#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 5.50 0.04 -3.46 -1.08 -1.26 -3.81 116.67 112.60 2k75 s ASP 2 Ca 0.00 2.35 -0.30 0.00 -0.52 0.00 0.00 52.55 54.07 2k75 s ASP 2 Cb 0.00 -2.60 -0.06 0.00 -1.46 0.00 0.00 42.92 38.80 2k75 s ASP 2 CO 0.00 -1.38 1.32 -0.22 0.52 0.00 0.00 175.17 175.42 2k75 s LEU 3 N -3.78 4.34 0.11 -1.34 2.96 -1.26 -1.79 118.68 117.92 2k75 s LEU 3 Ca 0.73 2.11 -0.01 0.00 -0.22 0.00 0.00 54.13 56.74 2k75 s LEU 3 Cb -0.29 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.79 2k75 s LEU 3 CO 0.33 -0.62 0.03 0.68 -1.32 0.00 0.00 176.35 175.44 2k75 s VAL 4 N 1.71 0.16 0.56 1.68 -7.23 -1.00 -4.93 120.40 111.35 2k75 s VAL 4 Ca 0.62 -1.88 -0.16 0.00 -1.81 0.00 0.00 61.98 58.74 2k75 s VAL 4 Cb -0.32 -1.88 -0.05 0.00 0.56 0.00 0.00 36.38 34.69 2k75 s VAL 4 CO 0.28 -0.63 1.03 -0.54 -0.31 0.00 0.00 175.10 174.92 2k75 s LYS 5 N -4.00 3.57 0.16 4.82 1.02 -1.26 -4.74 119.74 119.31 2k75 s LYS 5 Ca 0.19 1.11 -0.13 0.00 0.02 0.00 0.00 55.97 57.16 2k75 s LYS 5 Cb 0.08 -2.07 0.05 0.00 -0.52 0.00 0.00 37.83 35.36 2k75 s LYS 5 CO -0.02 -0.59 1.71 0.82 -0.92 0.00 0.00 175.35 176.35 2k75 h ILE 6 N 0.64 1.22 0.00 2.17 2.04 -1.95 -1.97 117.51 119.66 2k75 h ILE 6 Ca -0.47 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 64.69 2k75 h ILE 6 Cb 1.21 0.67 -0.00 0.00 -0.74 0.00 0.00 36.82 37.95 2k75 h ILE 6 CO 0.59 0.27 -0.02 0.03 0.00 0.00 0.00 178.15 179.01 2k75 h ARG 7 N 0.74 0.00 -0.06 2.37 3.08 -1.93 -0.58 114.38 118.00 2k75 h ARG 7 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 2k75 h ARG 7 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 2k75 h ARG 7 CO -0.01 0.02 0.00 -0.25 -1.07 0.00 0.00 179.97 178.66 2k75 n ASP 8 N -3.21 1.28 -4.73 7.04 8.00 -0.75 -4.89 116.55 119.30 2k75 n ASP 8 Ca -0.02 -1.50 -0.42 0.00 0.71 0.00 0.00 54.79 53.56 2k75 n ASP 8 Cb 0.17 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.93 3.10 0.23 2.53 1.01 -0.23 -4.93 120.40 120.18 2k75 s VAL 9 Ca 0.37 0.83 -0.20 0.00 0.00 0.00 0.00 61.98 62.98 2k75 s VAL 9 Cb 0.19 -3.53 0.03 0.00 0.00 0.00 0.00 36.38 33.07 2k75 s VAL 9 CO 0.31 0.09 0.63 -0.94 0.00 0.00 0.00 175.10 175.18 2k75 s SER 10 N 0.82 -0.32 0.60 3.32 1.04 -1.26 -5.01 113.70 112.89 2k75 s SER 10 Ca 0.63 -0.46 0.38 0.00 0.48 0.00 0.00 55.95 56.97 2k75 s SER 10 Cb -0.38 0.65 1.84 0.00 0.10 0.00 0.00 66.02 68.23 2k75 s SER 10 CO 0.34 -1.18 2.16 -0.07 0.98 0.00 0.00 173.24 175.48 2k75 h LEU 11 N 2.07 0.00 -1.52 2.42 3.38 -1.95 -1.67 115.31 118.04 2k75 h LEU 11 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2k75 h LEU 11 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2k75 h LEU 11 CO 0.31 0.01 0.00 -1.28 0.09 0.00 0.00 178.44 177.57 2k75 h SER 12 N 0.00 0.00 -3.63 -0.43 0.87 -1.96 -3.30 113.55 105.10 2k75 h SER 12 Ca -0.00 0.00 -0.63 0.00 -1.23 0.00 0.00 61.79 59.93 2k75 h SER 12 Cb 0.28 0.00 -0.41 0.00 -0.44 0.00 0.00 62.40 61.82 2k75 h SER 12 CO 0.00 0.00 -0.59 0.42 -0.53 0.00 0.00 176.83 176.13 2k75 s THR 13 N -3.61 2.80 0.29 2.23 -4.23 -0.63 -4.96 115.64 107.53 2k75 s THR 13 Ca -0.01 -3.89 0.03 0.00 -1.18 0.00 0.00 61.69 56.64 2k75 s THR 13 Cb 0.09 -2.88 0.28 0.00 1.34 0.00 0.00 72.50 71.33 2k75 s THR 13 CO 0.33 -0.92 1.79 -0.65 -0.54 0.00 0.00 174.62 174.63 2k75 h PRO 14 N 5.86 0.78 -5.11 3.99 0.11 -1.79 -3.40 132.00 132.43 2k75 h PRO 14 Ca 0.05 -0.05 -0.64 0.00 0.11 0.00 0.00 66.00 65.47 2k75 h PRO 14 Cb 0.81 -0.18 -0.34 0.00 0.11 0.00 0.00 31.00 31.41 2k75 h PRO 14 CO 0.71 0.51 -0.86 0.71 -0.21 0.00 0.00 178.00 178.86 2k75 s TYR 15 N -5.92 2.37 0.10 0.65 2.02 -1.26 -1.38 117.35 113.94 2k75 s TYR 15 Ca -0.12 -1.06 -0.06 0.00 -0.37 0.00 0.00 57.07 55.46 2k75 s TYR 15 Cb 0.23 -1.62 -0.02 0.00 -0.40 0.00 0.00 41.96 40.15 2k75 s TYR 15 CO 0.80 -0.47 0.14 0.14 -1.57 0.00 0.00 175.55 174.59 2k75 s VAL 16 N 0.63 0.14 -0.07 0.71 -7.23 -0.79 -3.37 120.40 110.42 2k75 s VAL 16 Ca -0.13 -1.44 0.04 0.00 -1.81 0.00 0.00 61.98 58.64 2k75 s VAL 16 Cb -0.16 -1.55 -0.02 0.00 0.56 0.00 0.00 36.38 35.20 2k75 s VAL 16 CO 0.03 -0.64 -0.19 -0.55 -0.31 0.00 0.00 175.10 173.45 2k75 s SER 17 N -2.92 3.62 0.13 4.85 0.15 -0.74 -1.29 113.70 117.51 2k75 s SER 17 Ca 0.10 -0.35 0.01 0.00 0.70 0.00 0.00 55.95 56.41 2k75 s SER 17 Cb 0.06 -0.97 -0.04 0.00 -1.71 0.00 0.00 66.02 63.36 2k75 s SER 17 CO -0.07 0.27 -0.03 0.68 1.20 0.00 0.00 173.24 175.29 2k75 s VAL 18 N -0.30 0.63 -0.01 4.45 -7.23 -0.86 -2.38 120.40 114.69 2k75 s VAL 18 Ca 0.01 -1.95 -0.03 0.00 -1.81 0.00 0.00 61.98 58.21 2k75 s VAL 18 Cb -0.13 -1.89 0.00 0.00 0.56 0.00 0.00 36.38 34.92 2k75 s VAL 18 CO 0.03 -0.67 0.06 -0.51 -0.31 0.00 0.00 175.10 173.69 2k75 s ILE 19 N -3.68 0.03 -2.96 -0.62 2.07 -1.26 -1.62 121.20 113.16 2k75 s ILE 19 Ca 0.18 -0.29 0.00 0.00 -1.41 0.00 0.00 60.65 59.13 2k75 s ILE 19 Cb 0.06 -0.19 0.00 0.00 0.13 0.00 0.00 42.46 42.46 2k75 s ILE 19 CO -0.01 -0.16 0.00 0.61 -1.91 0.00 0.00 174.94 173.48 2k75 n GLY 20 N 2.51 -0.63 3.53 1.50 0.00 -1.04 -4.60 105.19 106.47 2k75 n GLY 20 Ca -0.16 -0.92 -0.33 0.00 0.00 0.00 0.00 46.02 44.60 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 -1.18 2.74 -0.17 1.61 -2.85 -0.96 -1.62 119.74 117.31 2k75 s LYS 21 Ca 0.00 -0.60 -0.12 0.00 -1.00 0.00 0.00 55.97 54.25 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 0.22 0.42 0.10 0.00 0.00 175.35 176.70 2k75 s ILE 22 N -0.68 5.36 0.10 3.79 1.01 -1.03 -2.41 121.20 127.34 2k75 s ILE 22 Ca 0.10 0.39 0.03 0.00 0.00 0.00 0.00 60.65 61.17 2k75 s ILE 22 Cb -0.11 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 2k75 s ILE 22 CO 0.01 0.44 -0.09 0.42 0.00 0.00 0.00 174.94 175.72 2k75 s THR 23 N 0.23 0.88 -0.34 2.92 -4.23 0.10 0.21 115.64 115.40 2k75 s THR 23 Ca 0.13 -1.72 -0.01 0.00 -1.18 0.00 0.00 61.69 58.91 2k75 s THR 23 Cb -0.12 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.28 2k75 s THR 23 CO 0.02 -0.64 0.34 0.61 -0.54 0.00 0.00 174.62 174.40 2k75 n GLY 24 N 0.39 -0.80 3.70 3.99 0.00 -1.26 -1.42 105.19 109.79 2k75 n GLY 24 Ca -0.15 0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 -2.83 4.81 -0.06 -0.61 -1.09 -1.26 -4.04 121.20 116.12 2k75 s ILE 25 Ca 0.02 2.03 0.03 0.00 -2.23 0.00 0.00 60.65 60.49 2k75 s ILE 25 Cb -0.00 -4.30 0.01 0.00 -1.58 0.00 0.00 42.46 36.58 2k75 s ILE 25 CO 0.37 0.11 -0.13 -2.28 -1.23 0.00 0.00 174.94 171.79 2k75 s HIS 26 N 1.32 1.43 -0.13 3.97 2.46 0.20 -4.97 115.29 119.58 2k75 s HIS 26 Ca 0.51 -0.50 -0.05 0.00 0.47 0.00 0.00 55.06 55.50 2k75 s HIS 26 Cb -0.21 -1.04 -0.04 0.00 -0.13 0.00 0.00 32.58 31.17 2k75 s HIS 26 CO 0.25 -0.24 0.05 0.21 -2.47 0.00 0.00 174.74 172.53 2k75 s LYS 27 N 0.53 3.45 0.07 2.88 2.20 -1.26 -1.00 119.74 126.61 2k75 s LYS 27 Ca -0.12 -0.34 -0.11 0.00 -0.36 0.00 0.00 55.97 55.04 2k75 s LYS 27 Cb -0.14 -3.02 0.01 0.00 -1.51 0.00 0.00 37.83 33.17 2k75 s LYS 27 CO 0.03 0.55 0.26 0.21 -0.36 0.00 0.00 175.35 176.03 2k75 s LYS 28 N -0.42 0.82 0.04 4.03 2.20 -0.82 -5.00 119.74 120.60 2k75 s LYS 28 Ca 0.09 -0.69 0.05 0.00 -0.36 0.00 0.00 55.97 55.05 2k75 s LYS 28 Cb -0.12 0.35 -0.04 0.00 -1.51 0.00 0.00 37.83 36.51 2k75 s LYS 28 CO 0.02 -0.27 -0.09 -1.21 -0.36 0.00 0.00 175.35 173.45 2k75 s GLU 29 N -3.09 2.39 0.06 4.03 2.02 -1.26 -0.18 118.70 122.67 2k75 s GLU 29 Ca -0.01 -0.83 -0.05 0.00 0.02 0.00 0.00 54.97 54.10 2k75 s GLU 29 Cb 0.01 -2.42 -0.02 0.00 0.10 0.00 0.00 34.13 31.81 2k75 s GLU 29 CO -0.07 0.57 0.08 1.52 0.02 0.00 0.00 175.26 177.38 2k75 s TYR 30 N -1.06 0.31 0.10 1.61 1.13 -0.69 -4.96 117.35 113.80 2k75 s TYR 30 Ca 0.18 -0.77 -0.27 0.00 -1.41 0.00 0.00 57.07 54.80 2k75 s TYR 30 Cb -0.11 -0.21 -0.06 0.00 -1.10 0.00 0.00 41.96 40.48 2k75 s TYR 30 CO 0.09 -0.45 0.83 -2.00 -2.51 0.00 0.00 175.55 171.51 2k75 s GLU 31 N -3.69 4.58 -0.15 -3.49 2.12 -1.26 -1.91 118.70 114.90 2k75 s GLU 31 Ca 0.04 1.21 -0.05 0.00 0.36 0.00 0.00 54.97 56.53 2k75 s GLU 31 Cb 0.05 -3.34 0.08 0.00 0.26 0.00 0.00 34.13 31.18 2k75 s GLU 31 CO -0.10 0.35 0.29 0.45 -0.54 0.00 0.00 175.26 175.71 2k75 s SER 32 N -0.36 0.36 -1.48 -1.70 0.15 0.11 -4.86 113.70 105.93 2k75 s SER 32 Ca 0.40 0.54 -0.02 0.00 0.70 0.00 0.00 55.95 57.57 2k75 s SER 32 Cb -0.22 0.79 0.01 0.00 -1.71 0.00 0.00 66.02 64.89 2k75 s SER 32 CO 0.26 -0.25 0.22 0.47 1.20 0.00 0.00 173.24 175.14 2k75 n ASP 33 N 5.35 -5.20 -0.03 5.45 8.00 -1.26 -0.48 116.55 128.38 2k75 n ASP 33 Ca -0.06 -0.08 -0.00 0.00 0.71 0.00 0.00 54.79 55.35 2k75 n ASP 33 Cb 0.50 -4.31 -0.00 0.00 -0.02 0.00 0.00 41.12 37.29 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 -1.12 0.47 3.31 0.44 0.00 -1.26 -5.02 105.19 102.01 2k75 n GLY 34 Ca -0.16 -0.34 -0.18 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.97 1.58 -0.22 2.61 -4.23 0.37 -5.12 115.64 108.65 2k75 s THR 35 Ca 0.00 -2.07 -0.16 0.00 -1.18 0.00 0.00 61.69 58.29 2k75 s THR 35 Cb 0.00 -1.90 -0.04 0.00 1.34 0.00 0.00 72.50 71.90 2k75 s THR 35 CO 0.00 -0.56 0.39 -0.89 -0.54 0.00 0.00 174.62 173.02 2k75 s THR 36 N -2.79 5.19 0.01 3.99 2.01 -1.26 0.09 115.64 122.88 2k75 s THR 36 Ca 0.18 0.67 0.05 0.00 0.31 0.00 0.00 61.69 62.90 2k75 s THR 36 Cb -0.01 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.76 2k75 s THR 36 CO 0.05 0.22 -0.17 -0.54 -0.69 0.00 0.00 174.62 173.49 2k75 s LYS 37 N 1.54 1.28 0.28 4.92 -0.14 -0.80 -4.96 119.74 121.86 2k75 s LYS 37 Ca 0.18 -0.69 -0.19 0.00 -1.36 0.00 0.00 55.97 53.91 2k75 s LYS 37 Cb -0.15 -1.27 -0.09 0.00 -1.68 0.00 0.00 37.83 34.64 2k75 s LYS 37 CO 0.08 0.34 0.76 -1.12 -0.76 0.00 0.00 175.35 174.66 2k75 s SER 38 N -0.67 6.98 -0.02 2.83 0.01 -1.26 -1.70 113.70 119.87 2k75 s SER 38 Ca 0.06 1.43 0.02 0.00 1.31 0.00 0.00 55.95 58.77 2k75 s SER 38 Cb -0.07 -2.43 0.00 0.00 0.21 0.00 0.00 66.02 63.73 2k75 s SER 38 CO 0.00 -0.08 -0.08 0.54 0.41 0.00 0.00 173.24 174.04 2k75 s VAL 39 N -1.73 0.64 -0.17 3.43 0.11 0.74 -1.94 120.40 121.48 2k75 s VAL 39 Ca 0.49 -0.31 -0.08 0.00 -2.93 0.00 0.00 61.98 59.15 2k75 s VAL 39 Cb -0.14 -0.56 -0.04 0.00 -1.53 0.00 0.00 36.38 34.11 2k75 s VAL 39 CO 0.20 0.20 0.09 -0.31 -3.33 0.00 0.00 175.10 171.94 2k75 s TYR 40 N 0.05 3.33 0.14 1.54 1.51 0.95 -1.93 117.35 122.94 2k75 s TYR 40 Ca -0.00 0.21 0.07 0.00 -1.01 0.00 0.00 57.07 56.33 2k75 s TYR 40 Cb -0.06 -2.06 -0.04 0.00 -0.11 0.00 0.00 41.96 39.69 2k75 s TYR 40 CO -0.00 0.29 -0.16 -0.65 -1.11 0.00 0.00 175.55 173.91 2k75 s GLN 41 N 0.10 1.16 0.00 -0.62 -0.21 -0.17 0.10 119.66 120.02 2k75 s GLN 41 Ca 0.06 -1.33 0.00 0.00 0.02 0.00 0.00 55.36 54.11 2k75 s GLN 41 Cb -0.12 -1.13 0.00 0.00 1.00 0.00 0.00 33.01 32.77 2k75 s GLN 41 CO 0.00 0.22 0.00 0.41 -2.12 0.00 0.00 175.29 173.80 2k75 n GLY 42 N 0.40 0.80 3.33 3.09 0.00 -0.99 -0.63 105.19 111.19 2k75 n GLY 42 Ca -0.14 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.80 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 -2.87 2.37 -0.07 1.61 1.51 -0.51 -2.07 117.35 117.33 2k75 s TYR 43 Ca 0.00 -0.41 0.04 0.00 -1.01 0.00 0.00 57.07 55.69 2k75 s TYR 43 Cb 0.00 -1.52 -0.00 0.00 -0.11 0.00 0.00 41.96 40.33 2k75 s TYR 43 CO 0.00 -0.02 -0.21 -1.50 -1.11 0.00 0.00 175.55 172.72 2k75 s ILE 44 N -0.62 1.75 0.11 2.71 2.07 -1.03 -0.73 121.20 125.45 2k75 s ILE 44 Ca 0.10 -0.87 0.04 0.00 -1.41 0.00 0.00 60.65 58.51 2k75 s ILE 44 Cb -0.10 -1.51 -0.04 0.00 0.13 0.00 0.00 42.46 40.95 2k75 s ILE 44 CO -0.01 0.49 -0.10 -1.83 -1.91 0.00 0.00 174.94 171.58 2k75 s GLU 45 N 0.16 0.89 0.00 3.50 -1.05 -1.01 -2.19 118.70 118.99 2k75 s GLU 45 Ca -0.10 -1.22 0.00 0.00 -0.15 0.00 0.00 54.97 53.50 2k75 s GLU 45 Cb -0.15 -0.54 0.00 0.00 -0.44 0.00 0.00 34.13 33.00 2k75 s GLU 45 CO 0.05 0.08 0.00 -0.40 0.95 0.00 0.00 175.26 175.93 2k75 n ASP 46 N 0.39 0.52 -0.34 0.83 5.75 -0.97 -2.28 116.55 120.45 2k75 n ASP 46 Ca -0.15 0.00 0.14 0.00 -0.01 0.00 0.00 54.79 54.77 2k75 n ASP 46 Cb 0.58 0.00 0.56 0.00 -1.03 0.00 0.00 41.12 41.23 2k75 n ASP 46 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 2k75 n ASP 47 N 0.00 1.12 -0.00 -1.12 5.75 -1.26 -4.39 116.55 116.64 2k75 n ASP 47 Ca 0.00 -1.23 -0.00 0.00 -0.01 0.00 0.00 54.79 53.55 2k75 n ASP 47 Cb 0.00 0.02 -0.00 0.00 -1.03 0.00 0.00 41.12 40.11 2k75 n ASP 47 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 2k75 n THR 48 N -0.24 0.05 -0.94 2.12 -2.24 -1.26 -5.13 114.28 106.64 2k75 n THR 48 Ca 0.18 0.46 0.00 0.00 -2.27 0.00 0.00 64.05 62.42 2k75 n THR 48 Cb 0.31 -1.50 0.00 0.00 -2.10 0.00 0.00 70.33 67.05 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 -2.56 0.00 -2.64 6.98 0.00 -1.26 -4.95 120.51 116.08 2k75 n ALA 49 Ca -0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.33 2k75 n ALA 49 Cb 0.02 0.00 -0.11 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 2.54 0.53 0.05 0.00 1.70 -1.26 -2.29 118.95 120.21 2k75 s ARG 50 Ca 0.00 -0.89 -0.17 0.00 -0.47 0.00 0.00 55.73 54.20 2k75 s ARG 50 Cb 0.00 -0.06 0.03 0.00 -0.57 0.00 0.00 34.95 34.35 2k75 s ARG 50 CO 0.00 -0.02 0.38 -1.50 -1.08 0.00 0.00 175.30 173.08 2k75 s ILE 51 N -2.25 0.06 0.34 4.99 2.07 -0.93 -4.98 121.20 120.50 2k75 s ILE 51 Ca -0.05 -0.52 -0.26 0.00 -1.41 0.00 0.00 60.65 58.40 2k75 s ILE 51 Cb -0.04 -0.95 -0.09 0.00 0.13 0.00 0.00 42.46 41.51 2k75 s ILE 51 CO -0.03 -0.29 1.04 -0.13 -1.91 0.00 0.00 174.94 173.63 2k75 s ARG 52 N -2.52 4.42 0.09 3.50 3.00 -1.26 -2.48 118.95 123.70 2k75 s ARG 52 Ca -0.05 1.58 0.04 0.00 0.00 0.00 0.00 55.73 57.30 2k75 s ARG 52 Cb -0.01 -2.84 -0.03 0.00 0.00 0.00 0.00 34.95 32.07 2k75 s ARG 52 CO -0.03 0.07 -0.11 0.96 0.00 0.00 0.00 175.30 176.19 2k75 s ILE 53 N -1.46 0.98 -0.09 1.52 -4.36 -0.88 -1.82 121.20 115.09 2k75 s ILE 53 Ca 0.51 -1.55 -0.03 0.00 -0.26 0.00 0.00 60.65 59.32 2k75 s ILE 53 Cb -0.25 -1.27 0.05 0.00 1.25 0.00 0.00 42.46 42.24 2k75 s ILE 53 CO 0.32 -0.47 0.17 -0.94 0.24 0.00 0.00 174.94 174.25 2k75 s SER 54 N -2.25 0.60 -0.06 4.36 1.04 -0.40 -2.36 113.70 114.63 2k75 s SER 54 Ca 0.03 0.35 0.03 0.00 0.48 0.00 0.00 55.95 56.84 2k75 s SER 54 Cb -0.05 0.30 -0.03 0.00 0.10 0.00 0.00 66.02 66.35 2k75 s SER 54 CO 0.01 -0.23 -0.13 -0.94 0.98 0.00 0.00 173.24 172.93 2k75 s SER 55 N 2.15 4.15 -0.26 7.02 1.04 0.12 -0.93 113.70 127.00 2k75 s SER 55 Ca 0.01 -0.17 -0.15 0.00 0.48 0.00 0.00 55.95 56.12 2k75 s SER 55 Cb -0.12 -1.00 -0.04 0.00 0.10 0.00 0.00 66.02 64.97 2k75 s SER 55 CO -0.06 0.33 0.36 -0.36 0.98 0.00 0.00 173.24 174.49 2k75 s PHE 56 N -0.62 3.27 0.00 5.02 0.08 -1.05 -0.04 117.98 124.64 2k75 s PHE 56 Ca 0.09 0.42 0.00 0.00 0.12 0.00 0.00 56.93 57.56 2k75 s PHE 56 Cb -0.11 -2.54 0.00 0.00 -0.57 0.00 0.00 43.02 39.80 2k75 s PHE 56 CO 0.01 -0.17 0.00 0.41 -0.10 0.00 0.00 175.22 175.37 2k75 n GLY 57 N 4.54 1.00 3.74 4.36 0.00 -0.82 -4.84 105.19 113.16 2k75 n GLY 57 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.52 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 4.50 0.38 1.61 1.02 -1.26 -5.01 119.74 120.97 2k75 s LYS 58 Ca 0.00 1.87 -0.08 0.00 0.02 0.00 0.00 55.97 57.77 2k75 s LYS 58 Cb 0.00 -3.24 -0.06 0.00 -0.52 0.00 0.00 37.83 34.01 2k75 s LYS 58 CO 0.00 -0.08 0.70 -1.14 -0.92 0.00 0.00 175.35 173.91 2k75 s GLN 59 N -0.23 3.71 0.11 1.68 0.74 -1.26 -4.55 119.66 119.87 2k75 s GLN 59 Ca 0.53 0.29 0.07 0.00 0.05 0.00 0.00 55.36 56.29 2k75 s GLN 59 Cb -0.32 -2.47 -0.04 0.00 1.10 0.00 0.00 33.01 31.28 2k75 s GLN 59 CO 0.36 0.02 -0.17 -0.51 -0.55 0.00 0.00 175.29 174.45 2k75 s LEU 60 N -3.86 2.35 -0.11 3.68 1.43 -1.26 -5.13 118.68 115.79 2k75 s LEU 60 Ca 0.48 -0.74 0.01 0.00 -1.03 0.00 0.00 54.13 52.85 2k75 s LEU 60 Cb -0.10 -0.69 -0.02 0.00 0.03 0.00 0.00 46.19 45.41 2k75 s LEU 60 CO 0.32 -0.05 -0.14 -1.10 0.23 0.00 0.00 176.35 175.61 2k75 s GLN 61 N -2.29 3.15 0.33 1.70 -0.21 -1.26 -5.01 119.66 116.08 2k75 s GLN 61 Ca 0.07 -0.70 -0.29 0.00 0.02 0.00 0.00 55.36 54.46 2k75 s GLN 61 Cb -0.08 -2.55 -0.10 0.00 1.00 0.00 0.00 33.01 31.28 2k75 s GLN 61 CO 0.04 0.31 1.37 0.34 -2.12 0.00 0.00 175.29 175.23 2k75 s ASP 62 N 0.09 6.64 0.00 5.90 -1.08 -1.26 -2.26 116.67 124.70 2k75 s ASP 62 Ca -0.06 2.78 0.00 0.00 -0.52 0.00 0.00 52.55 54.75 2k75 s ASP 62 Cb -0.15 -2.65 0.00 0.00 -1.46 0.00 0.00 42.92 38.66 2k75 s ASP 62 CO 0.05 -0.65 0.00 -1.20 0.52 0.00 0.00 175.17 173.89 2k75 n SER 63 N 0.96 -3.17 -4.71 -0.34 7.64 0.55 -4.93 113.62 109.63 2k75 n SER 63 Ca 0.01 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.48 2k75 n SER 63 Cb 0.41 -2.80 -0.03 0.00 -1.01 0.00 0.00 64.21 60.77 2k75 n SER 63 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2k75 s ASP 64 N -2.04 7.25 -0.25 6.43 -1.08 -0.96 -4.74 116.67 121.28 2k75 s ASP 64 Ca 0.00 1.51 -0.26 0.00 -0.52 0.00 0.00 52.55 53.28 2k75 s ASP 64 Cb 0.00 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.94 2k75 s ASP 64 CO 0.00 -0.25 0.90 0.68 0.52 0.00 0.00 175.17 177.02 2k75 s VAL 65 N 1.11 4.76 0.12 1.11 -7.23 -1.26 -2.46 120.40 116.55 2k75 s VAL 65 Ca 0.48 1.67 0.00 0.00 -1.81 0.00 0.00 61.98 62.31 2k75 s VAL 65 Cb -0.20 -4.20 -0.04 0.00 0.56 0.00 0.00 36.38 32.50 2k75 s VAL 65 CO 0.24 -0.16 0.01 0.68 -0.31 0.00 0.00 175.10 175.56 2k75 s VAL 66 N 3.03 0.35 -0.12 1.32 -7.23 -0.64 -2.39 120.40 114.72 2k75 s VAL 66 Ca 0.38 -1.91 0.02 0.00 -1.81 0.00 0.00 61.98 58.66 2k75 s VAL 66 Cb -0.15 -1.90 0.01 0.00 0.56 0.00 0.00 36.38 34.90 2k75 s VAL 66 CO 0.08 -0.64 -0.18 -0.60 -0.31 0.00 0.00 175.10 173.46 2k75 s ARG 67 N -3.96 2.52 -0.17 4.82 3.52 -0.56 -2.51 118.95 122.61 2k75 s ARG 67 Ca 0.19 -0.67 -0.05 0.00 -0.13 0.00 0.00 55.73 55.07 2k75 s ARG 67 Cb 0.07 -2.08 -0.03 0.00 -1.56 0.00 0.00 34.95 31.35 2k75 s ARG 67 CO -0.01 -0.03 -0.00 0.42 -0.81 0.00 0.00 175.30 174.86 2k75 s ILE 68 N 0.90 4.14 0.09 4.11 1.01 -0.64 -1.17 121.20 129.64 2k75 s ILE 68 Ca -0.07 -0.26 0.07 0.00 0.00 0.00 0.00 60.65 60.38 2k75 s ILE 68 Cb -0.15 -2.84 -0.04 0.00 0.01 0.00 0.00 42.46 39.44 2k75 s ILE 68 CO -0.01 0.47 -0.12 -1.81 0.00 0.00 0.00 174.94 173.47 2k75 s ASP 69 N 0.47 4.25 -1.43 3.58 1.01 -0.38 -2.03 116.67 122.14 2k75 s ASP 69 Ca -0.01 -0.40 -0.06 0.00 0.71 0.00 0.00 52.55 52.78 2k75 s ASP 69 Cb -0.14 -0.78 0.01 0.00 1.01 0.00 0.00 42.92 43.02 2k75 s ASP 69 CO 0.02 0.20 0.79 -3.20 0.21 0.00 0.00 175.17 173.19 2k75 n ASN 70 N 0.89 -6.08 -4.73 0.27 2.85 -1.24 -2.47 115.26 104.76 2k75 n ASN 70 Ca -0.14 -0.37 -0.41 0.00 -0.11 0.00 0.00 54.58 53.55 2k75 n ASN 70 Cb 0.52 -4.82 -0.03 0.00 1.24 0.00 0.00 39.78 36.69 2k75 n ASN 70 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2k75 s ALA 71 N -3.21 3.39 -0.02 5.20 0.00 -0.41 -4.62 121.76 122.08 2k75 s ALA 71 Ca 0.39 0.86 -0.25 0.00 0.00 0.00 0.00 51.96 52.96 2k75 s ALA 71 Cb -0.17 -3.40 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 2k75 s ALA 71 CO 0.49 -0.34 0.78 0.50 0.00 0.00 0.00 175.76 177.19 2k75 s ARG 72 N 0.21 4.48 -0.00 0.00 3.52 -0.91 -1.89 118.95 124.36 2k75 s ARG 72 Ca 0.54 1.05 -0.22 0.00 -0.13 0.00 0.00 55.73 56.97 2k75 s ARG 72 Cb -0.30 -3.43 -0.05 0.00 -1.56 0.00 0.00 34.95 29.61 2k75 s ARG 72 CO 0.33 0.09 0.65 0.08 -0.81 0.00 0.00 175.30 175.64 2k75 s VAL 73 N 0.64 4.89 0.04 7.11 1.01 -0.48 -0.12 120.40 133.48 2k75 s VAL 73 Ca 0.41 1.36 -0.04 0.00 0.00 0.00 0.00 61.98 63.71 2k75 s VAL 73 Cb -0.19 -3.99 -0.02 0.00 0.00 0.00 0.00 36.38 32.18 2k75 s VAL 73 CO 0.22 0.38 0.06 0.00 0.00 0.00 0.00 175.10 175.76 2k75 s ALA 74 N -0.02 0.05 -0.22 5.51 0.00 -0.27 -4.93 121.76 121.88 2k75 s ALA 74 Ca 0.34 -0.65 -0.01 0.00 0.00 0.00 0.00 51.96 51.64 2k75 s ALA 74 Cb -0.19 0.23 0.02 0.00 0.00 0.00 0.00 23.12 23.19 2k75 s ALA 74 CO 0.19 -0.30 -0.11 -1.14 0.00 0.00 0.00 175.76 174.40 2k75 s GLN 75 N -2.60 2.99 -0.05 0.00 0.74 -1.26 -0.65 119.66 118.82 2k75 s GLN 75 Ca -0.05 -0.86 0.04 0.00 0.05 0.00 0.00 55.36 54.53 2k75 s GLN 75 Cb -0.01 -2.83 0.00 0.00 1.10 0.00 0.00 33.01 31.27 2k75 s GLN 75 CO -0.05 -0.29 -0.16 -0.06 -0.55 0.00 0.00 175.29 174.18 2k75 s PHE 76 N 1.34 1.69 -1.48 1.67 0.08 0.07 -4.72 117.98 116.62 2k75 s PHE 76 Ca 0.03 -0.55 -0.02 0.00 0.12 0.00 0.00 56.93 56.51 2k75 s PHE 76 Cb -0.15 -1.17 0.01 0.00 -0.57 0.00 0.00 43.02 41.14 2k75 s PHE 76 CO -0.07 -0.22 0.19 0.09 -0.10 0.00 0.00 175.22 175.11 2k75 n ASN 77 N 3.39 -5.20 0.00 1.36 3.02 -1.26 -0.31 115.26 116.26 2k75 n ASN 77 Ca -0.20 -0.06 0.00 0.00 -0.03 0.00 0.00 54.58 54.29 2k75 n ASN 77 Cb 0.53 -4.31 0.00 0.00 -0.61 0.00 0.00 39.78 35.38 2k75 n ASN 77 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k75 n GLY 78 N -1.10 0.62 3.42 7.41 0.00 -1.26 -5.00 105.19 109.28 2k75 n GLY 78 Ca -0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.65 2.80 0.38 1.61 2.02 0.58 -5.11 117.35 116.99 2k75 s TYR 79 Ca 0.00 -0.46 -0.24 0.00 -0.37 0.00 0.00 57.07 56.00 2k75 s TYR 79 Cb 0.00 -1.79 -0.10 0.00 -0.40 0.00 0.00 41.96 39.68 2k75 s TYR 79 CO 0.00 -0.07 1.00 -0.51 -1.57 0.00 0.00 175.55 174.40 2k75 s LEU 80 N 0.01 4.16 0.16 -1.29 1.43 -1.26 -0.75 118.68 121.14 2k75 s LEU 80 Ca -0.04 1.91 -0.19 0.00 -1.03 0.00 0.00 54.13 54.79 2k75 s LEU 80 Cb -0.14 -4.20 0.04 0.00 0.03 0.00 0.00 46.19 41.92 2k75 s LEU 80 CO 0.04 -0.34 0.51 -0.94 0.23 0.00 0.00 176.35 175.85 2k75 s SER 81 N -1.70 -0.33 -0.17 2.29 1.04 0.17 -4.20 113.70 110.80 2k75 s SER 81 Ca 0.56 -0.30 -0.06 0.00 0.48 0.00 0.00 55.95 56.63 2k75 s SER 81 Cb -0.18 0.55 -0.04 0.00 0.10 0.00 0.00 66.02 66.45 2k75 s SER 81 CO 0.24 -0.97 0.02 -0.76 0.98 0.00 0.00 173.24 172.75 2k75 s LEU 82 N -2.82 3.60 -0.18 2.42 1.43 -0.76 -1.12 118.68 121.26 2k75 s LEU 82 Ca 0.05 0.01 -0.05 0.00 -1.03 0.00 0.00 54.13 53.11 2k75 s LEU 82 Cb -0.00 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 2k75 s LEU 82 CO -0.08 0.19 -0.00 -0.55 0.23 0.00 0.00 176.35 176.13 2k75 s SER 83 N 0.28 4.98 -0.42 2.29 0.15 0.82 -1.27 113.70 120.53 2k75 s SER 83 Ca 0.01 -0.12 -0.13 0.00 0.70 0.00 0.00 55.95 56.41 2k75 s SER 83 Cb -0.13 -1.84 0.05 0.00 -1.71 0.00 0.00 66.02 62.39 2k75 s SER 83 CO 0.01 0.13 0.30 -0.69 1.20 0.00 0.00 173.24 174.19 2k75 s VAL 84 N 0.62 4.93 0.50 4.45 1.01 -0.10 -2.14 120.40 129.66 2k75 s VAL 84 Ca -0.01 -0.95 0.03 0.00 0.00 0.00 0.00 61.98 61.05 2k75 s VAL 84 Cb -0.14 -3.85 0.09 0.00 0.00 0.00 0.00 36.38 32.48 2k75 s VAL 84 CO 0.02 -0.41 0.68 0.61 0.00 0.00 0.00 175.10 176.00 2k75 n GLY 85 N 5.10 1.28 0.21 4.51 0.00 -1.26 -2.53 105.19 112.49 2k75 n GLY 85 Ca -0.12 -2.10 0.15 0.00 0.00 0.00 0.00 46.02 43.95 2k75 n GLY 85 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2k75 h ASP 86 N -0.20 0.00 0.68 1.61 3.32 -1.98 -1.58 116.42 118.28 2k75 h ASP 86 Ca -0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.82 2k75 h ASP 86 Cb 0.93 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.48 2k75 h ASP 86 CO 0.28 0.00 -0.20 -1.20 -1.72 0.00 0.00 179.24 176.40 2k75 n SER 87 N -2.66 0.28 -4.92 6.45 7.64 -1.26 -4.86 113.62 114.29 2k75 n SER 87 Ca 0.01 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.63 2k75 n SER 87 Cb 0.25 -0.15 0.06 0.00 -1.01 0.00 0.00 64.21 63.36 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 -2.88 5.06 -0.01 6.43 0.15 -0.60 -4.99 113.70 116.87 2k75 s SER 88 Ca 0.16 0.58 0.04 0.00 0.70 0.00 0.00 55.95 57.43 2k75 s SER 88 Cb 0.19 -1.33 -0.01 0.00 -1.71 0.00 0.00 66.02 63.16 2k75 s SER 88 CO 0.58 -1.44 -0.14 -0.13 1.20 0.00 0.00 173.24 173.31 2k75 s ARG 89 N -5.19 1.14 -0.09 5.44 1.81 -1.03 -4.92 118.95 116.12 2k75 s ARG 89 Ca 0.58 -0.50 0.04 0.00 -1.72 0.00 0.00 55.73 54.14 2k75 s ARG 89 Cb -0.11 -1.10 -0.00 0.00 -0.45 0.00 0.00 34.95 33.29 2k75 s ARG 89 CO 0.45 0.30 -0.23 0.42 -0.68 0.00 0.00 175.30 175.56 2k75 s ILE 90 N -0.31 2.01 -0.24 1.52 1.01 -1.26 -1.26 121.20 122.67 2k75 s ILE 90 Ca 0.05 -1.00 0.02 0.00 0.00 0.00 0.00 60.65 59.72 2k75 s ILE 90 Cb -0.06 -1.73 0.06 0.00 0.01 0.00 0.00 42.46 40.74 2k75 s ILE 90 CO -0.00 0.55 -0.09 -0.70 0.00 0.00 0.00 174.94 174.69 2k75 s GLU 91 N 0.27 2.03 0.43 2.79 2.12 -0.32 -4.98 118.70 121.04 2k75 s GLU 91 Ca -0.16 -1.13 -0.23 0.00 0.36 0.00 0.00 54.97 53.81 2k75 s GLU 91 Cb -0.17 -2.70 -0.08 0.00 0.26 0.00 0.00 34.13 31.43 2k75 s GLU 91 CO 0.08 -0.54 1.08 0.45 -0.54 0.00 0.00 175.26 175.79 2k75 s SER 92 N 1.25 6.53 -0.13 -1.70 0.15 -1.26 -1.49 113.70 117.05 2k75 s SER 92 Ca -0.06 2.10 0.02 0.00 0.70 0.00 0.00 55.95 58.70 2k75 s SER 92 Cb -0.19 -2.59 -0.00 0.00 -1.71 0.00 0.00 66.02 61.53 2k75 s SER 92 CO -0.06 -0.66 -0.18 -0.69 1.20 0.00 0.00 173.24 172.85 2k75 s VAL 93 N -1.67 2.51 0.00 4.45 1.01 -1.00 -4.83 120.40 120.86 2k75 s VAL 93 Ca 0.61 -0.85 0.00 0.00 0.00 0.00 0.00 61.98 61.74 2k75 s VAL 93 Cb -0.23 -2.02 0.00 0.00 0.00 0.00 0.00 36.38 34.13 2k75 s VAL 93 CO 0.28 0.54 0.00 -3.20 0.00 0.00 0.00 175.10 172.72 2k75 n ASN 94 N 3.70 0.00 -1.22 3.32 5.15 -1.26 -4.69 115.26 120.26 2k75 n ASN 94 Ca -0.19 0.00 0.13 0.00 -0.60 0.00 0.00 54.58 53.92 2k75 n ASN 94 Cb 0.52 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.71 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 -0.14 -0.54 -2.50 3.44 0.31 -1.26 -4.91 118.33 112.72 2k75 n VAL 95 Ca 0.00 0.63 -0.04 0.00 -0.01 0.00 0.00 64.34 64.93 2k75 n VAL 95 Cb 0.00 -1.00 -0.03 0.00 -0.91 0.00 0.00 33.84 31.90 2k75 n VAL 95 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2k75 n ASN 96 N -4.09 -3.99 -3.99 4.52 2.85 -1.26 -4.16 115.26 105.14 2k75 n ASN 96 Ca -0.06 1.57 -0.34 0.00 -0.11 0.00 0.00 54.58 55.64 2k75 n ASN 96 Cb 0.55 -5.29 0.01 0.00 1.24 0.00 0.00 39.78 36.28 2k75 n ASN 96 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 2k75 n ILE 97 N 1.77 -1.80 -2.28 -1.44 -5.35 -1.26 -4.86 119.36 104.15 2k75 n ILE 97 Ca -0.26 -0.43 -0.34 0.00 -0.27 0.00 0.00 62.75 61.45 2k75 n ILE 97 Cb 0.41 -1.54 -0.00 0.00 -1.74 0.00 0.00 39.64 36.76 2k75 n ILE 97 CO 0.00 0.00 0.00 -2.16 -1.76 0.00 0.00 176.55 172.63 2k75 s PRO 98 N -6.80 3.42 0.28 6.28 0.04 -1.26 -4.74 135.00 132.23 2k75 s PRO 98 Ca 0.33 1.49 0.00 0.00 0.04 0.00 0.00 61.00 62.87 2k75 s PRO 98 Cb -0.19 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.33 2k75 s PRO 98 CO 0.72 -0.77 0.00 1.28 0.04 0.00 0.00 177.00 178.27 2k75 n LEU 99 N -1.36 -6.20 -4.77 -3.56 4.77 -1.26 -4.87 117.00 99.75 2k75 n LEU 99 Ca 0.11 3.34 -0.39 0.00 -0.03 0.00 0.00 56.01 59.03 2k75 n LEU 99 Cb 0.52 -3.22 -0.03 0.00 -2.33 0.00 0.00 43.42 38.35 2k75 n LEU 99 CO 0.42 -1.31 0.82 -1.61 -1.33 0.00 0.00 177.39 174.38 2k75 s GLU 100 N -1.14 4.39 0.15 3.23 2.02 -1.26 -4.66 118.70 121.42 2k75 s GLU 100 Ca 0.00 1.81 0.00 0.00 0.02 0.00 0.00 54.97 56.80 2k75 s GLU 100 Cb 0.00 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 31.28 2k75 s GLU 100 CO 0.00 -0.02 0.00 0.72 0.02 0.00 0.00 175.26 175.98 2k75 n HIS 101 N 0.67 0.00 -3.07 1.61 8.25 -1.26 -4.80 115.22 116.62 2k75 n HIS 101 Ca 0.01 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.46 2k75 n HIS 101 Cb 0.46 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.57 2k75 n HIS 101 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2k75 n HIS 102 N 0.00 -1.27 -0.05 4.41 -0.00 -1.26 -4.97 115.22 112.08 2k75 n HIS 102 Ca 0.00 0.56 0.00 0.00 -0.00 0.00 0.00 57.72 58.28 2k75 n HIS 102 Cb 0.00 -1.91 0.00 0.00 -0.00 0.00 0.00 29.99 28.08 2k75 n HIS 102 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2k75 n HIS 103 N 1.05 -0.37 -2.75 1.57 -0.00 -1.26 -4.85 115.22 108.63 2k75 n HIS 103 Ca -0.00 0.00 -0.01 0.00 0.46 0.00 0.00 57.72 58.17 2k75 n HIS 103 Cb 0.37 0.00 -0.01 0.00 -0.12 0.00 0.00 29.99 30.23 2k75 n HIS 103 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2k75 n HIS 104 N -0.28 -3.69 -0.22 1.57 8.25 -1.26 -4.88 115.22 114.72 2k75 n HIS 104 Ca 0.00 1.78 -0.08 0.00 -0.26 0.00 0.00 57.72 59.16 2k75 n HIS 104 Cb 0.00 -3.67 0.05 0.00 1.12 0.00 0.00 29.99 27.49 2k75 n HIS 104 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2k75 h HIS 105 N 3.42 1.16 0.00 4.41 -0.00 -2.01 -3.56 115.15 118.57 2k75 h HIS 105 Ca -0.13 -0.18 0.00 0.00 -0.00 0.00 0.00 60.37 60.06 2k75 h HIS 105 Cb 0.39 -0.31 0.00 0.00 -0.00 0.00 0.00 27.41 27.48 2k75 h HIS 105 CO 0.01 1.00 0.00 1.58 -0.00 0.00 0.00 177.93 180.51