#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k75 n ASP 2 N 0.00 0.00 -4.65 -3.46 5.75 -1.26 -4.86 116.55 108.07 2k75 n ASP 2 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 54.79 54.37 2k75 n ASP 2 Cb 0.00 0.00 -0.05 0.00 -1.03 0.00 0.00 41.12 40.04 2k75 n ASP 2 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2k75 s LEU 3 N 0.00 4.11 0.17 -2.12 1.98 -1.26 -0.18 118.68 121.39 2k75 s LEU 3 Ca 0.00 0.92 0.04 0.00 -2.89 0.00 0.00 54.13 52.20 2k75 s LEU 3 Cb 0.00 -3.03 -0.05 0.00 0.66 0.00 0.00 46.19 43.78 2k75 s LEU 3 CO 0.00 -0.39 -0.07 0.68 -1.89 0.00 0.00 176.35 174.68 2k75 s VAL 4 N 2.35 1.15 0.75 1.68 -7.23 -1.00 -4.97 120.40 113.13 2k75 s VAL 4 Ca 0.31 -2.06 -0.11 0.00 -1.81 0.00 0.00 61.98 58.31 2k75 s VAL 4 Cb -0.16 -2.00 0.04 0.00 0.56 0.00 0.00 36.38 34.82 2k75 s VAL 4 CO 0.09 -0.62 1.08 -0.54 -0.31 0.00 0.00 175.10 174.81 2k75 s LYS 5 N -3.78 2.52 0.16 4.82 3.01 -1.26 -4.69 119.74 120.53 2k75 s LYS 5 Ca 0.20 0.73 -0.13 0.00 -1.01 0.00 0.00 55.97 55.76 2k75 s LYS 5 Cb 0.03 -1.96 0.05 0.00 -1.01 0.00 0.00 37.83 34.95 2k75 s LYS 5 CO 0.03 -1.34 1.73 0.82 0.51 0.00 0.00 175.35 177.11 2k75 h ILE 6 N -0.88 1.21 0.00 2.17 1.08 -1.94 -1.70 117.51 117.45 2k75 h ILE 6 Ca -0.46 -0.62 0.00 0.00 -0.39 0.00 0.00 64.86 63.39 2k75 h ILE 6 Cb 1.24 0.62 0.00 0.00 -3.07 0.00 0.00 36.82 35.61 2k75 h ILE 6 CO 0.59 0.24 0.00 -0.09 -0.69 0.00 0.00 178.15 178.20 2k75 h ARG 7 N 0.73 0.00 -0.01 2.37 9.65 -1.92 -1.59 114.38 123.61 2k75 h ARG 7 Ca 0.18 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.06 2k75 h ARG 7 Cb 0.16 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.74 2k75 h ARG 7 CO -0.02 0.00 -0.00 -0.25 2.80 0.00 0.00 179.97 182.50 2k75 n ASP 8 N -2.80 0.79 -4.73 -3.80 8.00 -0.64 -4.88 116.55 108.48 2k75 n ASP 8 Ca -0.00 -1.26 -0.42 0.00 0.71 0.00 0.00 54.79 53.82 2k75 n ASP 8 Cb 0.18 -0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.26 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 -2.01 2.84 0.18 2.53 1.01 -0.60 -4.93 120.40 119.43 2k75 s VAL 9 Ca 0.43 0.66 -0.20 0.00 0.00 0.00 0.00 61.98 62.87 2k75 s VAL 9 Cb 0.21 -3.42 0.04 0.00 0.00 0.00 0.00 36.38 33.22 2k75 s VAL 9 CO 0.35 0.08 0.56 -0.44 0.00 0.00 0.00 175.10 175.65 2k75 s SER 10 N 0.64 -0.37 0.40 3.32 0.01 -1.26 -5.03 113.70 111.41 2k75 s SER 10 Ca 0.62 -0.29 0.13 0.00 1.31 0.00 0.00 55.95 57.72 2k75 s SER 10 Cb -0.41 0.59 0.83 0.00 0.21 0.00 0.00 66.02 67.25 2k75 s SER 10 CO 0.38 -1.03 1.90 -0.07 0.41 0.00 0.00 173.24 174.83 2k75 h LEU 11 N 2.13 0.02 -2.88 2.44 3.38 -1.95 -1.77 115.31 116.67 2k75 h LEU 11 Ca -0.30 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 2k75 h LEU 11 Cb 1.28 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 2k75 h LEU 11 CO 0.37 0.30 0.03 0.77 0.09 0.00 0.00 178.44 180.01 2k75 h SER 12 N 0.02 0.00 -3.14 -0.43 4.64 -1.98 -3.18 113.55 109.47 2k75 h SER 12 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 2k75 h SER 12 Cb 0.51 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.19 2k75 h SER 12 CO 0.04 0.00 -0.49 0.42 -0.87 0.00 0.00 176.83 175.93 2k75 s THR 13 N -4.17 3.15 -0.44 2.95 -4.23 -0.67 -4.92 115.64 107.33 2k75 s THR 13 Ca -0.05 -4.22 0.25 0.00 -1.18 0.00 0.00 61.69 56.49 2k75 s THR 13 Cb 0.13 -3.04 0.27 0.00 1.34 0.00 0.00 72.50 71.19 2k75 s THR 13 CO 0.40 -1.02 1.74 1.55 -0.54 0.00 0.00 174.62 176.76 2k75 h PRO 14 N 5.49 0.00 -3.58 3.99 0.13 -1.73 -3.41 132.00 132.90 2k75 h PRO 14 Ca 0.15 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.73 2k75 h PRO 14 Cb 0.76 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.49 2k75 h PRO 14 CO 0.74 0.00 -0.76 0.71 -0.23 0.00 0.00 178.00 178.46 2k75 s TYR 15 N -3.34 1.35 0.15 1.56 2.02 -1.26 -2.30 117.35 115.54 2k75 s TYR 15 Ca 0.04 -1.25 -0.07 0.00 -0.37 0.00 0.00 57.07 55.42 2k75 s TYR 15 Cb 0.09 -1.31 -0.02 0.00 -0.40 0.00 0.00 41.96 40.33 2k75 s TYR 15 CO 0.42 -0.73 0.21 0.14 -1.57 0.00 0.00 175.55 174.02 2k75 s VAL 16 N 1.74 0.09 -0.05 0.71 -7.23 -1.00 -1.38 120.40 113.28 2k75 s VAL 16 Ca 0.03 -1.50 0.00 0.00 -1.81 0.00 0.00 61.98 58.70 2k75 s VAL 16 Cb -0.17 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 34.91 2k75 s VAL 16 CO -0.15 -0.39 -0.03 -0.55 -0.31 0.00 0.00 175.10 173.67 2k75 s SER 17 N -2.97 4.98 0.12 4.85 0.15 0.75 -0.54 113.70 121.03 2k75 s SER 17 Ca 0.17 0.03 0.03 0.00 0.70 0.00 0.00 55.95 56.88 2k75 s SER 17 Cb 0.05 -1.31 -0.04 0.00 -1.71 0.00 0.00 66.02 63.00 2k75 s SER 17 CO -0.01 0.34 -0.07 0.68 1.20 0.00 0.00 173.24 175.38 2k75 s VAL 18 N -0.92 0.83 -0.04 4.45 -7.23 -0.51 -2.38 120.40 114.60 2k75 s VAL 18 Ca 0.15 -1.98 -0.03 0.00 -1.81 0.00 0.00 61.98 58.31 2k75 s VAL 18 Cb -0.11 -1.76 0.02 0.00 0.56 0.00 0.00 36.38 35.09 2k75 s VAL 18 CO 0.04 -0.81 0.10 -0.51 -0.31 0.00 0.00 175.10 173.61 2k75 s ILE 19 N -3.54 -0.01 -0.33 -0.62 2.07 -1.26 -0.61 121.20 116.89 2k75 s ILE 19 Ca 0.14 0.05 0.00 0.00 -1.41 0.00 0.00 60.65 59.43 2k75 s ILE 19 Cb 0.05 -0.16 0.00 0.00 0.13 0.00 0.00 42.46 42.47 2k75 s ILE 19 CO -0.03 0.02 0.00 0.61 -1.91 0.00 0.00 174.94 173.63 2k75 n GLY 20 N 3.34 -0.99 3.65 1.50 0.00 -1.04 -4.71 105.19 106.94 2k75 n GLY 20 Ca -0.16 -0.75 -0.35 0.00 0.00 0.00 0.00 46.02 44.76 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 -0.13 3.74 -0.09 1.61 2.20 -0.69 -1.78 119.74 124.59 2k75 s LYS 21 Ca 0.00 -0.36 -0.21 0.00 -0.36 0.00 0.00 55.97 55.05 2k75 s LYS 21 Cb 0.00 -3.11 -0.04 0.00 -1.51 0.00 0.00 37.83 33.17 2k75 s LYS 21 CO 0.00 0.38 0.59 0.42 -0.36 0.00 0.00 175.35 176.38 2k75 s ILE 22 N 0.04 5.12 0.10 5.43 -1.09 -1.05 -2.34 121.20 127.42 2k75 s ILE 22 Ca 0.05 1.19 0.00 0.00 -2.23 0.00 0.00 60.65 59.66 2k75 s ILE 22 Cb -0.12 -3.92 -0.04 0.00 -1.58 0.00 0.00 42.46 36.79 2k75 s ILE 22 CO 0.01 0.29 -0.02 0.42 -1.23 0.00 0.00 174.94 174.41 2k75 s THR 23 N 0.70 0.42 -0.46 2.92 -4.23 -0.15 -0.66 115.64 114.19 2k75 s THR 23 Ca 0.32 -1.89 -0.18 0.00 -1.18 0.00 0.00 61.69 58.76 2k75 s THR 23 Cb -0.16 -1.75 0.02 0.00 1.34 0.00 0.00 72.50 71.95 2k75 s THR 23 CO 0.14 -0.79 0.61 0.61 -0.54 0.00 0.00 174.62 174.65 2k75 n GLY 24 N -0.03 -1.14 3.62 3.99 0.00 -1.26 -1.40 105.19 108.97 2k75 n GLY 24 Ca -0.11 1.20 -0.40 0.00 0.00 0.00 0.00 46.02 46.71 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 -2.51 5.04 -0.14 -0.61 -1.09 -1.26 -3.81 121.20 116.83 2k75 s ILE 25 Ca 0.25 0.97 0.02 0.00 -2.23 0.00 0.00 60.65 59.66 2k75 s ILE 25 Cb -0.06 -3.86 0.01 0.00 -1.58 0.00 0.00 42.46 36.96 2k75 s ILE 25 CO 0.78 0.07 -0.21 -1.00 -1.23 0.00 0.00 174.94 173.35 2k75 s HIS 26 N 2.37 2.67 -0.08 3.97 3.76 0.86 -4.96 115.29 123.87 2k75 s HIS 26 Ca 0.23 -1.27 -0.15 0.00 -0.15 0.00 0.00 55.06 53.72 2k75 s HIS 26 Cb -0.16 -1.81 -0.05 0.00 1.11 0.00 0.00 32.58 31.68 2k75 s HIS 26 CO 0.09 -0.57 0.39 0.21 -0.85 0.00 0.00 174.74 174.01 2k75 s LYS 27 N 0.75 4.11 -0.07 1.40 2.20 -1.26 -0.65 119.74 126.22 2k75 s LYS 27 Ca -0.08 0.32 -0.11 0.00 -0.36 0.00 0.00 55.97 55.74 2k75 s LYS 27 Cb -0.16 -3.34 0.02 0.00 -1.51 0.00 0.00 37.83 32.85 2k75 s LYS 27 CO -0.00 0.42 0.28 0.21 -0.36 0.00 0.00 175.35 175.89 2k75 s LYS 28 N -0.16 0.44 0.05 4.03 2.20 -0.47 -4.99 119.74 120.83 2k75 s LYS 28 Ca 0.22 0.17 0.08 0.00 -0.36 0.00 0.00 55.97 56.08 2k75 s LYS 28 Cb -0.15 0.20 -0.03 0.00 -1.51 0.00 0.00 37.83 36.35 2k75 s LYS 28 CO 0.10 -0.08 -0.22 -1.83 -0.36 0.00 0.00 175.35 172.96 2k75 s GLU 29 N -0.38 1.45 0.07 4.03 -1.05 -1.26 -0.25 118.70 121.30 2k75 s GLU 29 Ca -0.05 -0.97 -0.03 0.00 -0.15 0.00 0.00 54.97 53.77 2k75 s GLU 29 Cb -0.03 -1.58 -0.03 0.00 -0.44 0.00 0.00 34.13 32.05 2k75 s GLU 29 CO 0.02 0.40 0.04 1.52 0.95 0.00 0.00 175.26 178.18 2k75 s TYR 30 N -0.81 0.47 -0.36 4.83 1.13 -0.96 -4.95 117.35 116.70 2k75 s TYR 30 Ca 0.08 -0.98 -0.29 0.00 -1.41 0.00 0.00 57.07 54.48 2k75 s TYR 30 Cb -0.09 -0.32 0.02 0.00 -1.10 0.00 0.00 41.96 40.47 2k75 s TYR 30 CO 0.02 -0.44 1.12 -2.00 -2.51 0.00 0.00 175.55 171.73 2k75 s GLU 31 N -3.92 3.96 -0.31 -3.49 2.56 -1.26 -1.81 118.70 114.43 2k75 s GLU 31 Ca 0.09 0.95 -0.06 0.00 0.00 0.00 0.00 54.97 55.95 2k75 s GLU 31 Cb 0.07 -3.80 0.02 0.00 2.00 0.00 0.00 34.13 32.43 2k75 s GLU 31 CO -0.09 -1.06 0.07 -1.12 -0.56 0.00 0.00 175.26 172.51 2k75 s SER 32 N 1.99 5.12 -1.24 -1.70 0.01 0.14 -4.57 113.70 113.45 2k75 s SER 32 Ca 0.47 -0.91 -0.01 0.00 1.31 0.00 0.00 55.95 56.81 2k75 s SER 32 Cb -0.11 -1.85 0.01 0.00 0.21 0.00 0.00 66.02 64.28 2k75 s SER 32 CO 0.21 -0.24 0.11 0.47 0.41 0.00 0.00 173.24 174.19 2k75 n ASP 33 N 4.82 -4.38 0.00 2.44 8.00 -1.26 0.29 116.55 126.47 2k75 n ASP 33 Ca -0.14 0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.41 2k75 n ASP 33 Cb 0.46 -3.67 0.00 0.00 -0.02 0.00 0.00 41.12 37.89 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 -0.94 0.95 3.21 0.44 0.00 -1.26 -5.03 105.19 102.56 2k75 n GLY 34 Ca -0.14 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 2k75 n GLY 34 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2k75 s THR 35 N -2.91 2.33 0.22 2.61 -4.23 0.15 -5.08 115.64 108.74 2k75 s THR 35 Ca 0.00 -0.88 -0.30 0.00 -1.18 0.00 0.00 61.69 59.33 2k75 s THR 35 Cb 0.00 -1.96 -0.09 0.00 1.34 0.00 0.00 72.50 71.79 2k75 s THR 35 CO 0.00 0.53 1.29 -0.89 -0.54 0.00 0.00 174.62 175.01 2k75 s THR 36 N 0.85 3.17 0.05 3.99 2.01 -1.26 0.25 115.64 124.69 2k75 s THR 36 Ca -0.06 1.01 0.04 0.00 0.31 0.00 0.00 61.69 62.99 2k75 s THR 36 Cb -0.15 -3.64 -0.02 0.00 0.01 0.00 0.00 72.50 68.69 2k75 s THR 36 CO -0.02 0.17 -0.12 -0.54 -0.69 0.00 0.00 174.62 173.42 2k75 s LYS 37 N -0.47 0.78 -0.15 4.92 1.02 -0.75 -4.87 119.74 120.22 2k75 s LYS 37 Ca 0.54 -0.80 -0.13 0.00 0.02 0.00 0.00 55.97 55.61 2k75 s LYS 37 Cb -0.36 -0.74 -0.05 0.00 -0.52 0.00 0.00 37.83 36.16 2k75 s LYS 37 CO 0.41 0.17 0.26 0.45 -0.92 0.00 0.00 175.35 175.72 2k75 s SER 38 N -1.40 6.42 -0.03 2.83 0.15 -1.26 -2.27 113.70 118.14 2k75 s SER 38 Ca -0.02 0.49 0.03 0.00 0.70 0.00 0.00 55.95 57.15 2k75 s SER 38 Cb -0.09 -2.16 0.00 0.00 -1.71 0.00 0.00 66.02 62.06 2k75 s SER 38 CO 0.01 0.16 -0.10 0.54 1.20 0.00 0.00 173.24 175.06 2k75 s VAL 39 N 0.19 0.84 -0.13 4.45 0.11 0.65 -2.48 120.40 124.03 2k75 s VAL 39 Ca 0.15 -0.39 -0.05 0.00 -2.93 0.00 0.00 61.98 58.77 2k75 s VAL 39 Cb -0.13 -0.75 -0.04 0.00 -1.53 0.00 0.00 36.38 33.94 2k75 s VAL 39 CO 0.04 0.26 0.04 -0.31 -3.33 0.00 0.00 175.10 171.80 2k75 s TYR 40 N 0.22 3.25 0.15 1.54 1.51 -0.46 -1.37 117.35 122.20 2k75 s TYR 40 Ca -0.04 0.16 0.09 0.00 -1.01 0.00 0.00 57.07 56.27 2k75 s TYR 40 Cb -0.09 -1.93 -0.04 0.00 -0.11 0.00 0.00 41.96 39.79 2k75 s TYR 40 CO 0.01 0.36 -0.19 -0.65 -1.11 0.00 0.00 175.55 173.96 2k75 s GLN 41 N -0.35 1.26 0.00 -0.62 -0.21 0.18 -0.04 119.66 119.87 2k75 s GLN 41 Ca 0.08 -1.36 0.00 0.00 0.02 0.00 0.00 55.36 54.10 2k75 s GLN 41 Cb -0.12 -1.39 0.00 0.00 1.00 0.00 0.00 33.01 32.50 2k75 s GLN 41 CO 0.02 0.29 0.00 0.41 -2.12 0.00 0.00 175.29 173.89 2k75 n GLY 42 N 0.48 1.67 3.14 3.09 0.00 -0.97 -0.10 105.19 112.49 2k75 n GLY 42 Ca -0.15 -0.37 -0.20 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.23 1.20 0.01 1.61 1.51 -0.49 -2.35 117.35 117.61 2k75 s TYR 43 Ca 0.00 -0.36 0.07 0.00 -1.01 0.00 0.00 57.07 55.77 2k75 s TYR 43 Cb 0.00 -0.71 -0.02 0.00 -0.11 0.00 0.00 41.96 41.12 2k75 s TYR 43 CO 0.00 0.03 -0.22 -1.50 -1.11 0.00 0.00 175.55 172.75 2k75 s ILE 44 N -0.87 1.73 0.10 2.71 2.07 -0.82 -0.97 121.20 125.15 2k75 s ILE 44 Ca 0.01 -1.08 0.07 0.00 -1.41 0.00 0.00 60.65 58.24 2k75 s ILE 44 Cb -0.08 -1.47 -0.03 0.00 0.13 0.00 0.00 42.46 41.01 2k75 s ILE 44 CO 0.01 0.36 -0.17 -0.70 -1.91 0.00 0.00 174.94 172.53 2k75 s GLU 45 N -0.84 1.02 0.00 3.50 2.12 -0.99 -2.13 118.70 121.38 2k75 s GLU 45 Ca 0.08 -1.14 0.00 0.00 0.36 0.00 0.00 54.97 54.27 2k75 s GLU 45 Cb -0.09 -1.11 0.00 0.00 0.26 0.00 0.00 34.13 33.20 2k75 s GLU 45 CO 0.00 0.24 0.00 -3.47 -0.54 0.00 0.00 175.26 171.50 2k75 n ASP 46 N 0.95 0.00 0.00 -1.70 -0.08 -0.93 -1.70 116.55 113.09 2k75 n ASP 46 Ca -0.19 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.23 2k75 n ASP 46 Cb 0.55 0.00 0.67 0.00 2.34 0.00 0.00 41.12 44.67 2k75 n ASP 46 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2k75 n ASP 47 N 0.00 0.00 0.00 1.67 8.00 -1.26 -4.52 116.55 120.44 2k75 n ASP 47 Ca 0.00 0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.63 2k75 n ASP 47 Cb 0.00 -0.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.73 2k75 n ASP 47 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2k75 n THR 48 N -1.37 0.00 -1.77 -3.53 -2.24 -1.26 -5.15 114.28 98.96 2k75 n THR 48 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 2k75 n THR 48 Cb 0.27 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 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 -2.28 0.00 -2.70 6.98 0.00 -1.26 -5.05 120.51 116.20 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 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 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 2.34 0.69 0.16 0.00 1.70 -1.26 -2.19 118.95 120.40 2k75 s ARG 50 Ca 0.00 -0.78 -0.10 0.00 -0.47 0.00 0.00 55.73 54.37 2k75 s ARG 50 Cb 0.00 0.28 -0.00 0.00 -0.57 0.00 0.00 34.95 34.66 2k75 s ARG 50 CO 0.00 -0.19 0.32 -1.50 -1.08 0.00 0.00 175.30 172.85 2k75 s ILE 51 N -2.97 0.06 0.33 4.99 2.07 -0.90 -4.95 121.20 119.83 2k75 s ILE 51 Ca -0.02 -1.27 -0.26 0.00 -1.41 0.00 0.00 60.65 57.69 2k75 s ILE 51 Cb 0.01 -1.76 -0.10 0.00 0.13 0.00 0.00 42.46 40.74 2k75 s ILE 51 CO -0.06 -0.29 0.98 -0.13 -1.91 0.00 0.00 174.94 173.53 2k75 s ARG 52 N -3.94 4.52 0.12 3.50 0.52 -1.26 -1.93 118.95 120.47 2k75 s ARG 52 Ca 0.15 1.41 0.02 0.00 -0.52 0.00 0.00 55.73 56.79 2k75 s ARG 52 Cb 0.03 -2.80 -0.04 0.00 0.52 0.00 0.00 34.95 32.65 2k75 s ARG 52 CO -0.01 0.20 -0.05 0.96 0.02 0.00 0.00 175.30 176.42 2k75 s ILE 53 N -1.57 0.73 -0.00 1.52 -0.00 -0.99 -1.69 121.20 119.19 2k75 s ILE 53 Ca 0.51 -1.96 0.01 0.00 -0.00 0.00 0.00 60.65 59.21 2k75 s ILE 53 Cb -0.21 -1.82 -0.00 0.00 -0.00 0.00 0.00 42.46 40.43 2k75 s ILE 53 CO 0.26 -0.75 -0.03 -0.44 -0.00 0.00 0.00 174.94 173.98 2k75 s SER 54 N -3.09 0.34 -0.21 4.36 0.01 0.67 -2.30 113.70 113.48 2k75 s SER 54 Ca 0.16 -0.05 0.01 0.00 1.31 0.00 0.00 55.95 57.38 2k75 s SER 54 Cb 0.05 -0.04 0.03 0.00 0.21 0.00 0.00 66.02 66.28 2k75 s SER 54 CO -0.02 0.04 -0.16 -0.94 0.41 0.00 0.00 173.24 172.57 2k75 s SER 55 N -0.07 3.68 -0.32 2.44 1.04 0.94 -0.76 113.70 120.65 2k75 s SER 55 Ca 0.01 -0.92 -0.15 0.00 0.48 0.00 0.00 55.95 55.37 2k75 s SER 55 Cb -0.01 -1.52 -0.02 0.00 0.10 0.00 0.00 66.02 64.57 2k75 s SER 55 CO -0.00 -0.07 0.36 -0.36 0.98 0.00 0.00 173.24 174.14 2k75 s PHE 56 N 1.23 3.22 0.00 5.02 0.40 -1.03 -1.35 117.98 125.47 2k75 s PHE 56 Ca -0.00 0.13 0.00 0.00 -0.60 0.00 0.00 56.93 56.46 2k75 s PHE 56 Cb -0.16 -2.63 0.00 0.00 0.51 0.00 0.00 43.02 40.74 2k75 s PHE 56 CO -0.10 -0.35 0.00 0.41 0.70 0.00 0.00 175.22 175.88 2k75 n GLY 57 N 4.88 1.92 3.35 4.36 0.00 -1.04 -4.56 105.19 114.11 2k75 n GLY 57 Ca -0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 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 2.80 0.40 1.61 -0.14 -1.26 -5.07 119.74 118.08 2k75 s LYS 58 Ca 0.00 -1.27 -0.25 0.00 -1.36 0.00 0.00 55.97 53.09 2k75 s LYS 58 Cb 0.00 -3.87 -0.09 0.00 -1.68 0.00 0.00 37.83 32.20 2k75 s LYS 58 CO 0.00 -0.87 1.11 -1.14 -0.76 0.00 0.00 175.35 173.69 2k75 s GLN 59 N 1.54 4.09 0.13 1.68 0.74 -1.26 -4.73 119.66 121.85 2k75 s GLN 59 Ca 0.03 1.69 0.07 0.00 0.05 0.00 0.00 55.36 57.20 2k75 s GLN 59 Cb -0.22 -2.61 -0.04 0.00 1.10 0.00 0.00 33.01 31.25 2k75 s GLN 59 CO 0.05 -0.25 -0.17 -0.51 -0.55 0.00 0.00 175.29 173.87 2k75 s LEU 60 N -2.58 2.38 -0.06 3.68 1.43 -1.26 -5.14 118.68 117.12 2k75 s LEU 60 Ca 0.58 -0.78 -0.02 0.00 -1.03 0.00 0.00 54.13 52.88 2k75 s LEU 60 Cb -0.27 -0.71 -0.04 0.00 0.03 0.00 0.00 46.19 45.21 2k75 s LEU 60 CO 0.33 -0.06 0.03 -1.10 0.23 0.00 0.00 176.35 175.79 2k75 s GLN 61 N -2.43 3.03 0.31 1.70 -0.21 -1.26 -5.07 119.66 115.71 2k75 s GLN 61 Ca 0.09 -0.41 -0.29 0.00 0.02 0.00 0.00 55.36 54.77 2k75 s GLN 61 Cb -0.07 -2.84 -0.10 0.00 1.00 0.00 0.00 33.01 31.00 2k75 s GLN 61 CO 0.04 0.69 1.35 0.34 -2.12 0.00 0.00 175.29 175.60 2k75 s ASP 62 N -1.14 6.72 -0.43 5.90 -1.08 -1.26 -4.10 116.67 121.28 2k75 s ASP 62 Ca 0.16 2.69 -0.13 0.00 -0.52 0.00 0.00 52.55 54.75 2k75 s ASP 62 Cb -0.12 -2.64 0.02 0.00 -1.46 0.00 0.00 42.92 38.72 2k75 s ASP 62 CO 0.06 -0.60 0.56 -1.20 0.52 0.00 0.00 175.17 174.51 2k75 n SER 63 N 1.27 -7.49 -3.62 -0.34 7.64 0.16 -5.02 113.62 106.22 2k75 n SER 63 Ca 0.02 0.43 -0.04 0.00 1.01 0.00 0.00 58.87 60.30 2k75 n SER 63 Cb 0.41 -5.06 -0.06 0.00 -1.01 0.00 0.00 64.21 58.50 2k75 n SER 63 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 2k75 s ASP 64 N -2.54 -0.84 -0.17 6.43 1.01 -1.24 -4.96 116.67 114.36 2k75 s ASP 64 Ca 0.20 1.28 -0.29 0.00 0.71 0.00 0.00 52.55 54.45 2k75 s ASP 64 Cb -0.06 1.56 -0.01 0.00 1.01 0.00 0.00 42.92 45.43 2k75 s ASP 64 CO 0.71 -0.19 1.11 -0.69 0.21 0.00 0.00 175.17 176.31 2k75 s VAL 65 N 1.91 4.55 0.09 -1.27 1.01 -1.26 -2.52 120.40 122.90 2k75 s VAL 65 Ca -0.08 1.86 0.00 0.00 0.00 0.00 0.00 61.98 63.76 2k75 s VAL 65 Cb -0.06 -4.20 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 2k75 s VAL 65 CO -0.18 -0.11 -0.04 0.68 0.00 0.00 0.00 175.10 175.45 2k75 s VAL 66 N 2.94 0.46 -0.12 2.92 -7.23 -0.74 -1.75 120.40 116.89 2k75 s VAL 66 Ca 0.49 -1.89 0.02 0.00 -1.81 0.00 0.00 61.98 58.79 2k75 s VAL 66 Cb -0.18 -1.67 -0.00 0.00 0.56 0.00 0.00 36.38 35.08 2k75 s VAL 66 CO 0.12 -0.87 -0.19 -0.60 -0.31 0.00 0.00 175.10 173.26 2k75 s ARG 67 N -3.89 3.19 -0.19 4.82 3.52 0.18 -2.48 118.95 124.10 2k75 s ARG 67 Ca 0.12 -0.79 -0.06 0.00 -0.13 0.00 0.00 55.73 54.87 2k75 s ARG 67 Cb 0.07 -2.48 -0.03 0.00 -1.56 0.00 0.00 34.95 30.94 2k75 s ARG 67 CO -0.06 0.15 0.02 0.42 -0.81 0.00 0.00 175.30 175.02 2k75 s ILE 68 N 0.47 4.22 -0.05 4.11 1.01 0.22 -1.11 121.20 130.08 2k75 s ILE 68 Ca -0.13 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.31 2k75 s ILE 68 Cb -0.17 -2.91 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 2k75 s ILE 68 CO 0.05 0.44 -0.05 -1.81 0.00 0.00 0.00 174.94 173.57 2k75 s ASP 69 N 0.78 4.76 -1.16 3.58 1.01 -0.25 -1.43 116.67 123.96 2k75 s ASP 69 Ca 0.01 -0.02 -0.07 0.00 0.71 0.00 0.00 52.55 53.18 2k75 s ASP 69 Cb -0.14 -1.20 0.01 0.00 1.01 0.00 0.00 42.92 42.59 2k75 s ASP 69 CO 0.02 0.34 1.01 -3.20 0.21 0.00 0.00 175.17 173.55 2k75 n ASN 70 N 2.01 -5.42 -4.77 0.27 5.15 -1.24 -2.62 115.26 108.63 2k75 n ASN 70 Ca -0.17 -0.47 -0.36 0.00 -0.60 0.00 0.00 54.58 52.97 2k75 n ASN 70 Cb 0.53 -4.43 -0.01 0.00 -0.53 0.00 0.00 39.78 35.34 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 -3.28 2.92 -0.22 5.20 0.00 0.30 -4.68 121.76 122.00 2k75 s ALA 71 Ca 0.46 0.87 -0.08 0.00 0.00 0.00 0.00 51.96 53.20 2k75 s ALA 71 Cb -0.20 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.52 2k75 s ALA 71 CO 0.63 -0.62 0.09 0.50 0.00 0.00 0.00 175.76 176.37 2k75 s ARG 72 N -2.83 3.90 -0.01 0.00 3.52 -0.34 -2.37 118.95 120.83 2k75 s ARG 72 Ca 0.65 -0.36 -0.23 0.00 -0.13 0.00 0.00 55.73 55.65 2k75 s ARG 72 Cb -0.26 -3.34 -0.05 0.00 -1.56 0.00 0.00 34.95 29.74 2k75 s ARG 72 CO 0.31 0.07 0.71 0.08 -0.81 0.00 0.00 175.30 175.66 2k75 s VAL 73 N 0.95 4.90 0.02 7.11 1.01 -0.97 0.06 120.40 133.48 2k75 s VAL 73 Ca 0.05 1.48 -0.07 0.00 0.00 0.00 0.00 61.98 63.44 2k75 s VAL 73 Cb -0.14 -4.05 -0.00 0.00 0.00 0.00 0.00 36.38 32.19 2k75 s VAL 73 CO 0.03 0.33 0.13 0.00 0.00 0.00 0.00 175.10 175.59 2k75 s ALA 74 N 0.28 -0.22 -0.22 5.51 0.00 -0.62 -4.90 121.76 121.59 2k75 s ALA 74 Ca 0.37 -0.34 -0.06 0.00 0.00 0.00 0.00 51.96 51.93 2k75 s ALA 74 Cb -0.19 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.11 2k75 s ALA 74 CO 0.20 -0.28 0.03 -1.14 0.00 0.00 0.00 175.76 174.57 2k75 s GLN 75 N -2.12 3.64 -0.02 0.00 0.74 -1.26 -1.11 119.66 119.52 2k75 s GLN 75 Ca -0.09 -0.50 0.05 0.00 0.05 0.00 0.00 55.36 54.88 2k75 s GLN 75 Cb -0.04 -3.20 -0.01 0.00 1.10 0.00 0.00 33.01 30.86 2k75 s GLN 75 CO -0.02 -0.09 -0.18 -0.06 -0.55 0.00 0.00 175.29 174.39 2k75 s PHE 76 N 1.30 1.64 -1.67 1.67 0.08 0.36 -4.68 117.98 116.69 2k75 s PHE 76 Ca 0.04 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 56.75 2k75 s PHE 76 Cb -0.15 -1.07 0.00 0.00 -0.57 0.00 0.00 43.02 41.24 2k75 s PHE 76 CO 0.02 -0.06 0.00 -1.71 -0.10 0.00 0.00 175.22 173.37 2k75 n ASN 77 N 2.75 -4.71 0.00 1.36 5.15 -1.26 0.25 115.26 118.81 2k75 n ASN 77 Ca -0.16 0.28 0.00 0.00 -0.60 0.00 0.00 54.58 54.11 2k75 n ASN 77 Cb 0.54 -4.12 0.00 0.00 -0.53 0.00 0.00 39.78 35.66 2k75 n ASN 77 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2k75 n GLY 78 N -0.56 0.54 3.35 8.20 0.00 -1.26 -5.01 105.19 110.45 2k75 n GLY 78 Ca -0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.24 2.46 0.38 1.61 2.02 0.14 -5.11 117.35 116.62 2k75 s TYR 79 Ca 0.00 -0.41 -0.25 0.00 -0.37 0.00 0.00 57.07 56.04 2k75 s TYR 79 Cb 0.00 -1.56 -0.09 0.00 -0.40 0.00 0.00 41.96 39.91 2k75 s TYR 79 CO 0.00 -0.01 1.05 -0.51 -1.57 0.00 0.00 175.55 174.51 2k75 s LEU 80 N -0.55 4.20 0.14 -1.29 1.43 -1.26 -0.49 118.68 120.87 2k75 s LEU 80 Ca 0.08 2.05 -0.17 0.00 -1.03 0.00 0.00 54.13 55.05 2k75 s LEU 80 Cb -0.11 -4.10 0.04 0.00 0.03 0.00 0.00 46.19 42.05 2k75 s LEU 80 CO 0.00 -0.42 0.44 -0.94 0.23 0.00 0.00 176.35 175.67 2k75 s SER 81 N -1.49 -0.28 -0.20 2.29 1.04 -0.27 -4.27 113.70 110.51 2k75 s SER 81 Ca 0.56 -0.30 -0.07 0.00 0.48 0.00 0.00 55.95 56.62 2k75 s SER 81 Cb -0.23 0.50 -0.04 0.00 0.10 0.00 0.00 66.02 66.36 2k75 s SER 81 CO 0.29 -0.89 0.05 -0.76 0.98 0.00 0.00 173.24 172.91 2k75 s LEU 82 N -2.81 3.61 -0.12 2.42 1.43 -0.68 -1.59 118.68 120.95 2k75 s LEU 82 Ca 0.04 -0.05 -0.02 0.00 -1.03 0.00 0.00 54.13 53.07 2k75 s LEU 82 Cb 0.01 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.27 2k75 s LEU 82 CO -0.11 0.10 -0.04 -0.94 0.23 0.00 0.00 176.35 175.58 2k75 s SER 83 N 0.83 4.81 -0.35 2.29 1.04 0.11 -0.23 113.70 122.19 2k75 s SER 83 Ca 0.03 -0.06 -0.13 0.00 0.48 0.00 0.00 55.95 56.27 2k75 s SER 83 Cb -0.14 -1.56 -0.01 0.00 0.10 0.00 0.00 66.02 64.42 2k75 s SER 83 CO 0.02 0.26 0.24 -0.69 0.98 0.00 0.00 173.24 174.06 2k75 s VAL 84 N -0.17 5.20 0.76 5.02 1.01 0.06 -1.20 120.40 131.08 2k75 s VAL 84 Ca 0.03 -0.35 -0.05 0.00 0.00 0.00 0.00 61.98 61.61 2k75 s VAL 84 Cb -0.13 -3.72 0.12 0.00 0.00 0.00 0.00 36.38 32.65 2k75 s VAL 84 CO 0.02 -0.07 1.06 -0.83 0.00 0.00 0.00 175.10 175.28 2k75 s GLY 85 N 1.70 1.76 0.49 4.51 0.00 -1.26 -2.45 107.32 112.07 2k75 s GLY 85 Ca 0.06 -1.44 0.27 0.00 0.00 0.00 0.00 44.72 43.60 2k75 s GLY 85 CO 0.10 -0.87 1.98 1.29 0.00 0.00 0.00 173.10 175.60 2k75 h ASP 86 N -0.75 0.00 0.50 1.64 2.03 -1.98 -1.80 116.42 116.06 2k75 h ASP 86 Ca -0.40 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.90 2k75 h ASP 86 Cb 1.27 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.77 2k75 h ASP 86 CO 0.44 0.16 -0.13 -1.20 -1.03 0.00 0.00 179.24 177.48 2k75 n SER 87 N -3.52 0.36 -4.84 4.15 7.64 -1.26 -4.86 113.62 111.29 2k75 n SER 87 Ca -0.01 -0.32 -0.28 0.00 1.01 0.00 0.00 58.87 59.28 2k75 n SER 87 Cb 0.31 -0.12 0.09 0.00 -1.01 0.00 0.00 64.21 63.48 2k75 n SER 87 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2k75 s SER 88 N -2.64 4.48 0.00 6.43 0.15 -0.68 -5.02 113.70 116.42 2k75 s SER 88 Ca 0.24 0.61 0.04 0.00 0.70 0.00 0.00 55.95 57.53 2k75 s SER 88 Cb 0.20 -1.11 -0.01 0.00 -1.71 0.00 0.00 66.02 63.38 2k75 s SER 88 CO 0.51 -1.88 -0.11 -0.13 1.20 0.00 0.00 173.24 172.83 2k75 s ARG 89 N -5.49 0.88 -0.09 5.44 0.52 -1.08 -4.93 118.95 114.19 2k75 s ARG 89 Ca 0.63 -0.46 0.04 0.00 -0.52 0.00 0.00 55.73 55.42 2k75 s ARG 89 Cb -0.10 -0.85 0.00 0.00 0.52 0.00 0.00 34.95 34.52 2k75 s ARG 89 CO 0.48 0.23 -0.23 0.42 0.02 0.00 0.00 175.30 176.22 2k75 s ILE 90 N -0.39 1.97 -0.17 1.52 1.01 -1.26 -1.09 121.20 122.80 2k75 s ILE 90 Ca 0.03 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.72 2k75 s ILE 90 Cb -0.05 -1.71 0.02 0.00 0.01 0.00 0.00 42.46 40.73 2k75 s ILE 90 CO -0.00 0.54 -0.18 -1.61 0.00 0.00 0.00 174.94 173.69 2k75 s GLU 91 N 0.32 2.79 0.42 2.79 2.02 -0.26 -4.97 118.70 121.80 2k75 s GLU 91 Ca -0.17 -0.75 -0.23 0.00 0.02 0.00 0.00 54.97 53.84 2k75 s GLU 91 Cb -0.17 -2.42 -0.09 0.00 0.10 0.00 0.00 34.13 31.54 2k75 s GLU 91 CO 0.08 -0.20 1.04 -1.12 0.02 0.00 0.00 175.26 175.07 2k75 s SER 92 N 1.31 6.69 -0.41 -0.19 0.01 -1.26 -0.64 113.70 119.21 2k75 s SER 92 Ca 0.04 1.98 0.10 0.00 1.31 0.00 0.00 55.95 59.38 2k75 s SER 92 Cb -0.13 -2.58 0.33 0.00 0.21 0.00 0.00 66.02 63.85 2k75 s SER 92 CO -0.12 -0.53 0.73 0.52 0.41 0.00 0.00 173.24 174.25 2k75 n VAL 93 N -0.30 0.26 1.04 3.43 0.31 -0.71 -4.87 118.33 117.49 2k75 n VAL 93 Ca 0.06 -4.66 0.12 0.00 -0.01 0.00 0.00 64.34 59.85 2k75 n VAL 93 Cb 0.51 -0.70 0.28 0.00 -0.91 0.00 0.00 33.84 33.01 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 0.38 2.50 -4.22 4.52 5.03 -1.26 -4.67 115.26 117.54 2k75 n ASN 94 Ca 0.25 -1.82 -0.32 0.00 0.87 0.00 0.00 54.58 53.56 2k75 n ASN 94 Cb 0.60 -0.06 -0.17 0.00 -1.02 0.00 0.00 39.78 39.13 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 -1.87 2.04 -0.85 2.41 1.01 -1.26 -5.03 120.40 116.85 2k75 s VAL 95 Ca 0.33 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.29 2k75 s VAL 95 Cb 0.20 -1.76 0.35 0.00 0.00 0.00 0.00 36.38 35.17 2k75 s VAL 95 CO 0.31 0.56 1.95 -0.46 0.00 0.00 0.00 175.10 177.45 2k75 n ASN 96 N 3.51 7.34 -3.11 3.32 0.23 -1.26 -4.69 115.26 120.60 2k75 n ASN 96 Ca -0.19 -3.81 -0.21 0.00 -0.53 0.00 0.00 54.58 49.84 2k75 n ASN 96 Cb 0.53 -1.05 -0.05 0.00 -2.08 0.00 0.00 39.78 37.14 2k75 n ASN 96 CO 0.00 0.00 0.00 -0.38 -0.93 0.00 0.00 177.26 175.95 2k75 n ILE 97 N -0.47 -0.56 1.89 1.53 5.41 -1.26 -4.93 119.36 120.96 2k75 n ILE 97 Ca 0.52 -3.53 0.16 0.00 1.00 0.00 0.00 62.75 60.89 2k75 n ILE 97 Cb 0.26 -1.28 0.89 0.00 -0.71 0.00 0.00 39.64 38.80 2k75 n ILE 97 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2k75 n PRO 98 N 1.44 0.97 -2.35 0.38 -0.04 -1.26 -4.87 135.00 129.27 2k75 n PRO 98 Ca 0.19 -0.07 -0.36 0.00 -0.04 0.00 0.00 63.50 63.21 2k75 n PRO 98 Cb 0.55 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.49 2k75 n PRO 98 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2k75 s LEU 99 N -2.08 4.00 0.00 1.53 1.43 -1.26 -4.71 118.68 117.58 2k75 s LEU 99 Ca 0.45 2.19 0.00 0.00 -1.03 0.00 0.00 54.13 55.74 2k75 s LEU 99 Cb 0.22 -4.30 0.00 0.00 0.03 0.00 0.00 46.19 42.14 2k75 s LEU 99 CO 0.38 -0.84 0.00 1.21 0.23 0.00 0.00 176.35 177.33 2k75 n GLU 100 N -0.53 0.00 0.00 1.70 4.07 -1.26 -4.74 120.64 119.87 2k75 n GLU 100 Ca 0.07 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.17 2k75 n GLU 100 Cb 0.49 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.87 2k75 n GLU 100 CO 0.00 0.00 0.00 0.72 -0.06 0.00 0.00 177.13 177.79 2k75 n HIS 101 N 14.00 0.00 -3.62 4.31 8.25 -1.26 -4.42 115.22 132.48 2k75 n HIS 101 Ca 0.00 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.32 2k75 n HIS 101 Cb 0.00 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.05 2k75 n HIS 101 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2k75 s HIS 102 N 0.00 -0.37 -0.25 4.41 -3.43 -1.26 -5.14 115.29 109.25 2k75 s HIS 102 Ca 0.00 0.45 -0.14 0.00 -0.80 0.00 0.00 55.06 54.57 2k75 s HIS 102 Cb 0.00 0.28 -0.04 0.00 -1.43 0.00 0.00 32.58 31.39 2k75 s HIS 102 CO 0.00 -0.58 0.32 -3.38 -2.00 0.00 0.00 174.74 169.10 2k75 s HIS 103 N -2.16 3.29 0.15 0.38 -3.43 -1.26 -4.96 115.29 107.30 2k75 s HIS 103 Ca -0.07 0.41 -0.12 0.00 -0.80 0.00 0.00 55.06 54.48 2k75 s HIS 103 Cb -0.01 -2.49 0.03 0.00 -1.43 0.00 0.00 32.58 28.68 2k75 s HIS 103 CO 0.00 -0.11 1.62 1.25 -2.00 0.00 0.00 174.74 175.50 2k75 h HIS 104 N 7.86 0.96 -3.89 0.38 2.76 -1.97 -3.42 115.15 117.82 2k75 h HIS 104 Ca -0.34 -0.16 -0.49 0.00 -2.20 0.00 0.00 60.37 57.19 2k75 h HIS 104 Cb 1.17 -0.25 0.01 0.00 1.55 0.00 0.00 27.41 29.88 2k75 h HIS 104 CO 0.72 0.88 0.41 -1.01 -1.30 0.00 0.00 177.93 177.64 2k75 s HIS 105 N -5.07 3.49 -1.04 5.26 3.76 -1.26 -5.36 115.29 115.07 2k75 s HIS 105 Ca -0.12 1.71 0.00 0.00 -0.15 0.00 0.00 55.06 56.49 2k75 s HIS 105 Cb 0.12 -3.12 0.00 0.00 1.11 0.00 0.00 32.58 30.69 2k75 s HIS 105 CO 0.82 -0.36 0.26 0.72 -0.85 0.00 0.00 174.74 175.33