#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 5.85 0.08 6.43 -1.08 -1.26 -3.70 116.67 123.00 2k75 s ASP 2 Ca 0.00 1.93 -0.31 0.00 -0.52 0.00 0.00 52.55 53.65 2k75 s ASP 2 Cb 0.00 -2.55 -0.07 0.00 -1.46 0.00 0.00 42.92 38.84 2k75 s ASP 2 CO 0.00 -1.12 1.39 -0.22 0.52 0.00 0.00 175.17 175.74 2k75 s LEU 3 N -4.14 4.36 0.12 -1.34 2.96 -1.26 -1.93 118.68 117.44 2k75 s LEU 3 Ca 0.67 2.27 -0.00 0.00 -0.22 0.00 0.00 54.13 56.84 2k75 s LEU 3 Cb -0.18 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 2k75 s LEU 3 CO 0.31 -0.67 0.02 0.68 -1.32 0.00 0.00 176.35 175.37 2k75 s VAL 4 N 1.46 0.26 0.62 1.68 -7.23 -1.04 -4.92 120.40 111.22 2k75 s VAL 4 Ca 0.65 -1.90 -0.14 0.00 -1.81 0.00 0.00 61.98 58.78 2k75 s VAL 4 Cb -0.35 -1.91 -0.03 0.00 0.56 0.00 0.00 36.38 34.65 2k75 s VAL 4 CO 0.29 -0.62 1.05 -0.54 -0.31 0.00 0.00 175.10 174.97 2k75 s LYS 5 N -3.98 3.27 0.15 4.82 3.01 -1.26 -4.74 119.74 121.00 2k75 s LYS 5 Ca 0.19 1.08 -0.15 0.00 -1.01 0.00 0.00 55.97 56.08 2k75 s LYS 5 Cb 0.07 -2.03 0.02 0.00 -1.01 0.00 0.00 37.83 34.88 2k75 s LYS 5 CO -0.01 -0.84 1.72 0.82 0.51 0.00 0.00 175.35 177.55 2k75 h ILE 6 N 0.07 1.19 0.00 2.17 1.08 -1.94 -1.81 117.51 118.27 2k75 h ILE 6 Ca -0.46 -0.56 -0.01 0.00 -0.39 0.00 0.00 64.86 63.45 2k75 h ILE 6 Cb 1.21 0.71 -0.00 0.00 -3.07 0.00 0.00 36.82 35.67 2k75 h ILE 6 CO 0.58 0.21 -0.04 0.03 -0.69 0.00 0.00 178.15 178.24 2k75 h ARG 7 N 0.60 0.00 -0.00 2.37 3.08 -1.94 -1.68 114.38 116.80 2k75 h ARG 7 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 2k75 h ARG 7 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 2k75 h ARG 7 CO -0.02 0.04 -0.05 -3.47 -1.07 0.00 0.00 179.97 175.40 2k75 n ASP 8 N -3.18 0.31 -4.71 7.04 2.03 -0.70 -4.83 116.55 112.51 2k75 n ASP 8 Ca -0.00 -0.59 -0.42 0.00 0.52 0.00 0.00 54.79 54.30 2k75 n ASP 8 Cb 0.29 -0.11 -0.03 0.00 -0.72 0.00 0.00 41.12 40.54 2k75 n ASP 8 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2k75 s VAL 9 N -2.39 3.48 0.11 5.18 1.01 -0.64 -4.90 120.40 122.26 2k75 s VAL 9 Ca 0.33 1.03 -0.25 0.00 0.00 0.00 0.00 61.98 63.08 2k75 s VAL 9 Cb 0.21 -3.66 0.07 0.00 0.00 0.00 0.00 36.38 33.00 2k75 s VAL 9 CO 0.44 0.06 0.77 -0.44 0.00 0.00 0.00 175.10 175.94 2k75 s SER 10 N 1.29 -0.40 0.00 3.32 0.01 -1.26 -4.99 113.70 111.67 2k75 s SER 10 Ca 0.64 -0.13 0.07 0.00 1.31 0.00 0.00 55.95 57.84 2k75 s SER 10 Cb -0.35 0.52 0.40 0.00 0.21 0.00 0.00 66.02 66.80 2k75 s SER 10 CO 0.29 -0.88 0.97 0.18 0.41 0.00 0.00 173.24 174.21 2k75 n LEU 11 N -0.35 0.00 0.09 2.44 4.77 -1.26 -2.47 117.00 120.21 2k75 n LEU 11 Ca -0.11 0.12 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 2k75 n LEU 11 Cb 0.62 -0.12 0.47 0.00 -2.33 0.00 0.00 43.42 42.07 2k75 n LEU 11 CO 0.12 -0.09 1.08 0.77 -1.33 0.00 0.00 177.39 177.94 2k75 h SER 12 N 0.00 0.30 -4.03 -1.43 4.64 -1.95 -3.42 113.55 107.67 2k75 h SER 12 Ca 0.00 -0.02 -0.69 0.00 -0.47 0.00 0.00 61.79 60.61 2k75 h SER 12 Cb 0.03 -0.08 -0.23 0.00 -0.31 0.00 0.00 62.40 61.81 2k75 h SER 12 CO 0.00 0.27 -0.82 0.42 -0.87 0.00 0.00 176.83 175.83 2k75 s THR 13 N -5.21 2.64 -0.05 2.95 -4.23 -1.03 -5.07 115.64 105.64 2k75 s THR 13 Ca -0.07 -1.25 -0.09 0.00 -1.18 0.00 0.00 61.69 59.10 2k75 s THR 13 Cb 0.17 -2.10 -0.05 0.00 1.34 0.00 0.00 72.50 71.86 2k75 s THR 13 CO 0.72 0.33 0.42 1.55 -0.54 0.00 0.00 174.62 177.10 2k75 h PRO 14 N 4.55 -0.32 -6.16 3.99 0.13 -1.87 -3.44 132.00 128.88 2k75 h PRO 14 Ca -0.48 0.02 -0.69 0.00 -0.87 0.00 0.00 66.00 63.98 2k75 h PRO 14 Cb 1.15 0.07 -0.31 0.00 0.13 0.00 0.00 31.00 32.05 2k75 h PRO 14 CO 0.46 -0.21 -0.88 0.71 -0.23 0.00 0.00 178.00 177.85 2k75 s TYR 15 N -2.63 2.42 0.11 1.56 2.02 -1.26 -2.43 117.35 117.15 2k75 s TYR 15 Ca -0.05 -0.64 -0.02 0.00 -0.37 0.00 0.00 57.07 56.00 2k75 s TYR 15 Cb 0.00 -1.58 -0.04 0.00 -0.40 0.00 0.00 41.96 39.95 2k75 s TYR 15 CO 0.14 -0.16 0.05 0.14 -1.57 0.00 0.00 175.55 174.15 2k75 s VAL 16 N -0.28 0.13 0.05 0.71 -7.23 -0.85 -2.00 120.40 110.92 2k75 s VAL 16 Ca 0.00 -1.85 0.09 0.00 -1.81 0.00 0.00 61.98 58.41 2k75 s VAL 16 Cb -0.13 -1.90 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 2k75 s VAL 16 CO 0.02 -0.58 -0.24 -0.44 -0.31 0.00 0.00 175.10 173.55 2k75 s SER 17 N -3.01 3.35 0.07 4.85 0.01 -0.82 -1.64 113.70 116.52 2k75 s SER 17 Ca 0.19 -0.56 0.00 0.00 1.31 0.00 0.00 55.95 56.89 2k75 s SER 17 Cb 0.07 -0.37 -0.04 0.00 0.21 0.00 0.00 66.02 65.89 2k75 s SER 17 CO -0.01 0.25 -0.04 0.68 0.41 0.00 0.00 173.24 174.53 2k75 s VAL 18 N -0.86 0.41 -0.03 3.43 -7.23 -0.92 -2.50 120.40 112.70 2k75 s VAL 18 Ca 0.13 -1.87 0.00 0.00 -1.81 0.00 0.00 61.98 58.43 2k75 s VAL 18 Cb -0.10 -1.61 0.03 0.00 0.56 0.00 0.00 36.38 35.25 2k75 s VAL 18 CO 0.03 -0.92 0.01 -0.51 -0.31 0.00 0.00 175.10 173.40 2k75 s ILE 19 N -3.80 0.13 -1.11 -0.62 2.07 -1.26 -1.29 121.20 115.31 2k75 s ILE 19 Ca 0.10 0.11 0.00 0.00 -1.41 0.00 0.00 60.65 59.45 2k75 s ILE 19 Cb 0.07 -0.23 0.00 0.00 0.13 0.00 0.00 42.46 42.43 2k75 s ILE 19 CO -0.07 0.13 0.00 0.61 -1.91 0.00 0.00 174.94 173.70 2k75 n GLY 20 N 4.10 -0.62 3.19 1.50 0.00 -1.03 -4.73 105.19 107.61 2k75 n GLY 20 Ca -0.27 -0.58 -0.26 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.44 1.65 -0.09 1.61 -2.85 -1.07 -1.11 119.74 117.44 2k75 s LYS 21 Ca 0.00 -0.69 -0.17 0.00 -1.00 0.00 0.00 55.97 54.10 2k75 s LYS 21 Cb 0.00 -1.56 -0.05 0.00 -2.06 0.00 0.00 37.83 34.16 2k75 s LYS 21 CO 0.00 0.39 0.46 0.42 0.10 0.00 0.00 175.35 176.72 2k75 s ILE 22 N -0.37 5.14 0.03 3.79 1.09 -1.05 -2.40 121.20 127.44 2k75 s ILE 22 Ca 0.05 0.92 0.07 0.00 -1.10 0.00 0.00 60.65 60.59 2k75 s ILE 22 Cb -0.08 -3.79 -0.02 0.00 -1.06 0.00 0.00 42.46 37.50 2k75 s ILE 22 CO -0.00 0.38 -0.19 -0.89 -0.10 0.00 0.00 174.94 174.14 2k75 s THR 23 N 0.24 1.53 -0.13 2.92 2.01 0.14 -0.05 115.64 122.30 2k75 s THR 23 Ca 0.25 -1.07 -0.05 0.00 0.31 0.00 0.00 61.69 61.13 2k75 s THR 23 Cb -0.15 -1.32 0.02 0.00 0.01 0.00 0.00 72.50 71.05 2k75 s THR 23 CO 0.11 0.22 0.10 0.61 -0.69 0.00 0.00 174.62 174.97 2k75 n GLY 24 N 2.04 -4.12 3.68 4.40 0.00 -1.26 -2.09 105.19 107.83 2k75 n GLY 24 Ca -0.17 0.67 -0.38 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.54 5.22 -0.05 -0.61 -1.09 -1.26 -4.02 121.20 118.85 2k75 s ILE 25 Ca -0.12 0.65 0.05 0.00 -2.23 0.00 0.00 60.65 59.00 2k75 s ILE 25 Cb 0.01 -3.70 -0.00 0.00 -1.58 0.00 0.00 42.46 37.18 2k75 s ILE 25 CO 0.45 0.28 -0.20 -1.00 -1.23 0.00 0.00 174.94 173.23 2k75 s HIS 26 N 1.18 2.04 -0.14 3.97 3.76 0.29 -4.99 115.29 121.40 2k75 s HIS 26 Ca 0.18 -0.63 -0.03 0.00 -0.15 0.00 0.00 55.06 54.43 2k75 s HIS 26 Cb -0.14 -1.36 -0.03 0.00 1.11 0.00 0.00 32.58 32.15 2k75 s HIS 26 CO 0.07 -0.21 -0.02 0.21 -0.85 0.00 0.00 174.74 173.93 2k75 s LYS 27 N 0.03 3.48 0.05 1.40 2.20 -1.26 -0.65 119.74 124.98 2k75 s LYS 27 Ca -0.06 -0.49 -0.02 0.00 -0.36 0.00 0.00 55.97 55.05 2k75 s LYS 27 Cb -0.13 -2.88 -0.03 0.00 -1.51 0.00 0.00 37.83 33.27 2k75 s LYS 27 CO 0.03 0.38 -0.01 0.15 -0.36 0.00 0.00 175.35 175.55 2k75 s LYS 28 N 0.00 0.58 0.05 4.03 1.02 -0.52 -5.00 119.74 119.90 2k75 s LYS 28 Ca 0.01 -1.08 0.09 0.00 0.02 0.00 0.00 55.97 55.01 2k75 s LYS 28 Cb -0.13 0.21 -0.03 0.00 -0.52 0.00 0.00 37.83 37.36 2k75 s LYS 28 CO 0.02 -0.12 -0.26 -1.21 -0.92 0.00 0.00 175.35 172.87 2k75 s GLU 29 N -3.49 1.72 0.06 1.68 2.02 -1.26 -0.16 118.70 119.27 2k75 s GLU 29 Ca 0.03 -1.12 -0.03 0.00 0.02 0.00 0.00 54.97 53.87 2k75 s GLU 29 Cb 0.05 -1.93 -0.03 0.00 0.10 0.00 0.00 34.13 32.32 2k75 s GLU 29 CO -0.08 0.49 0.02 1.52 0.02 0.00 0.00 175.26 177.23 2k75 s TYR 30 N -0.84 0.42 -0.14 1.61 1.13 -0.97 -4.98 117.35 113.58 2k75 s TYR 30 Ca 0.12 -0.92 -0.13 0.00 -1.41 0.00 0.00 57.07 54.72 2k75 s TYR 30 Cb -0.10 -0.30 -0.05 0.00 -1.10 0.00 0.00 41.96 40.41 2k75 s TYR 30 CO 0.02 -0.41 0.27 -2.00 -2.51 0.00 0.00 175.55 170.93 2k75 s GLU 31 N -3.76 4.12 -0.24 -3.49 -6.30 -1.26 -1.95 118.70 105.82 2k75 s GLU 31 Ca 0.05 0.07 -0.25 0.00 -2.50 0.00 0.00 54.97 52.35 2k75 s GLU 31 Cb 0.06 -3.38 0.07 0.00 0.00 0.00 0.00 34.13 30.88 2k75 s GLU 31 CO -0.10 0.35 0.69 0.45 0.02 0.00 0.00 175.26 176.67 2k75 s SER 32 N 0.12 -0.71 -1.46 -1.70 0.15 0.88 -4.90 113.70 106.07 2k75 s SER 32 Ca 0.16 1.31 0.00 0.00 0.70 0.00 0.00 55.95 58.12 2k75 s SER 32 Cb -0.13 1.31 0.00 0.00 -1.71 0.00 0.00 66.02 65.49 2k75 s SER 32 CO 0.04 -0.28 0.00 0.47 1.20 0.00 0.00 173.24 174.67 2k75 n ASP 33 N 2.51 -4.79 -0.25 5.45 8.00 -1.26 0.17 116.55 126.38 2k75 n ASP 33 Ca -0.14 0.14 -0.03 0.00 0.71 0.00 0.00 54.79 55.47 2k75 n ASP 33 Cb 0.55 -4.07 -0.01 0.00 -0.02 0.00 0.00 41.12 37.57 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 -0.81 0.61 3.12 0.44 0.00 -1.26 -4.99 105.19 102.29 2k75 n GLY 34 Ca -0.19 -0.34 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.94 0.62 -0.22 2.61 -4.23 0.13 -5.13 115.64 107.47 2k75 s THR 35 Ca 0.00 -1.51 -0.12 0.00 -1.18 0.00 0.00 61.69 58.87 2k75 s THR 35 Cb 0.00 -1.16 -0.05 0.00 1.34 0.00 0.00 72.50 72.64 2k75 s THR 35 CO 0.00 -0.63 0.23 -0.89 -0.54 0.00 0.00 174.62 172.79 2k75 s THR 36 N -2.52 5.32 0.01 3.99 2.01 -1.26 -0.09 115.64 123.11 2k75 s THR 36 Ca 0.01 0.35 0.06 0.00 0.31 0.00 0.00 61.69 62.42 2k75 s THR 36 Cb -0.02 -3.57 -0.02 0.00 0.01 0.00 0.00 72.50 68.90 2k75 s THR 36 CO -0.02 0.34 -0.19 -0.54 -0.69 0.00 0.00 174.62 173.52 2k75 s LYS 37 N 0.97 1.43 0.28 4.92 1.02 -0.82 -4.97 119.74 122.56 2k75 s LYS 37 Ca 0.11 -0.77 -0.19 0.00 0.02 0.00 0.00 55.97 55.14 2k75 s LYS 37 Cb -0.13 -1.44 -0.09 0.00 -0.52 0.00 0.00 37.83 35.65 2k75 s LYS 37 CO 0.04 0.38 0.77 -1.54 -0.92 0.00 0.00 175.35 174.09 2k75 s SER 38 N -0.74 7.01 -0.02 2.83 1.04 -1.26 -2.30 113.70 120.26 2k75 s SER 38 Ca 0.07 1.45 0.02 0.00 0.48 0.00 0.00 55.95 57.98 2k75 s SER 38 Cb -0.08 -2.44 0.00 0.00 0.10 0.00 0.00 66.02 63.61 2k75 s SER 38 CO 0.00 -0.07 -0.08 0.54 0.98 0.00 0.00 173.24 174.61 2k75 s VAL 39 N -1.71 0.65 -0.18 5.02 0.11 0.78 -2.23 120.40 122.84 2k75 s VAL 39 Ca 0.48 -0.31 -0.08 0.00 -2.93 0.00 0.00 61.98 59.14 2k75 s VAL 39 Cb -0.15 -0.58 -0.04 0.00 -1.53 0.00 0.00 36.38 34.08 2k75 s VAL 39 CO 0.20 0.20 0.09 -0.31 -3.33 0.00 0.00 175.10 171.96 2k75 s TYR 40 N 0.11 3.34 0.16 1.54 1.51 0.99 -1.44 117.35 123.56 2k75 s TYR 40 Ca -0.01 0.22 0.08 0.00 -1.01 0.00 0.00 57.07 56.35 2k75 s TYR 40 Cb -0.07 -2.09 -0.04 0.00 -0.11 0.00 0.00 41.96 39.65 2k75 s TYR 40 CO 0.00 0.27 -0.17 -0.65 -1.11 0.00 0.00 175.55 173.89 2k75 s GLN 41 N 0.20 1.22 0.00 -0.62 -0.21 0.17 -0.30 119.66 120.11 2k75 s GLN 41 Ca 0.06 -1.37 0.00 0.00 0.02 0.00 0.00 55.36 54.07 2k75 s GLN 41 Cb -0.12 -1.22 0.00 0.00 1.00 0.00 0.00 33.01 32.67 2k75 s GLN 41 CO -0.00 0.24 0.00 0.41 -2.12 0.00 0.00 175.29 173.82 2k75 n GLY 42 N 0.33 0.68 3.32 3.09 0.00 -0.99 -0.55 105.19 111.06 2k75 n GLY 42 Ca -0.14 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.54 2.34 -0.07 1.61 1.51 -0.89 -1.52 117.35 117.80 2k75 s TYR 43 Ca 0.00 -0.43 0.05 0.00 -1.01 0.00 0.00 57.07 55.68 2k75 s TYR 43 Cb 0.00 -1.50 -0.00 0.00 -0.11 0.00 0.00 41.96 40.35 2k75 s TYR 43 CO 0.00 -0.02 -0.21 -1.50 -1.11 0.00 0.00 175.55 172.71 2k75 s ILE 44 N -0.63 1.76 0.09 2.71 2.07 -0.79 0.25 121.20 126.66 2k75 s ILE 44 Ca 0.10 -0.88 0.03 0.00 -1.41 0.00 0.00 60.65 58.49 2k75 s ILE 44 Cb -0.10 -1.52 -0.04 0.00 0.13 0.00 0.00 42.46 40.94 2k75 s ILE 44 CO -0.01 0.50 -0.09 -1.83 -1.91 0.00 0.00 174.94 171.60 2k75 s GLU 45 N 0.13 0.80 -0.33 3.50 -1.05 -1.01 -1.73 118.70 119.02 2k75 s GLU 45 Ca -0.09 -1.17 -0.02 0.00 -0.15 0.00 0.00 54.97 53.54 2k75 s GLU 45 Cb -0.15 -0.39 0.19 0.00 -0.44 0.00 0.00 34.13 33.34 2k75 s GLU 45 CO 0.05 0.04 0.84 0.16 0.95 0.00 0.00 175.26 177.30 2k75 s ASP 46 N -2.54 -0.95 0.00 0.83 1.47 -1.00 -2.59 116.67 111.89 2k75 s ASP 46 Ca 0.06 -0.16 0.00 0.00 1.18 0.00 0.00 52.55 53.63 2k75 s ASP 46 Cb -0.01 1.41 0.00 0.00 -0.34 0.00 0.00 42.92 43.98 2k75 s ASP 46 CO -0.01 -0.14 0.00 -0.67 0.68 0.00 0.00 175.17 175.02 2k75 n ASP 47 N 4.69 0.00 0.00 2.11 -0.08 -1.26 -3.96 116.55 118.05 2k75 n ASP 47 Ca 0.08 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.36 2k75 n ASP 47 Cb 0.58 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.04 2k75 n ASP 47 CO 0.00 0.00 0.00 0.35 0.12 0.00 0.00 177.20 177.67 2k75 n THR 48 N 0.00 0.00 -0.40 5.18 -2.24 -1.26 -4.94 114.28 110.62 2k75 n THR 48 Ca 0.00 0.89 0.00 0.00 -2.27 0.00 0.00 64.05 62.67 2k75 n THR 48 Cb 0.00 -1.35 0.00 0.00 -2.10 0.00 0.00 70.33 66.88 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 -1.13 0.00 -3.00 6.98 0.00 -1.25 -4.99 120.51 117.11 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 -0.10 0.00 0.00 0.00 0.00 19.45 19.35 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 3.90 0.44 0.05 0.00 1.70 -1.26 -2.38 118.95 121.39 2k75 s ARG 50 Ca 0.00 -0.53 -0.09 0.00 -0.47 0.00 0.00 55.73 54.64 2k75 s ARG 50 Cb 0.00 0.17 0.00 0.00 -0.57 0.00 0.00 34.95 34.55 2k75 s ARG 50 CO 0.00 -0.10 0.19 -1.50 -1.08 0.00 0.00 175.30 172.81 2k75 s ILE 51 N -1.59 0.12 0.41 4.99 2.07 -0.70 -4.97 121.20 121.52 2k75 s ILE 51 Ca -0.14 -0.99 -0.23 0.00 -1.41 0.00 0.00 60.65 57.88 2k75 s ILE 51 Cb -0.08 -1.03 -0.09 0.00 0.13 0.00 0.00 42.46 41.39 2k75 s ILE 51 CO -0.00 -0.55 1.01 -0.13 -1.91 0.00 0.00 174.94 173.37 2k75 s ARG 52 N -2.93 4.17 0.07 3.50 0.52 -1.25 -1.88 118.95 121.15 2k75 s ARG 52 Ca -0.02 1.39 0.02 0.00 -0.52 0.00 0.00 55.73 56.60 2k75 s ARG 52 Cb 0.01 -2.43 -0.03 0.00 0.52 0.00 0.00 34.95 33.01 2k75 s ARG 52 CO -0.06 -0.12 -0.08 0.96 0.02 0.00 0.00 175.30 176.02 2k75 s ILE 53 N -1.80 0.70 -0.05 1.52 -4.36 -0.57 -1.92 121.20 114.71 2k75 s ILE 53 Ca 0.59 -1.50 -0.03 0.00 -0.26 0.00 0.00 60.65 59.46 2k75 s ILE 53 Cb -0.18 -1.15 0.03 0.00 1.25 0.00 0.00 42.46 42.41 2k75 s ILE 53 CO 0.23 -0.58 0.13 -0.55 0.24 0.00 0.00 174.94 174.41 2k75 s SER 54 N -2.26 -0.10 -0.03 4.36 0.15 0.10 -2.34 113.70 113.57 2k75 s SER 54 Ca 0.01 0.26 0.03 0.00 0.70 0.00 0.00 55.95 56.95 2k75 s SER 54 Cb -0.03 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.47 2k75 s SER 54 CO -0.01 -0.11 -0.10 -0.94 1.20 0.00 0.00 173.24 173.27 2k75 s SER 55 N 0.79 1.39 -0.24 5.45 1.04 0.59 0.27 113.70 122.98 2k75 s SER 55 Ca -0.06 -0.22 -0.16 0.00 0.48 0.00 0.00 55.95 56.00 2k75 s SER 55 Cb -0.08 -0.39 -0.04 0.00 0.10 0.00 0.00 66.02 65.61 2k75 s SER 55 CO -0.04 0.07 0.40 -0.36 0.98 0.00 0.00 173.24 174.30 2k75 s PHE 56 N 0.21 3.30 0.00 5.02 0.08 -1.06 -0.01 117.98 125.53 2k75 s PHE 56 Ca -0.04 0.52 0.00 0.00 0.12 0.00 0.00 56.93 57.53 2k75 s PHE 56 Cb -0.10 -2.56 0.00 0.00 -0.57 0.00 0.00 43.02 39.79 2k75 s PHE 56 CO 0.01 -0.14 0.00 0.41 -0.10 0.00 0.00 175.22 175.40 2k75 n GLY 57 N 4.32 1.45 3.74 4.36 0.00 -0.95 -4.77 105.19 113.34 2k75 n GLY 57 Ca -0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 4.57 0.10 1.61 1.02 -1.26 -5.02 119.74 120.76 2k75 s LYS 58 Ca 0.00 1.80 -0.08 0.00 0.02 0.00 0.00 55.97 57.71 2k75 s LYS 58 Cb 0.00 -3.24 -0.06 0.00 -0.52 0.00 0.00 37.83 34.02 2k75 s LYS 58 CO 0.00 0.06 0.39 -1.14 -0.92 0.00 0.00 175.35 173.74 2k75 s GLN 59 N -0.66 3.70 0.10 1.68 2.00 -1.26 -4.57 119.66 120.65 2k75 s GLN 59 Ca 0.49 0.08 0.06 0.00 -2.00 0.00 0.00 55.36 53.98 2k75 s GLN 59 Cb -0.31 -2.94 -0.03 0.00 0.80 0.00 0.00 33.01 30.53 2k75 s GLN 59 CO 0.38 0.52 -0.15 -0.51 -0.50 0.00 0.00 175.29 175.03 2k75 s LEU 60 N -2.19 2.35 -0.03 3.68 1.43 -1.26 -5.15 118.68 117.50 2k75 s LEU 60 Ca 0.36 -0.73 0.06 0.00 -1.03 0.00 0.00 54.13 52.79 2k75 s LEU 60 Cb -0.13 -0.57 -0.01 0.00 0.03 0.00 0.00 46.19 45.51 2k75 s LEU 60 CO 0.20 -0.10 -0.22 -1.10 0.23 0.00 0.00 176.35 175.36 2k75 s GLN 61 N -2.25 1.99 0.25 1.70 -0.21 -1.26 -4.97 119.66 114.91 2k75 s GLN 61 Ca 0.04 -0.78 -0.30 0.00 0.02 0.00 0.00 55.36 54.35 2k75 s GLN 61 Cb -0.07 -1.80 -0.10 0.00 1.00 0.00 0.00 33.01 32.03 2k75 s GLN 61 CO 0.03 0.40 1.46 0.34 -2.12 0.00 0.00 175.29 175.40 2k75 s ASP 62 N -0.29 6.62 0.00 5.90 -1.08 -1.26 -2.12 116.67 124.44 2k75 s ASP 62 Ca 0.02 2.69 0.00 0.00 -0.52 0.00 0.00 52.55 54.75 2k75 s ASP 62 Cb -0.11 -2.62 0.00 0.00 -1.46 0.00 0.00 42.92 38.73 2k75 s ASP 62 CO 0.01 -0.73 0.00 -1.54 0.52 0.00 0.00 175.17 173.43 2k75 n SER 63 N 2.43 -2.67 -4.67 -0.34 3.41 0.93 -4.98 113.62 107.72 2k75 n SER 63 Ca 0.07 0.00 -0.41 0.00 -0.26 0.00 0.00 58.87 58.27 2k75 n SER 63 Cb 0.40 -0.66 -0.04 0.00 -0.26 0.00 0.00 64.21 63.65 2k75 n SER 63 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 2k75 s ASP 64 N -2.17 6.96 -0.31 4.04 -4.77 -0.90 -4.85 116.67 114.67 2k75 s ASP 64 Ca 0.00 1.18 -0.23 0.00 -3.30 0.00 0.00 52.55 50.20 2k75 s ASP 64 Cb 0.00 -2.45 0.00 0.00 -1.09 0.00 0.00 42.92 39.38 2k75 s ASP 64 CO 0.00 -0.38 0.78 -0.69 0.70 0.00 0.00 175.17 175.57 2k75 s VAL 65 N 2.06 4.79 0.11 2.11 1.01 -1.26 -2.52 120.40 126.71 2k75 s VAL 65 Ca 0.38 1.11 -0.04 0.00 0.00 0.00 0.00 61.98 63.44 2k75 s VAL 65 Cb -0.17 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 2k75 s VAL 65 CO 0.13 -0.27 0.10 0.68 0.00 0.00 0.00 175.10 175.74 2k75 s VAL 66 N 2.95 0.13 -0.11 2.92 -7.23 -0.27 -2.11 120.40 116.68 2k75 s VAL 66 Ca 0.32 -1.68 0.03 0.00 -1.81 0.00 0.00 61.98 58.84 2k75 s VAL 66 Cb -0.14 -1.77 0.00 0.00 0.56 0.00 0.00 36.38 35.03 2k75 s VAL 66 CO 0.13 -0.59 -0.22 -0.60 -0.31 0.00 0.00 175.10 173.50 2k75 s ARG 67 N -3.97 3.08 -0.17 4.82 3.52 -0.57 -2.45 118.95 123.21 2k75 s ARG 67 Ca 0.16 -0.85 -0.06 0.00 -0.13 0.00 0.00 55.73 54.85 2k75 s ARG 67 Cb 0.06 -2.37 -0.03 0.00 -1.56 0.00 0.00 34.95 31.05 2k75 s ARG 67 CO -0.03 0.14 0.02 0.42 -0.81 0.00 0.00 175.30 175.04 2k75 s ILE 68 N 0.44 4.36 0.01 4.11 1.01 -0.41 -1.29 121.20 129.42 2k75 s ILE 68 Ca -0.16 -0.19 0.06 0.00 0.00 0.00 0.00 60.65 60.36 2k75 s ILE 68 Cb -0.17 -2.95 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 2k75 s ILE 68 CO 0.07 0.47 -0.15 -1.81 0.00 0.00 0.00 174.94 173.51 2k75 s ASP 69 N 0.42 3.98 -1.30 3.58 1.01 -0.10 -2.16 116.67 122.11 2k75 s ASP 69 Ca -0.00 -0.32 -0.06 0.00 0.71 0.00 0.00 52.55 52.88 2k75 s ASP 69 Cb -0.13 -0.75 0.01 0.00 1.01 0.00 0.00 42.92 43.06 2k75 s ASP 69 CO 0.02 0.29 0.84 -3.20 0.21 0.00 0.00 175.17 173.32 2k75 n ASN 70 N 1.77 -5.83 -4.78 0.27 5.15 -1.25 -2.57 115.26 108.02 2k75 n ASN 70 Ca -0.16 -0.38 -0.37 0.00 -0.60 0.00 0.00 54.58 53.06 2k75 n ASN 70 Cb 0.52 -4.54 -0.03 0.00 -0.53 0.00 0.00 39.78 35.20 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 -3.21 3.07 -0.13 5.20 0.00 -0.65 -4.68 121.76 121.35 2k75 s ALA 71 Ca 0.42 0.81 -0.13 0.00 0.00 0.00 0.00 51.96 53.05 2k75 s ALA 71 Cb -0.18 -3.32 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 2k75 s ALA 71 CO 0.52 -0.38 0.30 0.50 0.00 0.00 0.00 175.76 176.69 2k75 s ARG 72 N -2.50 4.14 0.00 0.00 3.52 -0.57 -2.02 118.95 121.52 2k75 s ARG 72 Ca 0.59 0.12 -0.27 0.00 -0.13 0.00 0.00 55.73 56.05 2k75 s ARG 72 Cb -0.25 -3.38 -0.04 0.00 -1.56 0.00 0.00 34.95 29.72 2k75 s ARG 72 CO 0.31 0.35 0.84 0.08 -0.81 0.00 0.00 175.30 176.07 2k75 s VAL 73 N 0.13 4.85 0.03 7.11 1.01 -1.02 -0.12 120.40 132.38 2k75 s VAL 73 Ca 0.18 1.77 -0.05 0.00 0.00 0.00 0.00 61.98 63.87 2k75 s VAL 73 Cb -0.13 -4.19 -0.01 0.00 0.00 0.00 0.00 36.38 32.05 2k75 s VAL 73 CO 0.05 0.26 0.09 0.00 0.00 0.00 0.00 175.10 175.50 2k75 s ALA 74 N 0.57 -0.07 -0.20 5.51 0.00 -0.39 -4.92 121.76 122.25 2k75 s ALA 74 Ca 0.44 -0.52 0.01 0.00 0.00 0.00 0.00 51.96 51.89 2k75 s ALA 74 Cb -0.20 0.23 0.03 0.00 0.00 0.00 0.00 23.12 23.18 2k75 s ALA 74 CO 0.24 -0.30 -0.17 -1.14 0.00 0.00 0.00 175.76 174.38 2k75 s GLN 75 N -2.47 2.80 -0.09 0.00 0.74 -1.26 -0.77 119.66 118.61 2k75 s GLN 75 Ca -0.06 -0.96 0.04 0.00 0.05 0.00 0.00 55.36 54.43 2k75 s GLN 75 Cb -0.02 -2.67 -0.00 0.00 1.10 0.00 0.00 33.01 31.42 2k75 s GLN 75 CO -0.04 -0.30 -0.24 -0.06 -0.55 0.00 0.00 175.29 174.10 2k75 s PHE 76 N 1.25 2.53 -1.70 1.67 0.08 0.33 -4.65 117.98 117.49 2k75 s PHE 76 Ca 0.01 -0.95 0.00 0.00 0.12 0.00 0.00 56.93 56.12 2k75 s PHE 76 Cb -0.15 -1.68 0.00 0.00 -0.57 0.00 0.00 43.02 40.62 2k75 s PHE 76 CO -0.11 -0.36 0.00 -1.71 -0.10 0.00 0.00 175.22 172.95 2k75 n ASN 77 N 3.36 -4.83 0.00 1.36 5.15 -1.26 0.15 115.26 119.19 2k75 n ASN 77 Ca -0.19 0.27 0.00 0.00 -0.60 0.00 0.00 54.58 54.07 2k75 n ASN 77 Cb 0.53 -4.21 0.00 0.00 -0.53 0.00 0.00 39.78 35.57 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 -0.59 0.57 3.43 8.20 0.00 -1.26 -5.03 105.19 110.51 2k75 n GLY 78 Ca -0.19 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.46 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 -2.00 2.67 0.29 1.61 2.02 0.12 -5.10 117.35 116.96 2k75 s TYR 79 Ca 0.00 -0.29 -0.28 0.00 -0.37 0.00 0.00 57.07 56.13 2k75 s TYR 79 Cb 0.00 -1.65 -0.09 0.00 -0.40 0.00 0.00 41.96 39.82 2k75 s TYR 79 CO 0.00 0.08 1.02 -0.51 -1.57 0.00 0.00 175.55 174.57 2k75 s LEU 80 N -0.52 4.48 0.11 -1.29 2.01 -1.26 -0.51 118.68 121.70 2k75 s LEU 80 Ca 0.07 2.08 -0.16 0.00 0.01 0.00 0.00 54.13 56.12 2k75 s LEU 80 Cb -0.12 -3.77 0.03 0.00 0.01 0.00 0.00 46.19 42.35 2k75 s LEU 80 CO 0.01 -0.10 0.40 -0.94 1.01 0.00 0.00 176.35 176.73 2k75 s SER 81 N -1.19 -0.24 -0.19 2.29 1.04 0.05 -3.95 113.70 111.51 2k75 s SER 81 Ca 0.46 -0.27 -0.05 0.00 0.48 0.00 0.00 55.95 56.57 2k75 s SER 81 Cb -0.27 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.29 2k75 s SER 81 CO 0.34 -0.82 -0.01 -0.76 0.98 0.00 0.00 173.24 172.96 2k75 s LEU 82 N -2.69 3.27 -0.24 2.42 1.43 -0.81 -1.27 118.68 120.79 2k75 s LEU 82 Ca 0.02 -0.17 -0.10 0.00 -1.03 0.00 0.00 54.13 52.85 2k75 s LEU 82 Cb 0.02 -1.82 -0.05 0.00 0.03 0.00 0.00 46.19 44.37 2k75 s LEU 82 CO -0.11 0.10 0.14 -0.44 0.23 0.00 0.00 176.35 176.27 2k75 s SER 83 N 0.79 5.87 -0.39 2.29 0.01 0.83 -0.73 113.70 122.38 2k75 s SER 83 Ca -0.00 0.03 -0.14 0.00 1.31 0.00 0.00 55.95 57.15 2k75 s SER 83 Cb -0.14 -2.06 0.01 0.00 0.21 0.00 0.00 66.02 64.04 2k75 s SER 83 CO 0.02 0.03 0.27 -0.69 0.41 0.00 0.00 173.24 173.28 2k75 s VAL 84 N 1.24 5.11 0.61 3.43 1.01 0.14 -1.51 120.40 130.43 2k75 s VAL 84 Ca 0.07 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.47 2k75 s VAL 84 Cb -0.14 -3.79 0.11 0.00 0.00 0.00 0.00 36.38 32.56 2k75 s VAL 84 CO 0.06 -0.22 0.83 0.61 0.00 0.00 0.00 175.10 176.38 2k75 n GLY 85 N 5.11 1.14 0.24 4.51 0.00 -1.26 -2.55 105.19 112.39 2k75 n GLY 85 Ca -0.12 -2.09 0.16 0.00 0.00 0.00 0.00 46.02 43.97 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 -0.31 0.00 0.46 1.61 3.32 -1.98 -1.74 116.42 117.79 2k75 h ASP 86 Ca -0.28 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.77 2k75 h ASP 86 Cb 1.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.66 2k75 h ASP 86 CO 0.33 0.00 -0.29 -1.54 -1.72 0.00 0.00 179.24 176.02 2k75 n SER 87 N -2.83 0.57 -4.90 6.45 3.41 -1.26 -4.88 113.62 110.18 2k75 n SER 87 Ca 0.00 -0.40 -0.28 0.00 -0.26 0.00 0.00 58.87 57.94 2k75 n SER 87 Cb 0.24 0.06 0.04 0.00 -0.26 0.00 0.00 64.21 64.28 2k75 n SER 87 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2k75 s SER 88 N -2.75 5.49 -0.02 4.04 0.15 -0.66 -4.99 113.70 114.97 2k75 s SER 88 Ca 0.19 0.87 0.04 0.00 0.70 0.00 0.00 55.95 57.75 2k75 s SER 88 Cb 0.19 -1.77 -0.01 0.00 -1.71 0.00 0.00 66.02 62.72 2k75 s SER 88 CO 0.58 -1.20 -0.15 -0.13 1.20 0.00 0.00 173.24 173.54 2k75 s ARG 89 N -5.15 1.25 -0.09 5.44 0.52 -1.06 -4.93 118.95 114.93 2k75 s ARG 89 Ca 0.56 -0.52 0.04 0.00 -0.52 0.00 0.00 55.73 55.28 2k75 s ARG 89 Cb -0.11 -1.19 0.00 0.00 0.52 0.00 0.00 34.95 34.18 2k75 s ARG 89 CO 0.48 0.30 -0.21 0.42 0.02 0.00 0.00 175.30 176.31 2k75 s ILE 90 N -0.28 1.83 -0.16 1.52 1.01 -1.26 -0.92 121.20 122.95 2k75 s ILE 90 Ca 0.04 -0.89 -0.00 0.00 0.00 0.00 0.00 60.65 59.80 2k75 s ILE 90 Cb -0.06 -1.59 -0.00 0.00 0.01 0.00 0.00 42.46 40.81 2k75 s ILE 90 CO -0.00 0.51 -0.14 -1.61 0.00 0.00 0.00 174.94 173.70 2k75 s GLU 91 N 0.37 3.25 0.41 2.79 8.01 -0.41 -4.95 118.70 128.17 2k75 s GLU 91 Ca -0.17 -0.73 -0.25 0.00 0.01 0.00 0.00 54.97 53.84 2k75 s GLU 91 Cb -0.17 -2.66 -0.08 0.00 -4.31 0.00 0.00 34.13 26.91 2k75 s GLU 91 CO 0.07 0.02 1.14 -1.54 0.01 0.00 0.00 175.26 174.97 2k75 s SER 92 N 0.81 6.51 -0.10 -0.19 1.04 -1.26 -1.51 113.70 119.00 2k75 s SER 92 Ca -0.05 2.28 0.04 0.00 0.48 0.00 0.00 55.95 58.69 2k75 s SER 92 Cb -0.15 -2.61 -0.00 0.00 0.10 0.00 0.00 66.02 63.36 2k75 s SER 92 CO 0.00 -0.68 -0.23 -0.69 0.98 0.00 0.00 173.24 172.62 2k75 s VAL 93 N -1.48 2.18 0.02 5.02 1.01 -0.90 -4.91 120.40 121.34 2k75 s VAL 93 Ca 0.58 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.58 2k75 s VAL 93 Cb -0.29 -1.84 0.00 0.00 0.00 0.00 0.00 36.38 34.26 2k75 s VAL 93 CO 0.36 0.56 0.00 0.59 0.00 0.00 0.00 175.10 176.60 2k75 n ASN 94 N 3.43 0.03 -3.94 3.32 5.03 -1.26 -4.69 115.26 117.18 2k75 n ASN 94 Ca -0.19 0.03 -0.29 0.00 0.87 0.00 0.00 54.58 55.00 2k75 n ASN 94 Cb 0.53 0.01 -0.16 0.00 -1.02 0.00 0.00 39.78 39.14 2k75 n ASN 94 CO 0.00 0.00 0.00 0.68 -1.83 0.00 0.00 177.26 176.11 2k75 s VAL 95 N -1.09 1.34 0.53 2.41 -7.23 -1.26 -5.12 120.40 109.97 2k75 s VAL 95 Ca 0.00 -0.75 -0.16 0.00 -1.81 0.00 0.00 61.98 59.25 2k75 s VAL 95 Cb 0.00 -1.45 -0.07 0.00 0.56 0.00 0.00 36.38 35.42 2k75 s VAL 95 CO 0.00 0.18 0.99 0.21 -0.31 0.00 0.00 175.10 176.17 2k75 s ASN 96 N 1.54 6.54 -0.41 4.85 3.84 -1.26 -5.04 114.94 125.00 2k75 s ASN 96 Ca 0.01 1.58 0.05 0.00 0.21 0.00 0.00 52.86 54.71 2k75 s ASN 96 Cb -0.15 -2.51 0.19 0.00 -0.55 0.00 0.00 41.25 38.23 2k75 s ASN 96 CO -0.08 -0.64 0.38 -0.38 -2.79 0.00 0.00 177.10 173.59 2k75 n ILE 97 N -1.66 -1.08 -1.74 -5.21 5.41 -1.26 -5.13 119.36 108.69 2k75 n ILE 97 Ca 0.07 -3.57 -0.39 0.00 1.00 0.00 0.00 62.75 59.86 2k75 n ILE 97 Cb 0.54 -1.73 0.03 0.00 -0.71 0.00 0.00 39.64 37.78 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 2.50 1.83 -2.77 0.38 -0.02 -1.26 -4.28 135.00 131.38 2k75 n PRO 98 Ca 0.28 0.67 -0.02 0.00 -2.02 0.00 0.00 63.50 62.40 2k75 n PRO 98 Cb 0.49 -2.55 -0.02 0.00 -0.02 0.00 0.00 33.50 31.40 2k75 n PRO 98 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2k75 n LEU 99 N -0.64 -6.65 -3.02 2.45 0.00 -1.26 -5.03 117.00 102.85 2k75 n LEU 99 Ca 0.09 1.57 -0.05 0.00 0.00 0.00 0.00 56.01 57.62 2k75 n LEU 99 Cb 0.43 -2.99 -0.01 0.00 0.00 0.00 0.00 43.42 40.85 2k75 n LEU 99 CO 0.55 -3.27 0.05 -0.70 0.00 0.00 0.00 177.39 174.02 2k75 s GLU 100 N -1.12 0.94 0.36 1.96 2.12 -1.26 -5.10 118.70 116.59 2k75 s GLU 100 Ca -0.10 -0.86 0.00 0.00 0.36 0.00 0.00 54.97 54.37 2k75 s GLU 100 Cb 0.01 -0.17 0.00 0.00 0.26 0.00 0.00 34.13 34.22 2k75 s GLU 100 CO 0.64 -1.27 0.00 0.72 -0.54 0.00 0.00 175.26 174.80 2k75 n HIS 101 N 3.56 -4.71 -3.93 5.30 8.25 -1.26 -5.07 115.22 117.36 2k75 n HIS 101 Ca 0.16 2.49 -0.09 0.00 -0.26 0.00 0.00 57.72 60.01 2k75 n HIS 101 Cb 0.55 -3.56 -0.06 0.00 1.12 0.00 0.00 29.99 28.04 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 -1.83 0.30 0.10 4.41 -3.43 -1.26 -5.05 115.29 108.52 2k75 s HIS 102 Ca 0.00 -0.65 -0.20 0.00 -0.80 0.00 0.00 55.06 53.41 2k75 s HIS 102 Cb 0.00 0.11 -0.08 0.00 -1.43 0.00 0.00 32.58 31.18 2k75 s HIS 102 CO 0.00 -0.85 1.65 1.12 -2.00 0.00 0.00 174.74 174.66 2k75 h HIS 103 N 2.37 0.32 0.00 0.38 2.07 -2.09 -3.44 115.15 114.76 2k75 h HIS 103 Ca -0.29 -0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.21 2k75 h HIS 103 Cb 1.24 -0.10 0.00 0.00 2.57 0.00 0.00 27.41 31.13 2k75 h HIS 103 CO 0.39 0.34 0.00 1.58 -3.07 0.00 0.00 177.93 177.16 2k75 n HIS 104 N -4.83 0.00 -2.95 6.12 -0.00 -1.26 -4.88 115.22 107.41 2k75 n HIS 104 Ca -0.04 0.00 -0.38 0.00 -0.00 0.00 0.00 57.72 57.30 2k75 n HIS 104 Cb 0.11 -1.42 -0.06 0.00 -0.00 0.00 0.00 29.99 28.62 2k75 n HIS 104 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2k75 s HIS 105 N -0.71 3.83 0.00 1.57 3.76 -1.26 -5.34 115.29 117.14 2k75 s HIS 105 Ca 0.00 1.63 0.00 0.00 -0.15 0.00 0.00 55.06 56.54 2k75 s HIS 105 Cb 0.00 -2.78 0.00 0.00 1.11 0.00 0.00 32.58 30.91 2k75 s HIS 105 CO 0.00 0.42 0.00 1.58 -0.85 0.00 0.00 174.74 175.89