36.38 32.39 2k75 s VAL 95 CO 0.30 -0.85 0.53 0.20 0.00 0.00 0.00 175.10 175.29 2k75 s ASN 96 N 4.93 -0.82 -0.44 3.32 0.01 -1.26 -5.09 114.94 115.59 2k75 s ASN 96 Ca 0.62 0.80 0.05 0.00 -0.71 0.00 0.00 52.86 53.62 2k75 s ASN 96 Cb -0.14 1.83 0.19 0.00 0.41 0.00 0.00 41.25 43.54 2k75 s ASN 96 CO 0.29 -0.26 0.48 2.30 -1.51 0.00 0.00 177.10 178.39 2k75 n ILE 97 N 5.41 -0.83 -1.72 0.60 -5.35 -1.26 -5.13 119.36 111.08 2k75 n ILE 97 Ca -0.04 -2.80 -0.39 0.00 -0.27 0.00 0.00 62.75 59.25 2k75 n ILE 97 Cb 0.50 -0.90 0.04 0.00 -1.74 0.00 0.00 39.64 37.54 2k75 n ILE 97 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 2k75 n PRO 98 N 2.68 1.59 -2.37 6.28 -0.02 -1.26 -4.49 135.00 137.41 2k75 n PRO 98 Ca 0.25 0.59 -0.01 0.00 -2.02 0.00 0.00 63.50 62.31 2k75 n PRO 98 Cb 0.51 -2.48 -0.01 0.00 -0.02 0.00 0.00 33.50 31.50 2k75 n PRO 98 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2k75 n LEU 99 N -0.80 -5.67 -4.75 2.45 4.32 -1.26 -4.85 117.00 106.43 2k75 n LEU 99 Ca 0.10 2.51 -0.39 0.00 -0.02 0.00 0.00 56.01 58.21 2k75 n LEU 99 Cb 0.44 -3.00 0.03 0.00 -1.62 0.00 0.00 43.42 39.27 2k75 n LEU 99 CO 0.53 -2.94 1.03 -1.84 -1.22 0.00 0.00 177.39 172.96 2k75 n GLU 100 N 1.88 2.04 -1.38 3.23 0.28 -1.26 -4.83 120.64 120.60 2k75 n GLU 100 Ca -0.06 0.73 -0.43 0.00 -0.16 0.00 0.00 57.16 57.24 2k75 n GLU 100 Cb 0.10 -2.60 -0.03 0.00 1.43 0.00 0.00 31.44 30.33 2k75 n GLU 100 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 2k75 n HIS 101 N -0.51 2.54 -0.24 -1.84 8.25 -1.26 -4.63 115.22 117.52 2k75 n HIS 101 Ca 0.07 -2.28 -0.08 0.00 -0.26 0.00 0.00 57.72 55.17 2k75 n HIS 101 Cb 0.42 -2.05 0.04 0.00 1.12 0.00 0.00 29.99 29.52 2k75 n HIS 101 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 2k75 h HIS 102 N 7.13 1.18 -0.22 4.41 2.76 -2.01 -3.33 115.15 125.07 2k75 h HIS 102 Ca 0.48 -0.16 -0.53 0.00 -2.20 0.00 0.00 60.37 57.96 2k75 h HIS 102 Cb 0.66 -0.32 0.01 0.00 1.55 0.00 0.00 27.41 29.30 2k75 h HIS 102 CO 1.33 0.98 1.85 1.58 -1.30 0.00 0.00 177.93 182.37 2k75 n HIS 103 N -4.22 2.39 0.01 5.26 -0.00 -1.26 -4.63 115.22 112.76 2k75 n HIS 103 Ca 0.04 -1.76 -0.01 0.00 0.46 0.00 0.00 57.72 56.45 2k75 n HIS 103 Cb 0.29 -2.13 0.26 0.00 -0.12 0.00 0.00 29.99 28.29 2k75 n HIS 103 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2k75 h HIS 104 N 8.51 0.52 0.00 1.57 3.86 -1.99 -3.46 115.15 124.17 2k75 h HIS 104 Ca 0.35 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.48 2k75 h HIS 104 Cb 0.78 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 29.11 2k75 h HIS 104 CO 1.25 0.59 0.00 1.58 0.86 0.00 0.00 177.93 182.21 2k75 n HIS 105 N -4.21 0.00 0.00 2.45 -0.00 -1.26 -5.23 115.22 106.96 2k75 n HIS 105 Ca 0.01 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.19 2k75 n HIS 105 Cb 0.32 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 30.19 2k75 n HIS 105 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41