#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 4.55 -0.05 4.04 1.47 -1.26 -4.41 116.67 121.01 2k75 s ASP 2 Ca 0.00 0.52 -0.28 0.00 1.18 0.00 0.00 52.55 53.96 2k75 s ASP 2 Cb 0.00 -1.05 -0.03 0.00 -0.34 0.00 0.00 42.92 41.50 2k75 s ASP 2 CO 0.00 -1.80 0.92 -0.22 0.68 0.00 0.00 175.17 174.75 2k75 s LEU 3 N -5.41 4.32 0.12 2.11 2.96 -1.26 -1.90 118.68 119.62 2k75 s LEU 3 Ca 0.62 1.50 0.00 0.00 -0.22 0.00 0.00 54.13 56.04 2k75 s LEU 3 Cb -0.10 -3.45 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 2k75 s LEU 3 CO 0.47 -0.29 0.00 0.68 -1.32 0.00 0.00 176.35 175.89 2k75 s VAL 4 N 1.28 0.37 0.65 1.68 -7.23 -0.94 -4.96 120.40 111.26 2k75 s VAL 4 Ca 0.47 -1.91 -0.11 0.00 -1.81 0.00 0.00 61.98 58.62 2k75 s VAL 4 Cb -0.19 -1.87 -0.02 0.00 0.56 0.00 0.00 36.38 34.86 2k75 s VAL 4 CO 0.23 -0.67 1.04 -0.54 -0.31 0.00 0.00 175.10 174.85 2k75 s LYS 5 N -3.95 3.27 0.16 4.82 1.02 -1.26 -4.67 119.74 119.14 2k75 s LYS 5 Ca 0.18 0.89 -0.13 0.00 0.02 0.00 0.00 55.97 56.93 2k75 s LYS 5 Cb 0.07 -2.03 0.05 0.00 -0.52 0.00 0.00 37.83 35.40 2k75 s LYS 5 CO -0.02 -0.83 1.70 0.82 -0.92 0.00 0.00 175.35 176.09 2k75 h ILE 6 N -0.42 1.23 0.00 2.17 1.08 -1.94 -2.18 117.51 117.44 2k75 h ILE 6 Ca -0.44 -0.76 0.00 0.00 -0.39 0.00 0.00 64.86 63.27 2k75 h ILE 6 Cb 1.20 0.70 0.00 0.00 -3.07 0.00 0.00 36.82 35.65 2k75 h ILE 6 CO 0.59 0.29 0.00 0.08 -0.69 0.00 0.00 178.15 178.42 2k75 h ARG 7 N 0.75 0.00 -0.01 2.37 0.11 -1.93 -1.19 114.38 114.49 2k75 h ARG 7 Ca 0.18 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.26 2k75 h ARG 7 Cb 0.25 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.33 2k75 h ARG 7 CO -0.01 0.00 -0.06 -3.47 0.10 0.00 0.00 179.97 176.53 2k75 n ASP 8 N -2.78 0.85 -4.73 0.08 -0.08 -0.82 -4.87 116.55 104.19 2k75 n ASP 8 Ca -0.00 -1.08 -0.42 0.00 -1.51 0.00 0.00 54.79 51.78 2k75 n ASP 8 Cb 0.19 -0.00 -0.03 0.00 2.34 0.00 0.00 41.12 43.62 2k75 n ASP 8 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2k75 s VAL 9 N -2.18 2.82 0.23 5.18 1.01 -0.45 -4.96 120.40 122.06 2k75 s VAL 9 Ca 0.36 0.65 -0.18 0.00 0.00 0.00 0.00 61.98 62.82 2k75 s VAL 9 Cb 0.21 -3.42 0.02 0.00 0.00 0.00 0.00 36.38 33.19 2k75 s VAL 9 CO 0.40 0.09 0.57 -0.94 0.00 0.00 0.00 175.10 175.22 2k75 s SER 10 N 0.60 -0.23 0.32 3.32 1.04 -1.26 -5.03 113.70 112.46 2k75 s SER 10 Ca 0.62 -0.61 0.03 0.00 0.48 0.00 0.00 55.95 56.46 2k75 s SER 10 Cb -0.41 0.63 0.53 0.00 0.10 0.00 0.00 66.02 66.87 2k75 s SER 10 CO 0.38 -1.16 1.84 -0.07 0.98 0.00 0.00 173.24 175.21 2k75 h LEU 11 N 2.15 0.54 -2.38 2.42 3.38 -1.94 -1.45 115.31 118.03 2k75 h LEU 11 Ca -0.25 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2k75 h LEU 11 Cb 1.26 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.86 2k75 h LEU 11 CO 0.32 0.63 0.15 0.77 0.09 0.00 0.00 178.44 180.41 2k75 h SER 12 N 0.54 0.00 -3.31 -0.43 4.64 -1.98 -3.16 113.55 109.86 2k75 h SER 12 Ca 0.11 0.00 -0.66 0.00 -0.47 0.00 0.00 61.79 60.77 2k75 h SER 12 Cb 0.38 0.00 -0.39 0.00 -0.31 0.00 0.00 62.40 62.09 2k75 h SER 12 CO 0.02 0.00 -0.34 0.42 -0.87 0.00 0.00 176.83 176.06 2k75 s THR 13 N -4.05 3.62 -0.39 2.95 -4.23 -0.55 -4.89 115.64 108.11 2k75 s THR 13 Ca -0.04 -4.00 0.26 0.00 -1.18 0.00 0.00 61.69 56.73 2k75 s THR 13 Cb 0.10 -3.30 0.29 0.00 1.34 0.00 0.00 72.50 70.93 2k75 s THR 13 CO 0.32 -1.03 1.78 1.55 -0.54 0.00 0.00 174.62 176.70 2k75 h PRO 14 N 5.79 0.00 -4.08 3.99 0.13 -1.74 -3.41 132.00 132.68 2k75 h PRO 14 Ca 0.14 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.69 2k75 h PRO 14 Cb 0.79 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.54 2k75 h PRO 14 CO 0.78 0.00 -0.78 0.71 -0.23 0.00 0.00 178.00 178.48 2k75 s TYR 15 N -3.36 1.93 0.10 1.56 2.02 -1.26 -2.31 117.35 116.05 2k75 s TYR 15 Ca 0.05 -1.45 -0.07 0.00 -0.37 0.00 0.00 57.07 55.23 2k75 s TYR 15 Cb 0.09 -1.39 -0.01 0.00 -0.40 0.00 0.00 41.96 40.25 2k75 s TYR 15 CO 0.47 -0.72 0.17 0.14 -1.57 0.00 0.00 175.55 174.03 2k75 s VAL 16 N 1.55 0.13 -0.06 0.71 -7.23 -1.01 -4.44 120.40 110.05 2k75 s VAL 16 Ca -0.04 -1.39 0.04 0.00 -1.81 0.00 0.00 61.98 58.78 2k75 s VAL 16 Cb -0.18 -1.54 -0.02 0.00 0.56 0.00 0.00 36.38 35.19 2k75 s VAL 16 CO -0.07 -0.61 -0.19 -0.55 -0.31 0.00 0.00 175.10 173.38 2k75 s SER 17 N -2.91 3.63 0.12 4.85 0.15 -0.80 -1.20 113.70 117.54 2k75 s SER 17 Ca 0.10 -0.34 0.02 0.00 0.70 0.00 0.00 55.95 56.43 2k75 s SER 17 Cb 0.05 -0.91 -0.04 0.00 -1.71 0.00 0.00 66.02 63.41 2k75 s SER 17 CO -0.07 0.28 -0.07 0.68 1.20 0.00 0.00 173.24 175.26 2k75 s VAL 18 N -0.37 0.82 -0.07 4.45 -7.23 -0.59 -2.22 120.40 115.20 2k75 s VAL 18 Ca 0.03 -1.97 -0.04 0.00 -1.81 0.00 0.00 61.98 58.19 2k75 s VAL 18 Cb -0.12 -1.76 0.03 0.00 0.56 0.00 0.00 36.38 35.09 2k75 s VAL 18 CO 0.02 -0.81 0.17 -0.51 -0.31 0.00 0.00 175.10 173.65 2k75 s ILE 19 N -3.55 -0.03 -0.55 -0.62 2.07 -1.26 -0.74 121.20 116.53 2k75 s ILE 19 Ca 0.14 0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.49 2k75 s ILE 19 Cb 0.05 -0.26 0.00 0.00 0.13 0.00 0.00 42.46 42.38 2k75 s ILE 19 CO -0.03 0.04 0.00 0.61 -1.91 0.00 0.00 174.94 173.66 2k75 n GLY 20 N 3.76 -0.73 3.64 1.50 0.00 -1.10 -4.76 105.19 107.50 2k75 n GLY 20 Ca -0.21 -0.70 -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 -0.22 3.46 -0.18 1.61 2.20 -0.99 -2.44 119.74 123.19 2k75 s LYS 21 Ca 0.00 -0.39 -0.07 0.00 -0.36 0.00 0.00 55.97 55.14 2k75 s LYS 21 Cb 0.00 -2.97 -0.04 0.00 -1.51 0.00 0.00 37.83 33.31 2k75 s LYS 21 CO 0.00 0.48 0.06 0.42 -0.36 0.00 0.00 175.35 175.95 2k75 s ILE 22 N -0.25 4.81 0.16 5.43 1.01 -0.93 -2.34 121.20 129.09 2k75 s ILE 22 Ca 0.06 -0.03 0.02 0.00 0.00 0.00 0.00 60.65 60.71 2k75 s ILE 22 Cb -0.12 -3.16 -0.05 0.00 0.01 0.00 0.00 42.46 39.14 2k75 s ILE 22 CO 0.02 0.47 -0.02 0.42 0.00 0.00 0.00 174.94 175.83 2k75 s THR 23 N 0.27 0.78 0.00 2.92 -4.23 -0.22 0.24 115.64 115.40 2k75 s THR 23 Ca 0.04 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 2k75 s THR 23 Cb -0.12 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.67 2k75 s THR 23 CO 0.00 -0.55 0.00 0.61 -0.54 0.00 0.00 174.62 174.14 2k75 n GLY 24 N -0.23 2.00 2.06 3.99 0.00 -1.26 -1.57 105.19 110.18 2k75 n GLY 24 Ca -0.08 -0.52 0.00 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 0.00-12.29 -3.82 -0.61 2.08 -1.23 -4.91 119.36 98.58 2k75 n ILE 25 Ca 0.00 3.20 -0.12 0.00 0.56 0.00 0.00 62.75 66.38 2k75 n ILE 25 Cb 0.00 -5.07 -0.13 0.00 -0.75 0.00 0.00 39.64 33.69 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 -0.57 -0.15 -0.18 1.39 3.76 0.10 -4.95 115.29 114.70 2k75 s HIS 26 Ca 0.00 0.37 -0.07 0.00 -0.15 0.00 0.00 55.06 55.21 2k75 s HIS 26 Cb 0.00 0.04 -0.04 0.00 1.11 0.00 0.00 32.58 33.69 2k75 s HIS 26 CO 0.00 -0.08 0.05 0.21 -0.85 0.00 0.00 174.74 174.07 2k75 s LYS 27 N 0.18 3.92 0.15 1.40 2.20 -1.26 -1.37 119.74 124.96 2k75 s LYS 27 Ca -0.01 -0.36 -0.06 0.00 -0.36 0.00 0.00 55.97 55.18 2k75 s LYS 27 Cb -0.02 -3.17 -0.02 0.00 -1.51 0.00 0.00 37.83 33.11 2k75 s LYS 27 CO -0.00 0.29 0.19 0.15 -0.36 0.00 0.00 175.35 175.61 2k75 s LYS 28 N 0.32 1.06 0.08 4.03 1.02 -0.68 -4.99 119.74 120.57 2k75 s LYS 28 Ca 0.02 -1.29 0.10 0.00 0.02 0.00 0.00 55.97 54.82 2k75 s LYS 28 Cb -0.12 0.32 -0.03 0.00 -0.52 0.00 0.00 37.83 37.47 2k75 s LYS 28 CO 0.00 -0.35 -0.26 -1.21 -0.92 0.00 0.00 175.35 172.61 2k75 s GLU 29 N -4.00 1.60 0.11 1.68 2.02 -1.26 -0.30 118.70 118.55 2k75 s GLU 29 Ca 0.20 -1.18 -0.04 0.00 0.02 0.00 0.00 54.97 53.97 2k75 s GLU 29 Cb 0.05 -1.89 -0.03 0.00 0.10 0.00 0.00 34.13 32.36 2k75 s GLU 29 CO 0.01 0.47 0.10 1.52 0.02 0.00 0.00 175.26 177.38 2k75 s TYR 30 N -0.91 0.57 -0.37 1.61 1.13 -0.88 -4.97 117.35 113.54 2k75 s TYR 30 Ca 0.12 -1.00 -0.23 0.00 -1.41 0.00 0.00 57.07 54.55 2k75 s TYR 30 Cb -0.10 -0.31 0.01 0.00 -1.10 0.00 0.00 41.96 40.46 2k75 s TYR 30 CO 0.03 -0.53 0.76 -1.21 -2.51 0.00 0.00 175.55 172.10 2k75 s GLU 31 N -3.97 3.72 -0.36 -3.49 8.01 -1.26 -1.90 118.70 119.45 2k75 s GLU 31 Ca 0.15 0.24 -0.05 0.00 0.01 0.00 0.00 54.97 55.32 2k75 s GLU 31 Cb 0.06 -3.82 0.06 0.00 -4.31 0.00 0.00 34.13 26.13 2k75 s GLU 31 CO -0.04 -0.85 0.13 0.45 0.01 0.00 0.00 175.26 174.96 2k75 s SER 32 N 1.85 5.27 -1.38 -0.19 0.15 0.18 -4.60 113.70 114.98 2k75 s SER 32 Ca 0.30 -1.39 0.00 0.00 0.70 0.00 0.00 55.95 55.56 2k75 s SER 32 Cb -0.13 -1.85 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 2k75 s SER 32 CO 0.17 -0.39 0.00 -0.67 1.20 0.00 0.00 173.24 173.55 2k75 n ASP 33 N 4.75 -4.59 0.00 5.45 -0.08 -1.26 0.28 116.55 121.11 2k75 n ASP 33 Ca -0.10 0.15 0.00 0.00 -1.51 0.00 0.00 54.79 53.33 2k75 n ASP 33 Cb 0.43 -3.90 0.00 0.00 2.34 0.00 0.00 41.12 39.99 2k75 n ASP 33 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k75 n GLY 34 N -0.80 0.75 3.13 0.27 0.00 -1.26 -5.04 105.19 102.23 2k75 n GLY 34 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.18 1.73 0.10 2.61 2.01 0.14 -5.10 115.64 114.94 2k75 s THR 35 Ca 0.00 -0.80 -0.31 0.00 0.31 0.00 0.00 61.69 60.89 2k75 s THR 35 Cb 0.00 -1.54 -0.07 0.00 0.01 0.00 0.00 72.50 70.91 2k75 s THR 35 CO 0.00 0.49 1.24 -0.89 -0.69 0.00 0.00 174.62 174.76 2k75 s THR 36 N 0.70 3.79 0.02 -0.82 2.01 -1.26 0.48 115.64 120.55 2k75 s THR 36 Ca -0.12 1.32 0.02 0.00 0.31 0.00 0.00 61.69 63.22 2k75 s THR 36 Cb -0.16 -3.85 -0.02 0.00 0.01 0.00 0.00 72.50 68.48 2k75 s THR 36 CO 0.03 0.13 -0.06 -0.54 -0.69 0.00 0.00 174.62 173.48 2k75 s LYS 37 N 0.80 0.43 0.38 4.92 1.02 -0.80 -4.91 119.74 121.58 2k75 s LYS 37 Ca 0.59 -0.53 -0.21 0.00 0.02 0.00 0.00 55.97 55.84 2k75 s LYS 37 Cb -0.32 -0.24 -0.10 0.00 -0.52 0.00 0.00 37.83 36.65 2k75 s LYS 37 CO 0.31 0.05 0.90 -1.54 -0.92 0.00 0.00 175.35 174.14 2k75 s SER 38 N -1.06 6.99 -0.00 2.83 1.04 -1.26 -2.07 113.70 120.16 2k75 s SER 38 Ca -0.07 1.62 0.00 0.00 0.48 0.00 0.00 55.95 57.99 2k75 s SER 38 Cb -0.07 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.54 2k75 s SER 38 CO 0.00 -0.25 -0.00 0.54 0.98 0.00 0.00 173.24 174.50 2k75 s VAL 39 N -2.00 0.06 -0.16 5.02 0.11 0.59 -2.15 120.40 121.88 2k75 s VAL 39 Ca 0.57 -0.00 -0.06 0.00 -2.93 0.00 0.00 61.98 59.56 2k75 s VAL 39 Cb -0.11 -0.08 -0.04 0.00 -1.53 0.00 0.00 36.38 34.62 2k75 s VAL 39 CO 0.16 0.03 0.05 -0.31 -3.33 0.00 0.00 175.10 171.71 2k75 s TYR 40 N 0.16 3.25 0.14 1.54 1.51 0.62 -1.68 117.35 122.90 2k75 s TYR 40 Ca -0.01 0.11 0.06 0.00 -1.01 0.00 0.00 57.07 56.22 2k75 s TYR 40 Cb -0.03 -2.00 -0.04 0.00 -0.11 0.00 0.00 41.96 39.78 2k75 s TYR 40 CO -0.00 0.25 -0.13 -0.65 -1.11 0.00 0.00 175.55 173.90 2k75 s GLN 41 N 0.00 1.09 0.00 -0.62 -0.21 -0.47 0.23 119.66 119.69 2k75 s GLN 41 Ca 0.05 -1.35 0.00 0.00 0.02 0.00 0.00 55.36 54.09 2k75 s GLN 41 Cb -0.12 -0.90 0.00 0.00 1.00 0.00 0.00 33.01 32.99 2k75 s GLN 41 CO 0.01 0.16 0.00 0.41 -2.12 0.00 0.00 175.29 173.75 2k75 n GLY 42 N 0.22 0.87 3.33 3.09 0.00 -0.98 0.00 105.19 111.73 2k75 n GLY 42 Ca -0.13 -0.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.72 2.28 -0.03 1.61 1.51 -0.61 -1.41 117.35 117.98 2k75 s TYR 43 Ca 0.00 -0.41 0.02 0.00 -1.01 0.00 0.00 57.07 55.67 2k75 s TYR 43 Cb 0.00 -1.38 0.01 0.00 -0.11 0.00 0.00 41.96 40.48 2k75 s TYR 43 CO 0.00 0.10 -0.09 -1.50 -1.11 0.00 0.00 175.55 172.95 2k75 s ILE 44 N -0.78 0.82 0.04 2.71 2.07 -0.88 -1.06 121.20 124.12 2k75 s ILE 44 Ca 0.11 -0.36 -0.00 0.00 -1.41 0.00 0.00 60.65 58.99 2k75 s ILE 44 Cb -0.10 -0.74 -0.03 0.00 0.13 0.00 0.00 42.46 41.72 2k75 s ILE 44 CO 0.02 0.26 -0.04 -1.83 -1.91 0.00 0.00 174.94 171.44 2k75 s GLU 45 N 0.33 0.49 -0.30 3.50 -1.05 -0.99 -1.84 118.70 118.84 2k75 s GLU 45 Ca -0.06 -0.93 0.03 0.00 -0.15 0.00 0.00 54.97 53.86 2k75 s GLU 45 Cb -0.10 0.11 0.16 0.00 -0.44 0.00 0.00 34.13 33.86 2k75 s GLU 45 CO 0.01 -0.07 0.43 0.16 0.95 0.00 0.00 175.26 176.74 2k75 s ASP 46 N -2.21 0.19 0.00 0.83 -4.77 -1.09 -2.35 116.67 107.27 2k75 s ASP 46 Ca -0.04 -0.39 0.00 0.00 -3.30 0.00 0.00 52.55 48.83 2k75 s ASP 46 Cb -0.01 1.19 0.00 0.00 -1.09 0.00 0.00 42.92 43.01 2k75 s ASP 46 CO -0.05 -0.34 0.00 -0.90 0.70 0.00 0.00 175.17 174.58 2k75 n ASP 47 N 5.30 0.00 0.08 2.11 5.75 -1.26 -3.85 116.55 124.68 2k75 n ASP 47 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.80 2k75 n ASP 47 Cb 0.50 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.59 2k75 n ASP 47 CO 0.00 0.00 0.00 0.41 -0.11 0.00 0.00 177.20 177.50 2k75 n THR 48 N -0.65 0.00 -3.46 2.12 -1.04 -1.26 -5.14 114.28 104.85 2k75 n THR 48 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2k75 n THR 48 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 -2.84 0.00 -2.95 2.41 0.00 -1.25 -4.95 120.51 110.93 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 -1.38 0.36 0.02 0.00 1.70 -1.26 -2.68 118.95 115.71 2k75 s ARG 50 Ca 0.00 -0.64 -0.11 0.00 -0.47 0.00 0.00 55.73 54.51 2k75 s ARG 50 Cb 0.00 0.01 0.01 0.00 -0.57 0.00 0.00 34.95 34.40 2k75 s ARG 50 CO 0.00 -0.03 0.22 -1.50 -1.08 0.00 0.00 175.30 172.91 2k75 s ILE 51 N -1.44 0.09 0.41 4.99 2.07 -0.77 -4.97 121.20 121.58 2k75 s ILE 51 Ca -0.15 -0.74 -0.23 0.00 -1.41 0.00 0.00 60.65 58.12 2k75 s ILE 51 Cb -0.10 -0.75 -0.10 0.00 0.13 0.00 0.00 42.46 41.64 2k75 s ILE 51 CO -0.01 -0.41 1.00 -0.13 -1.91 0.00 0.00 174.94 173.48 2k75 s ARG 52 N -2.06 4.20 0.12 3.50 0.52 -1.26 -2.06 118.95 121.91 2k75 s ARG 52 Ca -0.09 1.33 0.04 0.00 -0.52 0.00 0.00 55.73 56.49 2k75 s ARG 52 Cb -0.03 -2.41 -0.04 0.00 0.52 0.00 0.00 34.95 32.99 2k75 s ARG 52 CO -0.01 -0.08 -0.10 0.96 0.02 0.00 0.00 175.30 176.09 2k75 s ILE 53 N -1.86 1.04 -0.12 1.52 -4.36 -0.50 -1.82 121.20 115.10 2k75 s ILE 53 Ca 0.59 -1.90 -0.06 0.00 -0.26 0.00 0.00 60.65 59.03 2k75 s ILE 53 Cb -0.16 -1.66 0.05 0.00 1.25 0.00 0.00 42.46 41.94 2k75 s ILE 53 CO 0.21 -0.69 0.27 -0.55 0.24 0.00 0.00 174.94 174.42 2k75 s SER 54 N -2.89 -0.15 -0.03 4.36 0.15 0.16 -2.31 113.70 112.99 2k75 s SER 54 Ca 0.12 0.58 0.06 0.00 0.70 0.00 0.00 55.95 57.41 2k75 s SER 54 Cb 0.01 0.52 -0.01 0.00 -1.71 0.00 0.00 66.02 64.82 2k75 s SER 54 CO -0.00 -0.19 -0.22 -0.94 1.20 0.00 0.00 173.24 173.09 2k75 s SER 55 N 1.54 2.62 -0.30 5.45 1.04 0.14 0.26 113.70 124.45 2k75 s SER 55 Ca -0.07 -0.41 -0.14 0.00 0.48 0.00 0.00 55.95 55.81 2k75 s SER 55 Cb -0.11 -0.41 -0.03 0.00 0.10 0.00 0.00 66.02 65.57 2k75 s SER 55 CO -0.09 0.25 0.30 -0.36 0.98 0.00 0.00 173.24 174.33 2k75 s PHE 56 N -0.40 3.23 0.00 5.02 0.08 -1.05 -0.28 117.98 124.58 2k75 s PHE 56 Ca 0.05 0.14 0.00 0.00 0.12 0.00 0.00 56.93 57.24 2k75 s PHE 56 Cb -0.10 -2.54 0.00 0.00 -0.57 0.00 0.00 43.02 39.82 2k75 s PHE 56 CO 0.00 -0.28 0.00 0.41 -0.10 0.00 0.00 175.22 175.25 2k75 n GLY 57 N 4.92 2.11 3.76 4.36 0.00 -0.91 -4.78 105.19 114.64 2k75 n GLY 57 Ca -0.11 0.00 -0.40 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 4.58 -0.05 1.61 1.02 -1.26 -5.04 119.74 120.60 2k75 s LYS 58 Ca 0.00 1.18 -0.10 0.00 0.02 0.00 0.00 55.97 57.07 2k75 s LYS 58 Cb 0.00 -3.30 -0.05 0.00 -0.52 0.00 0.00 37.83 33.96 2k75 s LYS 58 CO 0.00 0.45 0.28 -1.14 -0.92 0.00 0.00 175.35 174.02 2k75 s GLN 59 N -0.71 3.67 0.10 1.68 0.74 -1.26 -4.48 119.66 119.40 2k75 s GLN 59 Ca 0.38 0.12 0.05 0.00 0.05 0.00 0.00 55.36 55.97 2k75 s GLN 59 Cb -0.23 -3.18 -0.03 0.00 1.10 0.00 0.00 33.01 30.67 2k75 s GLN 59 CO 0.26 0.72 -0.14 -0.51 -0.55 0.00 0.00 175.29 175.07 2k75 s LEU 60 N -1.17 2.37 0.19 3.68 1.43 -1.26 -5.16 118.68 118.76 2k75 s LEU 60 Ca 0.21 -0.75 0.09 0.00 -1.03 0.00 0.00 54.13 52.64 2k75 s LEU 60 Cb -0.14 -0.51 -0.04 0.00 0.03 0.00 0.00 46.19 45.52 2k75 s LEU 60 CO 0.10 -0.14 -0.06 -1.10 0.23 0.00 0.00 176.35 175.38 2k75 s GLN 61 N -2.41 2.18 0.49 1.70 -0.21 -1.26 -4.99 119.66 115.17 2k75 s GLN 61 Ca 0.05 -1.25 -0.21 0.00 0.02 0.00 0.00 55.36 53.97 2k75 s GLN 61 Cb -0.06 -2.21 -0.07 0.00 1.00 0.00 0.00 33.01 31.67 2k75 s GLN 61 CO 0.02 0.43 1.13 -0.51 -2.12 0.00 0.00 175.29 174.24 2k75 s ASP 62 N -2.98 6.05 -1.30 5.90 1.01 -1.26 -3.05 116.67 121.03 2k75 s ASP 62 Ca 0.26 2.19 -0.04 0.00 0.71 0.00 0.00 52.55 55.67 2k75 s ASP 62 Cb -0.09 -2.59 0.03 0.00 1.01 0.00 0.00 42.92 41.28 2k75 s ASP 62 CO 0.17 -0.99 0.30 -1.20 0.21 0.00 0.00 175.17 173.65 2k75 n SER 63 N -0.85 -4.48 -4.54 0.27 7.64 0.66 -4.91 113.62 107.41 2k75 n SER 63 Ca 0.09 -0.12 -0.41 0.00 1.01 0.00 0.00 58.87 59.44 2k75 n SER 63 Cb 0.50 -3.72 -0.09 0.00 -1.01 0.00 0.00 64.21 59.89 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 -2.41 6.19 -0.30 6.43 2.15 -0.90 -4.79 116.67 123.04 2k75 s ASP 64 Ca 0.20 -0.28 -0.26 0.00 0.43 0.00 0.00 52.55 52.65 2k75 s ASP 64 Cb -0.10 -2.21 0.01 0.00 -0.30 0.00 0.00 42.92 40.32 2k75 s ASP 64 CO 0.25 -0.38 0.90 0.68 -0.17 0.00 0.00 175.17 176.44 2k75 s VAL 65 N 2.06 4.70 0.30 1.11 -7.23 -1.26 -2.18 120.40 117.90 2k75 s VAL 65 Ca 0.12 1.42 -0.05 0.00 -1.81 0.00 0.00 61.98 61.66 2k75 s VAL 65 Cb -0.17 -4.24 -0.00 0.00 0.56 0.00 0.00 36.38 32.53 2k75 s VAL 65 CO 0.12 -0.32 0.44 0.68 -0.31 0.00 0.00 175.10 175.72 2k75 s VAL 66 N 3.19 0.00 -0.07 1.32 -7.23 -1.02 -2.13 120.40 114.45 2k75 s VAL 66 Ca 0.37 -1.58 0.04 0.00 -1.81 0.00 0.00 61.98 59.01 2k75 s VAL 66 Cb -0.14 -2.51 -0.00 0.00 0.56 0.00 0.00 36.38 34.30 2k75 s VAL 66 CO 0.13 0.00 -0.21 -0.60 -0.31 0.00 0.00 175.10 174.11 2k75 s ARG 67 N -3.43 2.45 -0.20 4.82 3.52 0.30 -2.70 118.95 123.71 2k75 s ARG 67 Ca 0.29 -0.75 -0.06 0.00 -0.13 0.00 0.00 55.73 55.08 2k75 s ARG 67 Cb 0.00 -1.97 -0.03 0.00 -1.56 0.00 0.00 34.95 31.40 2k75 s ARG 67 CO 0.16 0.21 0.01 0.42 -0.81 0.00 0.00 175.30 175.30 2k75 s ILE 68 N 0.22 4.12 0.14 4.11 1.01 0.08 -1.37 121.20 129.50 2k75 s ILE 68 Ca -0.12 -0.26 0.07 0.00 0.00 0.00 0.00 60.65 60.34 2k75 s ILE 68 Cb -0.15 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.41 2k75 s ILE 68 CO 0.06 0.43 -0.03 -1.81 0.00 0.00 0.00 174.94 173.58 2k75 s ASP 69 N 0.93 4.69 -1.56 3.58 1.01 -0.37 -1.53 116.67 123.42 2k75 s ASP 69 Ca 0.02 -0.36 -0.05 0.00 0.71 0.00 0.00 52.55 52.87 2k75 s ASP 69 Cb -0.14 -0.99 0.01 0.00 1.01 0.00 0.00 42.92 42.81 2k75 s ASP 69 CO 0.02 0.13 0.62 0.59 0.21 0.00 0.00 175.17 176.74 2k75 n ASN 70 N 0.26 -6.09 -4.77 0.27 3.02 -1.25 -2.62 115.26 104.08 2k75 n ASN 70 Ca -0.11 -0.29 -0.39 0.00 -0.03 0.00 0.00 54.58 53.76 2k75 n ASN 70 Cb 0.54 -4.92 -0.00 0.00 -0.61 0.00 0.00 39.78 34.78 2k75 n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k75 s ALA 71 N -3.18 3.14 -0.27 5.41 0.00 -0.34 -4.61 121.76 121.91 2k75 s ALA 71 Ca 0.31 1.15 -0.08 0.00 0.00 0.00 0.00 51.96 53.34 2k75 s ALA 71 Cb -0.14 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.50 2k75 s ALA 71 CO 0.39 -0.81 0.10 0.50 0.00 0.00 0.00 175.76 175.93 2k75 s ARG 72 N -2.40 3.55 -0.06 0.00 3.52 -0.61 -2.41 118.95 120.54 2k75 s ARG 72 Ca 0.60 -0.56 -0.21 0.00 -0.13 0.00 0.00 55.73 55.43 2k75 s ARG 72 Cb -0.35 -3.40 -0.04 0.00 -1.56 0.00 0.00 34.95 29.59 2k75 s ARG 72 CO 0.44 -0.26 0.60 0.08 -0.81 0.00 0.00 175.30 175.35 2k75 s VAL 73 N 1.61 5.05 0.08 7.11 1.01 -0.98 0.25 120.40 134.55 2k75 s VAL 73 Ca 0.06 1.23 -0.16 0.00 0.00 0.00 0.00 61.98 63.11 2k75 s VAL 73 Cb -0.16 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.32 2k75 s VAL 73 CO 0.04 0.32 0.37 0.00 0.00 0.00 0.00 175.10 175.84 2k75 s ALA 74 N 0.46 -0.87 -0.23 5.51 0.00 -1.03 -4.81 121.76 120.78 2k75 s ALA 74 Ca 0.32 0.03 -0.10 0.00 0.00 0.00 0.00 51.96 52.21 2k75 s ALA 74 Cb -0.17 0.51 -0.05 0.00 0.00 0.00 0.00 23.12 23.41 2k75 s ALA 74 CO 0.15 -0.54 0.14 -1.14 0.00 0.00 0.00 175.76 174.38 2k75 s GLN 75 N -3.20 4.04 -0.10 0.00 0.74 -1.26 -2.10 119.66 117.78 2k75 s GLN 75 Ca -0.01 -0.29 0.02 0.00 0.05 0.00 0.00 55.36 55.14 2k75 s GLN 75 Cb 0.01 -3.49 -0.02 0.00 1.10 0.00 0.00 33.01 30.62 2k75 s GLN 75 CO -0.08 0.08 -0.16 -0.06 -0.55 0.00 0.00 175.29 174.52 2k75 s PHE 76 N 0.99 2.71 0.00 1.67 0.08 -0.42 -4.80 117.98 118.21 2k75 s PHE 76 Ca 0.07 -0.58 0.00 0.00 0.12 0.00 0.00 56.93 56.54 2k75 s PHE 76 Cb -0.13 -1.74 0.00 0.00 -0.57 0.00 0.00 43.02 40.57 2k75 s PHE 76 CO 0.04 -0.14 0.00 0.09 -0.10 0.00 0.00 175.22 175.11 2k75 n ASN 77 N 3.14 0.00 0.00 1.36 4.13 -1.26 -1.88 115.26 120.75 2k75 n ASN 77 Ca -0.18 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.08 2k75 n ASN 77 Cb 0.52 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.76 2k75 n ASN 77 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2k75 n GLY 78 N 0.00 0.00 3.18 7.41 0.00 -1.26 -5.16 105.19 109.37 2k75 n GLY 78 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2k75 n GLY 78 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2k75 s TYR 79 N 0.00 0.06 0.29 1.61 -0.85 -0.79 -5.15 117.35 112.52 2k75 s TYR 79 Ca 0.00 -0.31 -0.22 0.00 -0.52 0.00 0.00 57.07 56.03 2k75 s TYR 79 Cb 0.00 -0.03 -0.09 0.00 0.38 0.00 0.00 41.96 42.22 2k75 s TYR 79 CO 0.00 -0.45 0.83 -0.51 -1.52 0.00 0.00 175.55 173.90 2k75 s LEU 80 N -2.18 4.27 0.19 -3.49 1.43 -1.26 -1.30 118.68 116.34 2k75 s LEU 80 Ca -0.04 1.58 -0.20 0.00 -1.03 0.00 0.00 54.13 54.44 2k75 s LEU 80 Cb -0.00 -3.90 0.04 0.00 0.03 0.00 0.00 46.19 42.36 2k75 s LEU 80 CO -0.05 -0.07 0.58 -0.55 0.23 0.00 0.00 176.35 176.49 2k75 s SER 81 N -1.76 -0.36 -0.19 2.29 0.15 -0.89 -4.53 113.70 108.40 2k75 s SER 81 Ca 0.49 -0.33 -0.09 0.00 0.70 0.00 0.00 55.95 56.72 2k75 s SER 81 Cb -0.16 0.61 -0.05 0.00 -1.71 0.00 0.00 66.02 64.71 2k75 s SER 81 CO 0.21 -1.06 0.11 -0.76 1.20 0.00 0.00 173.24 172.93 2k75 s LEU 82 N -2.83 4.09 -0.21 3.45 1.43 -0.76 -2.47 118.68 121.38 2k75 s LEU 82 Ca 0.06 0.19 -0.05 0.00 -1.03 0.00 0.00 54.13 53.31 2k75 s LEU 82 Cb -0.02 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 2k75 s LEU 82 CO -0.05 0.18 -0.02 -0.44 0.23 0.00 0.00 176.35 176.26 2k75 s SER 83 N 0.33 4.61 -0.41 2.29 0.01 0.14 -0.66 113.70 120.00 2k75 s SER 83 Ca 0.07 -0.28 -0.16 0.00 1.31 0.00 0.00 55.95 56.88 2k75 s SER 83 Cb -0.11 -1.79 0.02 0.00 0.21 0.00 0.00 66.02 64.35 2k75 s SER 83 CO -0.01 0.03 0.36 -0.69 0.41 0.00 0.00 173.24 173.33 2k75 s VAL 84 N 1.22 5.19 0.36 3.43 1.01 0.14 -1.57 120.40 130.18 2k75 s VAL 84 Ca 0.03 -0.53 0.00 0.00 0.00 0.00 0.00 61.98 61.49 2k75 s VAL 84 Cb -0.15 -3.98 0.07 0.00 0.00 0.00 0.00 36.38 32.33 2k75 s VAL 84 CO 0.00 -0.36 0.49 0.61 0.00 0.00 0.00 175.10 175.85 2k75 n GLY 85 N 5.14 0.82 0.25 4.51 0.00 -1.26 -2.53 105.19 112.12 2k75 n GLY 85 Ca -0.09 -2.01 0.16 0.00 0.00 0.00 0.00 46.02 44.08 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 -0.27 0.00 0.68 1.61 3.32 -1.97 -2.36 116.42 117.43 2k75 h ASP 86 Ca -0.16 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.89 2k75 h ASP 86 Cb 0.61 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.16 2k75 h ASP 86 CO 0.18 0.00 -0.20 -1.20 -1.72 0.00 0.00 179.24 176.30 2k75 n SER 87 N -2.97 0.28 -4.87 6.45 7.64 -1.26 -4.87 113.62 114.03 2k75 n SER 87 Ca 0.01 -0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 2k75 n SER 87 Cb 0.32 -0.14 0.04 0.00 -1.01 0.00 0.00 64.21 63.41 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 5.66 -0.03 6.43 0.15 -0.89 -4.93 113.70 117.21 2k75 s SER 88 Ca 0.16 1.28 0.03 0.00 0.70 0.00 0.00 55.95 58.12 2k75 s SER 88 Cb 0.19 -2.17 -0.00 0.00 -1.71 0.00 0.00 66.02 62.33 2k75 s SER 88 CO 0.58 -1.22 -0.13 -0.60 1.20 0.00 0.00 173.24 173.07 2k75 s ARG 89 N -5.26 1.26 -0.12 5.44 3.52 -1.08 -4.94 118.95 117.77 2k75 s ARG 89 Ca 0.57 -0.44 0.01 0.00 -0.13 0.00 0.00 55.73 55.75 2k75 s ARG 89 Cb -0.11 -1.15 -0.01 0.00 -1.56 0.00 0.00 34.95 32.12 2k75 s ARG 89 CO 0.53 0.19 -0.16 0.42 -0.81 0.00 0.00 175.30 175.46 2k75 s ILE 90 N 0.05 2.76 -0.08 4.11 1.01 -1.26 -1.23 121.20 126.56 2k75 s ILE 90 Ca -0.02 -0.77 0.05 0.00 0.00 0.00 0.00 60.65 59.91 2k75 s ILE 90 Cb -0.09 -2.13 -0.00 0.00 0.01 0.00 0.00 42.46 40.25 2k75 s ILE 90 CO 0.01 0.54 -0.24 -0.70 0.00 0.00 0.00 174.94 174.55 2k75 s GLU 91 N 0.30 2.77 0.45 2.79 2.12 -0.47 -4.94 118.70 121.70 2k75 s GLU 91 Ca -0.12 -0.86 -0.22 0.00 0.36 0.00 0.00 54.97 54.12 2k75 s GLU 91 Cb -0.16 -2.19 -0.08 0.00 0.26 0.00 0.00 34.13 31.95 2k75 s GLU 91 CO 0.06 0.25 1.06 -1.12 -0.54 0.00 0.00 175.26 174.98 2k75 s SER 92 N 0.15 6.48 -0.08 -1.70 0.01 -1.26 -0.54 113.70 116.76 2k75 s SER 92 Ca -0.12 2.03 0.05 0.00 1.31 0.00 0.00 55.95 59.21 2k75 s SER 92 Cb -0.16 -2.58 -0.00 0.00 0.21 0.00 0.00 66.02 63.49 2k75 s SER 92 CO 0.07 -0.69 -0.23 -0.69 0.41 0.00 0.00 173.24 172.11 2k75 s VAL 93 N -1.78 1.97 0.18 3.43 1.01 -0.91 -4.86 120.40 119.44 2k75 s VAL 93 Ca 0.63 -0.99 -0.14 0.00 0.00 0.00 0.00 61.98 61.49 2k75 s VAL 93 Cb -0.20 -1.69 -0.07 0.00 0.00 0.00 0.00 36.38 34.42 2k75 s VAL 93 CO 0.25 0.54 0.57 0.54 0.00 0.00 0.00 175.10 177.00 2k75 s ASN 94 N 0.18 6.79 0.00 3.32 2.20 -1.26 -4.77 114.94 121.39 2k75 s ASN 94 Ca -0.13 1.07 0.00 0.00 -0.94 0.00 0.00 52.86 52.86 2k75 s ASN 94 Cb -0.16 -2.29 0.00 0.00 -2.00 0.00 0.00 41.25 36.80 2k75 s ASN 94 CO 0.07 0.05 0.00 0.52 -2.94 0.00 0.00 177.10 174.79 2k75 n VAL 95 N 0.54 0.00 -3.27 3.54 0.31 -1.26 -4.97 118.33 113.21 2k75 n VAL 95 Ca -0.03 0.15 -0.05 0.00 -0.01 0.00 0.00 64.34 64.40 2k75 n VAL 95 Cb 0.52 -0.57 -0.05 0.00 -0.91 0.00 0.00 33.84 32.83 2k75 n VAL 95 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 2k75 s ASN 96 N -1.65 -0.28 -0.56 4.52 0.02 -1.26 -5.00 114.94 110.72 2k75 s ASN 96 Ca 0.00 0.17 -0.25 0.00 -1.02 0.00 0.00 52.86 51.76 2k75 s ASN 96 Cb 0.00 1.44 0.04 0.00 0.02 0.00 0.00 41.25 42.75 2k75 s ASN 96 CO 0.00 -0.31 0.65 -0.38 0.02 0.00 0.00 177.10 177.08 2k75 n ILE 97 N 5.38 -4.50 -1.74 0.60 5.41 -1.26 -4.84 119.36 118.42 2k75 n ILE 97 Ca -0.01 0.10 -0.39 0.00 1.00 0.00 0.00 62.75 63.45 2k75 n ILE 97 Cb 0.51 -3.77 0.03 0.00 -0.71 0.00 0.00 39.64 35.70 2k75 n ILE 97 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2k75 n PRO 98 N -0.93 1.86 -0.18 0.38 -0.02 -1.26 -4.92 135.00 129.92 2k75 n PRO 98 Ca -0.14 0.67 -0.08 0.00 -2.02 0.00 0.00 63.50 61.94 2k75 n PRO 98 Cb 0.67 -2.54 0.02 0.00 -0.02 0.00 0.00 33.50 31.62 2k75 n PRO 98 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2k75 h LEU 99 N 1.74 0.72 -9.73 2.45 6.46 -2.06 -3.42 115.31 111.46 2k75 h LEU 99 Ca -0.50 -0.16 -0.55 0.00 -0.12 0.00 0.00 57.88 56.55 2k75 h LEU 99 Cb 1.30 -0.19 0.09 0.00 -0.73 0.00 0.00 40.66 41.13 2k75 h LEU 99 CO 0.58 0.68 0.78 -0.62 -0.62 0.00 0.00 178.44 179.24 2k75 n GLU 100 N -4.54 2.47 -4.36 1.25 -0.58 -1.26 -4.97 120.64 108.64 2k75 n GLU 100 Ca 0.02 0.88 -0.34 0.00 -0.42 0.00 0.00 57.16 57.30 2k75 n GLU 100 Cb 0.15 -2.61 -0.10 0.00 -0.57 0.00 0.00 31.44 28.30 2k75 n GLU 100 CO 0.00 0.00 0.00 -1.01 -0.48 0.00 0.00 177.13 175.64 2k75 s HIS 101 N -0.10 3.11 0.00 -0.32 3.76 -1.26 -5.05 115.29 115.43 2k75 s HIS 101 Ca 0.65 0.00 0.00 0.00 -0.15 0.00 0.00 55.06 55.56 2k75 s HIS 101 Cb -0.55 -1.88 0.00 0.00 1.11 0.00 0.00 32.58 31.27 2k75 s HIS 101 CO 0.50 0.25 0.70 0.72 -0.85 0.00 0.00 174.74 176.06 2k75 n HIS 102 N 2.79 0.00 -1.43 1.40 8.25 -1.26 -4.76 115.22 120.20 2k75 n HIS 102 Ca -0.18 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.16 2k75 n HIS 102 Cb 0.53 -0.20 -0.05 0.00 1.12 0.00 0.00 29.99 31.39 2k75 n HIS 102 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k75 n HIS 103 N -1.19 -0.48 0.00 4.41 8.25 -1.26 -4.58 115.22 120.37 2k75 n HIS 103 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2k75 n HIS 103 Cb 0.00 -2.50 0.00 0.00 1.12 0.00 0.00 29.99 28.61 2k75 n HIS 103 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k75 n HIS 104 N -1.93 0.00 -0.33 4.41 8.25 -1.26 -1.21 115.22 123.15 2k75 n HIS 104 Ca -0.13 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 2k75 n HIS 104 Cb 0.42 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.53 2k75 n HIS 104 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k75 n HIS 105 N 2.13 0.00 1.61 4.41 -0.00 -1.26 -5.19 115.22 116.92 2k75 n HIS 105 Ca 0.00 -0.06 0.14 0.00 -0.00 0.00 0.00 57.72 57.81 2k75 n HIS 105 Cb 0.00 -0.01 0.62 0.00 -0.00 0.00 0.00 29.99 30.60 2k75 n HIS 105 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06