#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k8i s LYS 2 N 0.00 1.79 -0.01 3.17 -2.85 -1.26 -4.61 119.74 115.97 2k8i s LYS 2 Ca 0.00 -1.99 -0.30 0.00 -1.00 0.00 0.00 55.97 52.68 2k8i s LYS 2 Cb 0.00 -1.30 -0.03 0.00 -2.06 0.00 0.00 37.83 34.44 2k8i s LYS 2 CO 0.00 -0.08 1.01 0.54 0.10 0.00 0.00 175.35 176.92 2k8i s VAL 3 N -2.96 4.76 0.09 1.79 0.11 -1.08 -4.93 120.40 118.18 2k8i s VAL 3 Ca 0.35 1.98 -0.00 0.00 -2.93 0.00 0.00 61.98 61.38 2k8i s VAL 3 Cb 0.08 -4.27 0.00 0.00 -1.53 0.00 0.00 36.38 30.66 2k8i s VAL 3 CO 0.16 0.13 0.12 0.00 -3.33 0.00 0.00 175.10 172.18 2k8i n ALA 4 N 4.12 -0.08 -1.10 1.54 0.00 -1.26 -3.69 120.51 120.03 2k8i n ALA 4 Ca 0.07 -0.40 -0.31 0.00 0.00 0.00 0.00 53.44 52.80 2k8i n ALA 4 Cb 0.50 0.33 0.12 0.00 0.00 0.00 0.00 19.45 20.40 2k8i n ALA 4 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2k8i s LYS 5 N -2.20 1.69 0.00 0.00 2.20 -1.26 -2.96 119.74 117.21 2k8i s LYS 5 Ca 0.07 1.17 0.00 0.00 -0.36 0.00 0.00 55.97 56.86 2k8i s LYS 5 Cb -0.00 -1.83 0.00 0.00 -1.51 0.00 0.00 37.83 34.49 2k8i s LYS 5 CO 0.05 -2.04 0.00 -0.40 -0.36 0.00 0.00 175.35 172.60 2k8i n ASP 6 N -3.79 -1.52 -4.45 1.43 5.75 -0.69 -4.89 116.55 108.38 2k8i n ASP 6 Ca 0.09 0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.44 2k8i n ASP 6 Cb 0.53 -1.26 -0.08 0.00 -1.03 0.00 0.00 41.12 39.28 2k8i n ASP 6 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2k8i s LEU 7 N 0.00 5.09 0.45 -2.12 1.43 -1.16 -3.11 118.68 119.27 2k8i s LEU 7 Ca 0.00 -0.90 -0.24 0.00 -1.03 0.00 0.00 54.13 51.96 2k8i s LEU 7 Cb 0.00 -2.31 -0.09 0.00 0.03 0.00 0.00 46.19 43.82 2k8i s LEU 7 CO 0.00 -0.62 1.16 0.55 0.23 0.00 0.00 176.35 177.67 2k8i n VAL 8 N 5.37 2.75 -3.74 -1.59 3.14 -0.25 -3.27 118.33 120.75 2k8i n VAL 8 Ca -0.09 -0.50 -0.13 0.00 -2.96 0.00 0.00 64.34 60.66 2k8i n VAL 8 Cb 0.46 -1.40 -0.10 0.00 -1.06 0.00 0.00 33.84 31.74 2k8i n VAL 8 CO 0.00 0.00 0.00 -0.69 -6.46 0.00 0.00 176.83 169.68 2k8i s VAL 9 N -1.26 -0.00 0.10 1.55 1.01 -0.99 -0.73 120.40 120.07 2k8i s VAL 9 Ca 0.64 0.01 0.09 0.00 0.00 0.00 0.00 61.98 62.72 2k8i s VAL 9 Cb -0.51 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2k8i s VAL 9 CO 0.56 0.00 -0.22 -0.44 0.00 0.00 0.00 175.10 175.00 2k8i s SER 10 N 0.28 3.63 0.00 3.32 0.01 -0.01 -2.92 113.70 118.02 2k8i s SER 10 Ca -0.01 -0.59 -0.28 0.00 1.31 0.00 0.00 55.95 56.39 2k8i s SER 10 Cb -0.03 -0.44 0.10 0.00 0.21 0.00 0.00 66.02 65.86 2k8i s SER 10 CO -0.00 0.21 0.84 -1.48 0.41 0.00 0.00 173.24 173.21 2k8i s LEU 11 N -1.86 -0.42 -0.23 2.44 -0.00 -0.96 -1.07 118.68 116.58 2k8i s LEU 11 Ca 0.15 0.10 0.02 0.00 -0.00 0.00 0.00 54.13 54.40 2k8i s LEU 11 Cb -0.10 2.14 0.05 0.00 -0.00 0.00 0.00 46.19 48.28 2k8i s LEU 11 CO 0.07 -0.65 -0.11 0.00 -0.00 0.00 0.00 176.35 175.67 2k8i s ALA 12 N -2.83 2.25 0.16 1.48 0.00 0.17 0.12 121.76 123.12 2k8i s ALA 12 Ca 0.02 -1.45 0.09 0.00 0.00 0.00 0.00 51.96 50.62 2k8i s ALA 12 Cb -0.01 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.65 2k8i s ALA 12 CO -0.07 -0.98 -0.20 1.52 0.00 0.00 0.00 175.76 176.03 2k8i s TYR 13 N 1.27 1.93 -0.15 0.00 1.13 -0.54 -0.34 117.35 120.65 2k8i s TYR 13 Ca -0.04 -0.43 0.00 0.00 -1.41 0.00 0.00 57.07 55.18 2k8i s TYR 13 Cb -0.18 -0.98 0.03 0.00 -1.10 0.00 0.00 41.96 39.73 2k8i s TYR 13 CO -0.07 0.35 -0.12 -1.14 -2.51 0.00 0.00 175.55 172.06 2k8i s GLN 14 N -2.63 2.12 -0.29 -3.49 0.74 -0.32 0.52 119.66 116.30 2k8i s GLN 14 Ca 0.16 -0.57 -0.11 0.00 0.05 0.00 0.00 55.36 54.89 2k8i s GLN 14 Cb -0.07 -2.09 -0.04 0.00 1.10 0.00 0.00 33.01 31.91 2k8i s GLN 14 CO 0.07 -0.28 0.18 0.54 -0.55 0.00 0.00 175.29 175.24 2k8i s VAL 15 N 1.51 5.09 0.08 1.34 0.11 -0.48 -0.68 120.40 127.37 2k8i s VAL 15 Ca 0.04 0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.12 2k8i s VAL 15 Cb -0.13 -3.46 -0.04 0.00 -1.53 0.00 0.00 36.38 31.22 2k8i s VAL 15 CO -0.10 0.21 -0.07 -0.60 -3.33 0.00 0.00 175.10 171.21 2k8i s ARG 16 N 1.72 0.76 0.84 1.54 3.52 0.95 -1.89 118.95 126.39 2k8i s ARG 16 Ca 0.07 -1.18 -0.12 0.00 -0.13 0.00 0.00 55.73 54.37 2k8i s ARG 16 Cb -0.16 -0.25 0.10 0.00 -1.56 0.00 0.00 34.95 33.08 2k8i s ARG 16 CO 0.09 0.01 1.16 0.95 -0.81 0.00 0.00 175.30 176.70 2k8i s THR 17 N -2.97 2.03 0.37 4.11 -4.23 -0.37 0.10 115.64 114.68 2k8i s THR 17 Ca 0.06 0.01 0.38 0.00 -1.18 0.00 0.00 61.69 60.96 2k8i s THR 17 Cb 0.01 -2.93 0.41 0.00 1.34 0.00 0.00 72.50 71.34 2k8i s THR 17 CO -0.03 -0.01 2.16 -0.33 -0.54 0.00 0.00 174.62 175.87 2k8i h GLU 18 N -1.19 0.00 0.00 3.99 5.08 -1.91 -2.42 114.58 118.13 2k8i h GLU 18 Ca -0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.89 2k8i h GLU 18 Cb 1.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.58 2k8i h GLU 18 CO 0.65 0.01 -0.82 -0.25 -1.00 0.00 0.00 179.01 177.60 2k8i n ASP 19 N -3.11 0.72 0.00 1.42 8.00 -1.26 -4.97 116.55 117.35 2k8i n ASP 19 Ca -0.01 0.10 0.00 0.00 0.71 0.00 0.00 54.79 55.59 2k8i n ASP 19 Cb 0.20 0.38 0.00 0.00 -0.02 0.00 0.00 41.12 41.68 2k8i n ASP 19 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2k8i n GLY 20 N 1.30 1.83 3.67 0.44 0.00 -0.91 -4.80 105.19 106.73 2k8i n GLY 20 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2k8i n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8i s VAL 21 N -2.00 4.55 -0.15 1.61 0.11 -1.26 -4.89 120.40 118.36 2k8i s VAL 21 Ca 0.00 -0.14 -0.19 0.00 -2.93 0.00 0.00 61.98 58.71 2k8i s VAL 21 Cb 0.00 -2.97 -0.04 0.00 -1.53 0.00 0.00 36.38 31.85 2k8i s VAL 21 CO 0.00 0.56 0.55 -0.22 -3.33 0.00 0.00 175.10 172.65 2k8i s LEU 22 N -0.41 4.23 -0.20 2.54 2.96 -1.26 -1.23 118.68 125.30 2k8i s LEU 22 Ca 0.09 0.84 0.07 0.00 -0.22 0.00 0.00 54.13 54.91 2k8i s LEU 22 Cb -0.12 -2.79 -0.17 0.00 0.50 0.00 0.00 46.19 43.61 2k8i s LEU 22 CO 0.02 -0.11 -0.09 1.33 -1.32 0.00 0.00 176.35 176.18 2k8i n VAL 23 N 4.09 1.24 -3.82 1.68 0.24 -0.79 -5.02 118.33 115.95 2k8i n VAL 23 Ca -0.05 -0.59 -0.06 0.00 -2.04 0.00 0.00 64.34 61.61 2k8i n VAL 23 Cb 0.51 -0.98 -0.02 0.00 -1.47 0.00 0.00 33.84 31.88 2k8i n VAL 23 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2k8i s ASP 24 N -5.73 -0.24 -0.29 -1.34 -1.08 -1.16 -5.06 116.67 101.78 2k8i s ASP 24 Ca -0.21 -0.53 -0.16 0.00 -0.52 0.00 0.00 52.55 51.13 2k8i s ASP 24 Cb 0.07 0.65 0.12 0.00 -1.46 0.00 0.00 42.92 42.29 2k8i s ASP 24 CO 0.59 -1.20 0.85 -0.70 0.52 0.00 0.00 175.17 175.24 2k8i s GLU 25 N -3.71 0.52 -0.46 4.34 2.12 -1.26 -1.38 118.70 118.86 2k8i s GLU 25 Ca 0.11 0.90 -0.16 0.00 0.36 0.00 0.00 54.97 56.18 2k8i s GLU 25 Cb -0.04 0.11 0.06 0.00 0.26 0.00 0.00 34.13 34.52 2k8i s GLU 25 CO 0.05 -0.11 0.40 -1.12 -0.54 0.00 0.00 175.26 173.94 2k8i s SER 26 N 1.48 6.15 0.88 -1.70 0.01 0.18 -4.99 113.70 115.71 2k8i s SER 26 Ca -0.09 -1.21 -0.11 0.00 1.31 0.00 0.00 55.95 55.85 2k8i s SER 26 Cb -0.04 -2.19 0.12 0.00 0.21 0.00 0.00 66.02 64.12 2k8i s SER 26 CO -0.17 -0.63 1.09 -2.16 0.41 0.00 0.00 173.24 171.78 2k8i s PRO 27 N 1.74 1.40 0.26 12.44 0.04 -1.22 -1.47 135.00 148.20 2k8i s PRO 27 Ca 0.05 1.00 0.24 0.00 0.04 0.00 0.00 61.00 62.33 2k8i s PRO 27 Cb -0.23 -1.81 0.98 0.00 0.04 0.00 0.00 34.50 33.48 2k8i s PRO 27 CO 0.08 -2.19 1.72 1.33 0.04 0.00 0.00 177.00 177.98 2k8i n VAL 28 N -3.87 0.81 0.07 -0.36 0.24 -1.26 -2.21 118.33 111.75 2k8i n VAL 28 Ca 0.08 0.21 -0.08 0.00 -2.04 0.00 0.00 64.34 62.51 2k8i n VAL 28 Cb 0.54 -1.14 -0.10 0.00 -1.47 0.00 0.00 33.84 31.67 2k8i n VAL 28 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 2k8i h SER 29 N 0.00 0.05 -2.84 -1.34 4.64 -2.01 -3.42 113.55 108.63 2k8i h SER 29 Ca 0.00 -0.05 -0.34 0.00 -0.47 0.00 0.00 61.79 60.93 2k8i h SER 29 Cb 0.38 -0.02 -0.37 0.00 -0.31 0.00 0.00 62.40 62.09 2k8i h SER 29 CO 0.00 1.02 -0.65 0.00 -0.87 0.00 0.00 176.83 176.32 2k8i s ALA 30 N -2.77 -0.09 0.79 5.18 0.00 -0.94 -5.16 121.76 118.77 2k8i s ALA 30 Ca 0.00 0.26 -0.11 0.00 0.00 0.00 0.00 51.96 52.10 2k8i s ALA 30 Cb 0.10 -1.08 0.07 0.00 0.00 0.00 0.00 23.12 22.21 2k8i s ALA 30 CO 0.82 -0.96 1.10 -2.14 0.00 0.00 0.00 175.76 174.58 2k8i s PRO 31 N 2.28 2.14 0.26 0.00 0.02 -1.23 -3.41 135.00 135.06 2k8i s PRO 31 Ca 0.04 0.63 -0.30 0.00 0.02 0.00 0.00 61.00 61.40 2k8i s PRO 31 Cb -0.14 -1.93 -0.09 0.00 0.02 0.00 0.00 34.50 32.36 2k8i s PRO 31 CO -0.09 -1.58 1.12 -1.17 -0.33 0.00 0.00 177.00 174.95 2k8i s LEU 32 N -5.75 4.53 -0.16 -5.54 0.20 0.33 -4.87 118.68 107.42 2k8i s LEU 32 Ca 0.61 2.27 0.01 0.00 0.69 0.00 0.00 54.13 57.70 2k8i s LEU 32 Cb -0.14 -3.62 0.02 0.00 -0.43 0.00 0.00 46.19 42.02 2k8i s LEU 32 CO 0.54 -0.19 -0.17 -1.81 -0.29 0.00 0.00 176.35 174.42 2k8i s ASP 33 N -0.67 2.90 0.25 3.68 1.01 -1.26 -2.26 116.67 120.32 2k8i s ASP 33 Ca 0.46 -0.57 -0.19 0.00 0.71 0.00 0.00 52.55 52.97 2k8i s ASP 33 Cb -0.32 -1.33 0.02 0.00 1.01 0.00 0.00 42.92 42.30 2k8i s ASP 33 CO 0.41 -0.03 0.63 -0.72 0.21 0.00 0.00 175.17 175.67 2k8i s TYR 34 N 1.37 -0.09 -0.30 4.23 1.13 -1.15 -4.88 117.35 117.66 2k8i s TYR 34 Ca 0.05 -0.31 -0.07 0.00 -1.41 0.00 0.00 57.07 55.33 2k8i s TYR 34 Cb -0.13 0.54 0.01 0.00 -1.10 0.00 0.00 41.96 41.28 2k8i s TYR 34 CO -0.11 -1.10 0.09 -1.17 -2.51 0.00 0.00 175.55 170.74 2k8i s LEU 35 N -2.92 3.93 0.27 -3.49 2.96 -1.26 -2.34 118.68 115.83 2k8i s LEU 35 Ca 0.12 -0.73 -0.29 0.00 -0.22 0.00 0.00 54.13 53.01 2k8i s LEU 35 Cb -0.04 -1.89 -0.10 0.00 0.50 0.00 0.00 46.19 44.66 2k8i s LEU 35 CO 0.04 -0.21 1.31 -2.28 -1.32 0.00 0.00 176.35 173.89 2k8i s HIS 36 N 1.50 3.16 0.00 5.38 5.65 -1.20 -2.81 115.29 126.97 2k8i s HIS 36 Ca 0.02 1.32 0.00 0.00 0.25 0.00 0.00 55.06 56.65 2k8i s HIS 36 Cb -0.17 -3.64 0.00 0.00 -1.18 0.00 0.00 32.58 27.59 2k8i s HIS 36 CO 0.03 -1.86 0.00 0.41 -0.65 0.00 0.00 174.74 172.67 2k8i n GLY 37 N 1.56 0.42 0.29 1.59 0.00 -1.26 -1.70 105.19 106.09 2k8i n GLY 37 Ca 0.03 -0.93 0.03 0.00 0.00 0.00 0.00 46.02 45.15 2k8i n GLY 37 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2k8i n HIS 38 N -3.59 0.00 -3.13 1.61 -0.00 -1.12 -4.74 115.22 104.25 2k8i n HIS 38 Ca 0.00 -0.32 -0.21 0.00 -0.00 0.00 0.00 57.72 57.19 2k8i n HIS 38 Cb 0.32 -0.07 0.05 0.00 -0.00 0.00 0.00 29.99 30.28 2k8i n HIS 38 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2k8i n GLY 39 N -0.45 -0.42 0.31 -1.41 0.00 -1.26 -4.90 105.19 97.05 2k8i n GLY 39 Ca 0.05 0.10 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 2k8i n GLY 39 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2k8i h SER 40 N -1.66 1.07 -5.16 1.61 0.02 -1.95 -3.45 113.55 104.02 2k8i h SER 40 Ca -0.50 -0.29 -0.08 0.00 -0.84 0.00 0.00 61.79 60.08 2k8i h SER 40 Cb 1.34 -0.29 -0.14 0.00 0.14 0.00 0.00 62.40 63.46 2k8i h SER 40 CO 0.52 1.09 -0.33 -1.48 -1.14 0.00 0.00 176.83 175.50 2k8i s LEU 41 N -9.39 1.22 0.06 5.07 0.05 -1.26 -5.06 118.68 109.38 2k8i s LEU 41 Ca -0.12 -0.65 -0.12 0.00 0.05 0.00 0.00 54.13 53.29 2k8i s LEU 41 Cb 0.14 1.16 -0.07 0.00 -2.05 0.00 0.00 46.19 45.37 2k8i s LEU 41 CO 0.86 -0.77 0.26 2.30 -0.55 0.00 0.00 176.35 178.45 2k8i n ILE 42 N -0.11 0.59 -0.06 1.48 -5.35 -1.26 -4.62 119.36 110.03 2k8i n ILE 42 Ca -0.14 -0.15 -0.02 0.00 -0.27 0.00 0.00 62.75 62.17 2k8i n ILE 42 Cb 0.63 0.00 0.23 0.00 -1.74 0.00 0.00 39.64 38.75 2k8i n ILE 42 CO 0.00 0.00 0.00 0.28 -1.76 0.00 0.00 176.55 175.07 2k8i h SER 43 N 0.60 0.63 -0.24 7.28 0.02 -1.95 -2.49 113.55 117.40 2k8i h SER 43 Ca -0.13 -0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 60.63 2k8i h SER 43 Cb 0.57 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.93 2k8i h SER 43 CO 0.23 0.69 -0.00 1.23 -1.14 0.00 0.00 176.83 177.84 2k8i h GLY 44 N 0.92 0.58 0.23 -3.77 0.00 -1.48 -1.24 103.07 98.30 2k8i h GLY 44 Ca 0.13 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 47.12 2k8i h GLY 44 CO 0.01 0.32 -0.01 -2.00 0.00 0.00 0.00 176.54 174.87 2k8i h LEU 45 N 0.52 -0.02 -0.64 3.11 5.85 -1.69 -3.01 115.31 119.43 2k8i h LEU 45 Ca 0.11 -0.73 0.11 0.00 0.84 0.00 0.00 57.88 58.21 2k8i h LEU 45 Cb 0.34 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.30 2k8i h LEU 45 CO 0.01 0.74 0.23 -0.33 -0.34 0.00 0.00 178.44 178.75 2k8i h GLU 46 N -0.79 0.38 -0.60 1.25 5.08 -1.30 0.44 114.58 119.03 2k8i h GLU 46 Ca -0.00 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 2k8i h GLU 46 Cb 0.74 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 2k8i h GLU 46 CO 0.00 0.25 0.40 1.15 -1.00 0.00 0.00 179.01 179.82 2k8i h THR 47 N 0.39 1.11 0.01 1.13 2.02 -1.32 0.15 112.91 116.40 2k8i h THR 47 Ca 0.33 -0.26 -0.21 0.00 0.77 0.00 0.00 66.41 67.04 2k8i h THR 47 Cb 0.44 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 2k8i h THR 47 CO -0.34 0.14 -0.91 0.00 0.37 0.00 0.00 175.52 174.77 2k8i h ALA 48 N 1.64 0.45 -0.12 6.16 0.00 -0.77 -3.03 119.26 123.59 2k8i h ALA 48 Ca 0.23 -0.72 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 2k8i h ALA 48 Cb 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2k8i h ALA 48 CO -0.06 0.88 -0.16 -0.07 0.00 0.00 0.00 179.25 179.84 2k8i h LEU 49 N 0.15 0.19 -9.89 0.00 3.38 0.63 -3.44 115.31 106.32 2k8i h LEU 49 Ca -0.06 -0.04 -0.55 0.00 0.09 0.00 0.00 57.88 57.32 2k8i h LEU 49 Cb 1.55 -0.05 0.19 0.00 0.09 0.00 0.00 40.66 42.44 2k8i h LEU 49 CO 0.15 0.37 -0.14 -0.62 0.09 0.00 0.00 178.44 178.29 2k8i n GLU 50 N -4.26 0.16 0.00 1.13 1.02 -0.04 -3.58 120.64 115.07 2k8i n GLU 50 Ca -0.01 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.24 2k8i n GLU 50 Cb 0.28 -2.08 0.00 0.00 -0.02 0.00 0.00 31.44 29.63 2k8i n GLU 50 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k8i n GLY 51 N 1.20 2.70 3.95 0.62 0.00 -1.24 -5.01 105.19 107.41 2k8i n GLY 51 Ca 0.11 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 2k8i n GLY 51 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2k8i s HIS 52 N -0.99 1.58 0.42 1.61 -3.43 -1.23 -4.81 115.29 108.44 2k8i s HIS 52 Ca 0.00 -0.79 0.07 0.00 -0.80 0.00 0.00 55.06 53.54 2k8i s HIS 52 Cb 0.00 -2.02 -0.06 0.00 -1.43 0.00 0.00 32.58 29.06 2k8i s HIS 52 CO 0.00 -0.70 0.09 -1.21 -2.00 0.00 0.00 174.74 170.92 2k8i s GLU 53 N -4.41 2.09 0.45 -0.38 2.02 -1.26 -2.64 118.70 114.57 2k8i s GLU 53 Ca 0.44 -2.02 -0.23 0.00 0.02 0.00 0.00 54.97 53.17 2k8i s GLU 53 Cb -0.03 -1.78 -0.10 0.00 0.10 0.00 0.00 34.13 32.32 2k8i s GLU 53 CO 0.27 -0.11 1.00 1.33 0.02 0.00 0.00 175.26 177.77 2k8i n VAL 54 N -1.12 2.59 0.00 2.63 0.24 -1.26 -2.47 118.33 118.94 2k8i n VAL 54 Ca -0.04 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.76 2k8i n VAL 54 Cb 0.66 -1.16 0.00 0.00 -1.47 0.00 0.00 33.84 31.87 2k8i n VAL 54 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k8i n GLY 55 N 1.20 3.37 3.75 7.63 0.00 0.38 -5.02 105.19 116.50 2k8i n GLY 55 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2k8i n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k8i s ASP 56 N -0.94 6.78 -0.05 1.61 1.01 -1.03 -4.80 116.67 119.25 2k8i s ASP 56 Ca 0.00 2.58 -0.00 0.00 0.71 0.00 0.00 52.55 55.84 2k8i s ASP 56 Cb 0.00 -2.63 0.03 0.00 1.01 0.00 0.00 42.92 41.33 2k8i s ASP 56 CO 0.00 -0.58 0.00 -0.75 0.21 0.00 0.00 175.17 174.06 2k8i s LYS 57 N -0.79 0.41 0.37 8.23 2.36 -1.26 -2.40 119.74 126.66 2k8i s LYS 57 Ca 0.55 0.11 -0.08 0.00 -2.55 0.00 0.00 55.97 53.99 2k8i s LYS 57 Cb -0.39 -0.68 0.03 0.00 -1.05 0.00 0.00 37.83 35.74 2k8i s LYS 57 CO 0.45 -0.21 0.64 1.97 1.55 0.00 0.00 175.35 179.75 2k8i n PHE 58 N 4.62 -1.93 -4.39 4.03 -1.74 -1.01 -5.00 117.46 112.04 2k8i n PHE 58 Ca -0.17 -2.10 -0.33 0.00 -0.56 0.00 0.00 57.45 54.29 2k8i n PHE 58 Cb 0.50 0.75 -0.10 0.00 1.52 0.00 0.00 39.48 42.15 2k8i n PHE 58 CO 0.00 0.00 0.00 -0.51 -0.56 0.00 0.00 176.76 175.69 2k8i s ASP 59 N -3.12 4.90 0.02 5.98 1.11 -1.26 -1.66 116.67 122.64 2k8i s ASP 59 Ca 0.22 -0.04 0.06 0.00 0.18 0.00 0.00 52.55 52.97 2k8i s ASP 59 Cb -0.03 -1.24 -0.02 0.00 1.07 0.00 0.00 42.92 42.70 2k8i s ASP 59 CO 0.16 0.30 -0.17 -0.69 1.18 0.00 0.00 175.17 175.95 2k8i s VAL 60 N -1.00 1.39 -0.16 -1.27 1.01 0.14 -4.94 120.40 115.57 2k8i s VAL 60 Ca 0.17 -0.94 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 2k8i s VAL 60 Cb -0.11 -1.20 0.05 0.00 0.00 0.00 0.00 36.38 35.12 2k8i s VAL 60 CO 0.07 0.24 0.02 0.00 0.00 0.00 0.00 175.10 175.43 2k8i s ALA 61 N -0.63 0.98 -0.00 5.51 0.00 -1.26 0.25 121.76 126.62 2k8i s ALA 61 Ca 0.06 -0.57 0.07 0.00 0.00 0.00 0.00 51.96 51.51 2k8i s ALA 61 Cb -0.08 -1.07 -0.02 0.00 0.00 0.00 0.00 23.12 21.96 2k8i s ALA 61 CO 0.01 -0.95 -0.21 0.08 0.00 0.00 0.00 175.76 174.68 2k8i s VAL 62 N 1.86 1.67 0.54 0.00 1.01 -0.15 -4.94 120.40 120.39 2k8i s VAL 62 Ca 0.01 -0.98 -0.19 0.00 0.00 0.00 0.00 61.98 60.81 2k8i s VAL 62 Cb -0.16 -1.40 -0.06 0.00 0.00 0.00 0.00 36.38 34.76 2k8i s VAL 62 CO -0.07 0.40 1.13 -0.83 0.00 0.00 0.00 175.10 175.73 2k8i s GLY 63 N -0.67 2.64 0.66 4.51 0.00 -1.26 -1.05 107.32 112.14 2k8i s GLY 63 Ca 0.08 0.82 0.28 0.00 0.00 0.00 0.00 44.72 45.91 2k8i s GLY 63 CO -0.00 1.18 1.87 0.00 0.00 0.00 0.00 173.10 176.15 2k8i h ALA 64 N 1.20 1.43 0.00 3.20 0.00 -1.67 0.32 119.26 123.74 2k8i h ALA 64 Ca -0.50 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 2k8i h ALA 64 Cb 1.26 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2k8i h ALA 64 CO 0.57 -0.40 -0.14 -2.95 0.00 0.00 0.00 179.25 176.33 2k8i h ASN 65 N 0.00 0.00 -0.00 0.00 -1.07 -1.82 -3.22 115.58 109.47 2k8i h ASN 65 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.38 2k8i h ASN 65 Cb 0.78 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.03 2k8i h ASN 65 CO -0.00 0.14 -0.27 0.47 0.07 0.00 0.00 177.43 177.84 2k8i n ASP 66 N -3.19 0.35 0.00 6.14 8.00 -0.01 -5.02 116.55 122.82 2k8i n ASP 66 Ca 0.02 -0.68 0.00 0.00 0.71 0.00 0.00 54.79 54.84 2k8i n ASP 66 Cb 0.49 0.95 0.00 0.00 -0.02 0.00 0.00 41.12 42.54 2k8i n ASP 66 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k8i n ALA 67 N -1.06 0.00 -1.14 2.24 0.00 -0.53 -1.21 120.51 118.81 2k8i n ALA 67 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2k8i n ALA 67 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2k8i n ALA 67 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2k8i n TYR 68 N 0.00 -3.25 0.00 0.00 4.01 -1.26 -4.76 117.16 111.89 2k8i n TYR 68 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2k8i n TYR 68 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 2k8i n TYR 68 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2k8i n GLY 69 N 5.00 1.15 3.55 2.72 0.00 -1.26 -4.04 105.19 112.30 2k8i n GLY 69 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 2k8i n GLY 69 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2k8i s GLN 70 N -0.05 -0.65 -0.23 1.61 -1.52 -1.26 -4.62 119.66 112.94 2k8i s GLN 70 Ca 0.00 0.57 -0.42 0.00 -1.95 0.00 0.00 55.36 53.57 2k8i s GLN 70 Cb 0.00 -1.61 -0.18 0.00 -0.22 0.00 0.00 33.01 31.00 2k8i s GLN 70 CO 0.00 -3.48 1.50 0.98 -0.25 0.00 0.00 175.29 174.05 2k8i n TYR 71 N -4.70 1.61 -4.17 0.91 9.36 -0.76 -4.93 117.16 114.48 2k8i n TYR 71 Ca 0.05 0.83 -0.23 0.00 3.32 0.00 0.00 57.90 61.87 2k8i n TYR 71 Cb 0.56 -2.30 -0.17 0.00 -0.63 0.00 0.00 39.34 36.81 2k8i n TYR 71 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2k8i s ASP 72 N 2.17 1.50 0.01 2.98 -1.08 -1.26 -5.00 116.67 115.97 2k8i s ASP 72 Ca 0.96 -0.20 0.21 0.00 -0.52 0.00 0.00 52.55 53.00 2k8i s ASP 72 Cb -1.21 -0.62 0.89 0.00 -1.46 0.00 0.00 42.92 40.51 2k8i s ASP 72 CO 0.65 -0.06 1.67 -1.84 0.52 0.00 0.00 175.17 176.11 2k8i n GLU 73 N 4.31 0.01 0.00 4.34 0.28 -1.26 -2.70 120.64 125.61 2k8i n GLU 73 Ca -0.19 0.15 0.14 0.00 -0.16 0.00 0.00 57.16 57.09 2k8i n GLU 73 Cb 0.51 -1.51 0.60 0.00 1.43 0.00 0.00 31.44 32.47 2k8i n GLU 73 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 2k8i n ASN 74 N -1.52 0.08 0.00 -1.84 0.23 -1.26 -2.92 115.26 108.05 2k8i n ASN 74 Ca 0.05 0.26 0.12 0.00 -0.53 0.00 0.00 54.58 54.48 2k8i n ASN 74 Cb 0.24 -0.36 0.32 0.00 -2.08 0.00 0.00 39.78 37.91 2k8i n ASN 74 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 2k8i n LEU 75 N -1.44 0.41 -4.60 -4.53 7.94 -1.10 -4.82 117.00 108.86 2k8i n LEU 75 Ca 0.08 0.12 -0.34 0.00 -1.11 0.00 0.00 56.01 54.76 2k8i n LEU 75 Cb 0.32 -0.30 -0.10 0.00 0.53 0.00 0.00 43.42 43.87 2k8i n LEU 75 CO 0.27 0.09 -0.30 0.54 -1.11 0.00 0.00 177.39 176.88 2k8i s VAL 76 N -3.01 4.39 0.31 1.96 0.11 -1.15 -4.58 120.40 118.44 2k8i s VAL 76 Ca 0.11 -0.19 -0.17 0.00 -2.93 0.00 0.00 61.98 58.81 2k8i s VAL 76 Cb 0.18 -2.93 0.02 0.00 -1.53 0.00 0.00 36.38 32.12 2k8i s VAL 76 CO 0.66 0.51 0.68 0.00 -3.33 0.00 0.00 175.10 173.62 2k8i s GLN 77 N 0.07 1.88 -0.30 1.54 0.00 -1.18 -5.03 119.66 116.64 2k8i s GLN 77 Ca 0.03 -1.21 -0.05 0.00 -0.00 0.00 0.00 55.36 54.12 2k8i s GLN 77 Cb -0.13 0.58 0.02 0.00 0.00 0.00 0.00 33.01 33.48 2k8i s GLN 77 CO 0.02 -0.85 0.06 1.03 0.00 0.00 0.00 175.29 175.54 2k8i s ARG 78 N -3.43 2.89 -0.17 9.60 3.00 -1.26 -2.76 118.95 126.81 2k8i s ARG 78 Ca 0.16 -0.99 -0.08 0.00 0.00 0.00 0.00 55.73 54.82 2k8i s ARG 78 Cb -0.04 -3.32 -0.04 0.00 0.00 0.00 0.00 34.95 31.55 2k8i s ARG 78 CO 0.09 -0.50 0.09 0.08 0.00 0.00 0.00 175.30 175.06 2k8i s VAL 79 N 1.43 5.03 0.47 3.52 1.01 -0.73 -4.87 120.40 126.26 2k8i s VAL 79 Ca 0.01 0.05 -0.24 0.00 0.00 0.00 0.00 61.98 61.79 2k8i s VAL 79 Cb -0.18 -3.25 -0.08 0.00 0.00 0.00 0.00 36.38 32.87 2k8i s VAL 79 CO 0.01 0.49 1.41 -2.65 0.00 0.00 0.00 175.10 174.36 2k8i n PRO 80 N 3.19 2.10 -0.35 2.72 -0.02 -1.26 -0.31 135.00 141.07 2k8i n PRO 80 Ca -0.17 0.75 0.09 0.00 -2.02 0.00 0.00 63.50 62.15 2k8i n PRO 80 Cb 0.53 -2.60 0.27 0.00 -0.02 0.00 0.00 33.50 31.68 2k8i n PRO 80 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2k8i h LYS 81 N 2.07 0.89 -0.78 -0.52 1.79 -0.88 -2.17 116.57 116.97 2k8i h LYS 81 Ca -0.51 -0.05 0.01 0.00 -2.18 0.00 0.00 60.65 57.92 2k8i h LYS 81 Cb 1.28 -0.20 -0.04 0.00 -1.58 0.00 0.00 32.23 31.69 2k8i h LYS 81 CO 0.60 0.59 0.52 0.22 -1.08 0.00 0.00 179.45 180.29 2k8i h ASP 82 N 0.92 0.88 -0.85 0.86 3.58 -1.91 -1.96 116.42 117.93 2k8i h ASP 82 Ca 0.50 -0.02 0.17 0.00 0.42 0.00 0.00 57.03 58.10 2k8i h ASP 82 Cb 0.59 -0.22 -0.06 0.00 1.72 0.00 0.00 39.33 41.36 2k8i h ASP 82 CO -0.27 0.63 0.56 0.58 -2.88 0.00 0.00 179.24 177.86 2k8i h VAL 83 N 1.04 0.75 -0.99 2.25 2.07 -1.76 -1.65 116.25 117.95 2k8i h VAL 83 Ca 0.29 -0.16 -0.68 0.00 0.82 0.00 0.00 66.70 66.97 2k8i h VAL 83 Cb -0.09 0.23 -0.29 0.00 -1.52 0.00 0.00 31.29 29.62 2k8i h VAL 83 CO -0.07 0.09 0.84 0.49 0.02 0.00 0.00 177.57 178.94 2k8i n PHE 84 N -4.52 3.23 -0.29 1.57 3.72 -0.74 -4.67 117.46 115.76 2k8i n PHE 84 Ca 0.17 -3.02 0.28 0.00 -0.05 0.00 0.00 57.45 54.84 2k8i n PHE 84 Cb 0.59 -1.43 0.64 0.00 -0.94 0.00 0.00 39.48 38.34 2k8i n PHE 84 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2k8i h MET 85 N 2.00 0.17 -0.50 -1.08 -0.00 -1.39 0.93 114.93 115.06 2k8i h MET 85 Ca 0.60 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 60.29 2k8i h MET 85 Cb 0.83 -0.04 0.00 0.00 -0.00 0.00 0.00 31.60 32.39 2k8i h MET 85 CO 1.58 0.11 0.00 0.41 -0.00 0.00 0.00 176.91 179.01 2k8i n GLY 86 N -1.63 1.20 3.91 -3.00 0.00 -1.26 -4.91 105.19 99.50 2k8i n GLY 86 Ca 0.24 -0.41 -0.27 0.00 0.00 0.00 0.00 46.02 45.57 2k8i n GLY 86 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8i s VAL 87 N -1.63 4.17 0.00 1.61 0.11 0.32 -5.04 120.40 119.94 2k8i s VAL 87 Ca 0.25 0.16 0.00 0.00 -2.93 0.00 0.00 61.98 59.46 2k8i s VAL 87 Cb 0.15 -3.63 0.00 0.00 -1.53 0.00 0.00 36.38 31.37 2k8i s VAL 87 CO 0.14 -0.66 0.50 -0.67 -3.33 0.00 0.00 175.10 171.08 2k8i n ASP 88 N -2.50 0.00 -3.65 3.54 -0.08 -1.26 -4.89 116.55 107.71 2k8i n ASP 88 Ca 0.03 0.52 -0.11 0.00 -1.51 0.00 0.00 54.79 53.72 2k8i n ASP 88 Cb 0.56 -0.11 -0.11 0.00 2.34 0.00 0.00 41.12 43.80 2k8i n ASP 88 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 2k8i s GLU 89 N -1.21 0.23 -0.40 -0.67 2.02 -1.26 -5.10 118.70 112.31 2k8i s GLU 89 Ca 0.00 0.87 -0.27 0.00 0.02 0.00 0.00 54.97 55.60 2k8i s GLU 89 Cb 0.00 0.12 -0.06 0.00 0.10 0.00 0.00 34.13 34.28 2k8i s GLU 89 CO 0.00 -0.28 2.35 -0.51 0.02 0.00 0.00 175.26 176.84 2k8i s LEU 90 N 2.51 3.42 0.32 1.80 1.43 -1.26 -4.91 118.68 121.99 2k8i s LEU 90 Ca 0.00 1.35 0.07 0.00 -1.03 0.00 0.00 54.13 54.52 2k8i s LEU 90 Cb -0.12 -2.84 -0.06 0.00 0.03 0.00 0.00 46.19 43.20 2k8i s LEU 90 CO -0.11 -2.59 -0.04 -1.58 0.23 0.00 0.00 176.35 172.26 2k8i s GLN 91 N 7.65 1.70 0.23 1.70 0.74 -1.26 -4.90 119.66 125.52 2k8i s GLN 91 Ca 0.99 -1.89 -0.28 0.00 0.05 0.00 0.00 55.36 54.23 2k8i s GLN 91 Cb -0.22 -1.34 -0.09 0.00 1.10 0.00 0.00 33.01 32.46 2k8i s GLN 91 CO 0.29 0.02 0.88 0.08 -0.55 0.00 0.00 175.29 176.01 2k8i s VAL 92 N -2.89 4.20 0.00 1.34 1.01 -1.26 -3.46 120.40 119.34 2k8i s VAL 92 Ca 0.32 1.90 0.00 0.00 0.00 0.00 0.00 61.98 64.20 2k8i s VAL 92 Cb 0.05 -4.21 0.00 0.00 0.00 0.00 0.00 36.38 32.22 2k8i s VAL 92 CO 0.15 0.45 0.00 0.61 0.00 0.00 0.00 175.10 176.30 2k8i n GLY 93 N 1.36 0.81 3.75 4.51 0.00 0.28 -4.98 105.19 110.93 2k8i n GLY 93 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 2k8i n GLY 93 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k8i s MET 94 N -0.34 4.45 -0.05 1.61 -1.94 -1.22 -4.82 119.30 116.98 2k8i s MET 94 Ca 0.00 0.98 0.03 0.00 -1.71 0.00 0.00 55.69 54.99 2k8i s MET 94 Cb 0.00 -3.35 -0.03 0.00 2.01 0.00 0.00 34.83 33.46 2k8i s MET 94 CO 0.00 0.33 -0.14 1.03 -0.01 0.00 0.00 175.02 176.23 2k8i s ARG 95 N -0.17 2.55 0.22 2.03 0.52 -1.26 -0.77 118.95 122.07 2k8i s ARG 95 Ca 0.36 -0.69 -0.23 0.00 -0.52 0.00 0.00 55.73 54.65 2k8i s ARG 95 Cb -0.20 -2.40 0.04 0.00 0.52 0.00 0.00 34.95 32.92 2k8i s ARG 95 CO 0.21 0.61 0.85 -0.59 0.02 0.00 0.00 175.30 176.40 2k8i s PHE 96 N -0.69 -0.14 -0.17 -0.53 -0.12 -1.04 -5.04 117.98 110.25 2k8i s PHE 96 Ca 0.10 -0.25 -0.17 0.00 -0.05 0.00 0.00 56.93 56.56 2k8i s PHE 96 Cb -0.11 0.68 -0.04 0.00 -0.63 0.00 0.00 43.02 42.92 2k8i s PHE 96 CO 0.01 -1.04 0.46 -1.17 -0.05 0.00 0.00 175.22 173.42 2k8i s LEU 97 N -2.95 4.20 -0.16 -1.99 2.96 -1.26 -1.74 118.68 117.74 2k8i s LEU 97 Ca 0.12 0.67 -0.02 0.00 -0.22 0.00 0.00 54.13 54.68 2k8i s LEU 97 Cb -0.04 -2.63 -0.02 0.00 0.50 0.00 0.00 46.19 44.00 2k8i s LEU 97 CO 0.05 -0.08 -0.09 0.00 -1.32 0.00 0.00 176.35 174.91 2k8i s ALA 98 N 1.15 2.76 0.28 5.97 0.00 0.03 -4.91 121.76 127.04 2k8i s ALA 98 Ca 0.23 -0.94 -0.29 0.00 0.00 0.00 0.00 51.96 50.96 2k8i s ALA 98 Cb -0.15 -1.42 -0.09 0.00 0.00 0.00 0.00 23.12 21.46 2k8i s ALA 98 CO 0.09 0.07 1.05 -1.21 0.00 0.00 0.00 175.76 175.76 2k8i s GLU 99 N 0.63 4.68 0.20 0.00 2.02 -1.26 0.13 118.70 125.10 2k8i s GLU 99 Ca -0.05 1.69 0.01 0.00 0.02 0.00 0.00 54.97 56.64 2k8i s GLU 99 Cb -0.15 -3.18 -0.00 0.00 0.10 0.00 0.00 34.13 30.90 2k8i s GLU 99 CO 0.03 0.29 0.24 0.25 0.02 0.00 0.00 175.26 176.08 2k8i n THR 100 N 1.20 0.00 -0.12 3.63 -2.24 -0.77 -4.86 114.28 111.12 2k8i n THR 100 Ca -0.01 -1.20 -0.02 0.00 -2.27 0.00 0.00 64.05 60.55 2k8i n THR 100 Cb 0.46 0.67 0.21 0.00 -2.10 0.00 0.00 70.33 69.57 2k8i n THR 100 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2k8i h ASP 101 N 1.17 0.74 -0.70 3.42 3.32 -2.00 -2.76 116.42 119.62 2k8i h ASP 101 Ca -0.15 -0.12 -0.31 0.00 0.02 0.00 0.00 57.03 56.48 2k8i h ASP 101 Cb 0.70 -0.19 -0.18 0.00 0.22 0.00 0.00 39.33 39.87 2k8i h ASP 101 CO 0.21 0.71 0.39 0.00 -1.72 0.00 0.00 179.24 178.83 2k8i n GLN 102 N -4.30 2.49 0.00 3.56 10.64 -1.26 -5.01 117.38 123.51 2k8i n GLN 102 Ca 0.04 -2.38 0.00 0.00 -1.83 0.00 0.00 57.00 52.83 2k8i n GLN 102 Cb 0.20 -1.97 0.00 0.00 -0.86 0.00 0.00 30.24 27.62 2k8i n GLN 102 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2k8i n GLY 103 N -0.47 -0.53 3.72 2.61 0.00 -1.04 -4.87 105.19 104.61 2k8i n GLY 103 Ca 0.41 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 2k8i n GLY 103 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2k8i n PRO 104 N -0.56 2.20 -3.76 1.61 -0.02 -1.26 -1.84 135.00 131.37 2k8i n PRO 104 Ca 0.00 0.77 -0.24 0.00 -2.02 0.00 0.00 63.50 62.01 2k8i n PRO 104 Cb 0.00 -2.44 -0.17 0.00 -0.02 0.00 0.00 33.50 30.87 2k8i n PRO 104 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2k8i s VAL 105 N -1.14 0.40 -0.43 -1.45 1.01 0.35 -4.85 120.40 114.29 2k8i s VAL 105 Ca 0.57 -0.04 -0.28 0.00 0.00 0.00 0.00 61.98 62.23 2k8i s VAL 105 Cb -0.52 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.22 2k8i s VAL 105 CO 0.61 0.14 1.50 -2.84 0.00 0.00 0.00 175.10 174.51 2k8i s PRO 106 N 1.95 3.45 0.19 2.72 0.02 -1.26 -0.79 135.00 141.29 2k8i s PRO 106 Ca 0.04 0.92 0.11 0.00 0.02 0.00 0.00 61.00 62.09 2k8i s PRO 106 Cb -0.13 -4.09 -0.04 0.00 0.02 0.00 0.00 34.50 30.26 2k8i s PRO 106 CO -0.06 -1.73 -0.20 0.14 -0.33 0.00 0.00 177.00 174.83 2k8i s VAL 107 N 5.93 2.59 -0.11 3.83 -7.23 -0.71 -4.82 120.40 119.88 2k8i s VAL 107 Ca 0.63 -1.95 0.02 0.00 -1.81 0.00 0.00 61.98 58.86 2k8i s VAL 107 Cb -0.15 -2.26 -0.01 0.00 0.56 0.00 0.00 36.38 34.52 2k8i s VAL 107 CO 0.31 -0.13 -0.16 -0.70 -0.31 0.00 0.00 175.10 174.11 2k8i s GLU 108 N -2.76 3.12 -0.02 4.82 2.12 -1.14 -2.50 118.70 122.33 2k8i s GLU 108 Ca 0.22 -0.73 -0.30 0.00 0.36 0.00 0.00 54.97 54.52 2k8i s GLU 108 Cb -0.08 -2.50 -0.03 0.00 0.26 0.00 0.00 34.13 31.77 2k8i s GLU 108 CO 0.12 0.29 1.09 0.42 -0.54 0.00 0.00 175.26 176.64 2k8i s ILE 109 N 0.12 4.51 -0.76 -3.70 1.01 0.05 -1.16 121.20 121.26 2k8i s ILE 109 Ca -0.08 1.80 0.06 0.00 0.00 0.00 0.00 60.65 62.44 2k8i s ILE 109 Cb -0.15 -4.16 0.07 0.00 0.01 0.00 0.00 42.46 38.23 2k8i s ILE 109 CO 0.05 0.08 0.76 0.35 0.00 0.00 0.00 174.94 176.17 2k8i n THR 110 N 4.21 0.12 0.00 2.92 -2.24 0.24 0.10 114.28 119.63 2k8i n THR 110 Ca 0.08 -0.56 0.00 0.00 -2.27 0.00 0.00 64.05 61.30 2k8i n THR 110 Cb 0.48 1.06 0.00 0.00 -2.10 0.00 0.00 70.33 69.77 2k8i n THR 110 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2k8i n ALA 111 N 0.33 0.00 -3.68 6.98 0.00 -1.22 -4.84 120.51 118.08 2k8i n ALA 111 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.20 2k8i n ALA 111 Cb 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.47 2k8i n ALA 111 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2k8i s VAL 112 N -2.00 0.33 0.00 0.00 1.01 -1.26 -0.13 120.40 118.36 2k8i s VAL 112 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 61.98 61.40 2k8i s VAL 112 Cb 0.00 -0.98 0.00 0.00 0.00 0.00 0.00 36.38 35.40 2k8i s VAL 112 CO 0.00 -0.34 0.00 -0.62 0.00 0.00 0.00 175.10 174.14 2k8i n GLU 113 N 5.11 2.43 0.02 2.72 1.02 0.13 -4.97 120.64 127.11 2k8i n GLU 113 Ca -0.07 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 56.96 2k8i n GLU 113 Cb 0.46 0.00 -0.05 0.00 -0.02 0.00 0.00 31.44 31.84 2k8i n GLU 113 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 2k8i h ASP 114 N 0.00 -0.25 0.00 1.62 3.58 -2.02 -3.37 116.42 115.98 2k8i h ASP 114 Ca 0.00 0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.50 2k8i h ASP 114 Cb 0.00 0.12 0.00 0.00 1.72 0.00 0.00 39.33 41.17 2k8i h ASP 114 CO 0.00 -0.11 0.00 -0.90 -2.88 0.00 0.00 179.24 175.35 2k8i n ASP 115 N -5.21 0.16 -4.08 2.28 5.75 -1.26 -5.05 116.55 109.15 2k8i n ASP 115 Ca -0.05 -0.51 -0.08 0.00 -0.01 0.00 0.00 54.79 54.15 2k8i n ASP 115 Cb 0.14 0.27 -0.10 0.00 -1.03 0.00 0.00 41.12 40.40 2k8i n ASP 115 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2k8i s HIS 116 N -0.27 0.50 0.28 2.11 -3.43 -1.26 -0.16 115.29 113.06 2k8i s HIS 116 Ca 0.00 -0.98 0.08 0.00 -0.80 0.00 0.00 55.06 53.36 2k8i s HIS 116 Cb 0.00 -0.37 -0.04 0.00 -1.43 0.00 0.00 32.58 30.75 2k8i s HIS 116 CO 0.00 -0.34 0.18 0.14 -2.00 0.00 0.00 174.74 172.72 2k8i s VAL 117 N -3.51 3.90 -0.33 -5.38 -7.23 0.58 0.19 120.40 108.60 2k8i s VAL 117 Ca 0.04 -1.52 -0.06 0.00 -1.81 0.00 0.00 61.98 58.62 2k8i s VAL 117 Cb 0.05 -3.20 0.04 0.00 0.56 0.00 0.00 36.38 33.83 2k8i s VAL 117 CO -0.08 -0.30 0.09 -0.69 -0.31 0.00 0.00 175.10 173.81 2k8i s VAL 118 N -2.24 3.71 -0.09 1.32 1.01 0.82 -1.77 120.40 123.16 2k8i s VAL 118 Ca 0.35 -1.13 0.01 0.00 0.00 0.00 0.00 61.98 61.21 2k8i s VAL 118 Cb -0.07 -3.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.20 2k8i s VAL 118 CO 0.24 -0.16 -0.13 0.68 0.00 0.00 0.00 175.10 175.74 2k8i s VAL 119 N 1.39 3.14 0.00 2.92 -7.23 -1.11 0.80 120.40 120.31 2k8i s VAL 119 Ca -0.02 -0.66 0.02 0.00 -1.81 0.00 0.00 61.98 59.51 2k8i s VAL 119 Cb -0.19 -2.28 -0.01 0.00 0.56 0.00 0.00 36.38 34.46 2k8i s VAL 119 CO 0.02 0.56 -0.06 -0.62 -0.31 0.00 0.00 175.10 174.69 2k8i s ASP 120 N -0.21 0.68 -0.00 4.85 -1.08 -0.31 -3.12 116.67 117.47 2k8i s ASP 120 Ca 0.01 -0.16 0.00 0.00 -0.52 0.00 0.00 52.55 51.88 2k8i s ASP 120 Cb -0.13 -0.06 0.01 0.00 -1.46 0.00 0.00 42.92 41.28 2k8i s ASP 120 CO 0.03 0.03 0.93 0.61 0.52 0.00 0.00 175.17 177.29 2k8i n GLY 121 N 2.75 0.10 2.84 2.66 0.00 -1.26 -2.89 105.19 109.38 2k8i n GLY 121 Ca -0.14 -0.03 -0.28 0.00 0.00 0.00 0.00 46.02 45.57 2k8i n GLY 121 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k8i s ASN 122 N -0.90 3.15 0.20 1.61 4.22 -1.26 -4.52 114.94 117.44 2k8i s ASN 122 Ca 0.01 -0.87 0.03 0.00 -2.14 0.00 0.00 52.86 49.88 2k8i s ASN 122 Cb 0.01 -0.85 -0.01 0.00 1.28 0.00 0.00 41.25 41.68 2k8i s ASN 122 CO 0.00 -0.25 0.09 1.41 -2.04 0.00 0.00 177.10 176.31 2k8i n HIS 123 N 4.89 -0.05 -0.10 1.54 8.25 -1.26 -4.83 115.22 123.66 2k8i n HIS 123 Ca -0.11 -1.38 -0.06 0.00 -0.26 0.00 0.00 57.72 55.92 2k8i n HIS 123 Cb 0.46 0.04 0.02 0.00 1.12 0.00 0.00 29.99 31.63 2k8i n HIS 123 CO 0.00 0.00 0.00 1.98 0.64 0.00 0.00 176.34 178.96 2k8i h MET 124 N 0.00 0.13 0.00 -0.41 4.05 -1.95 0.74 114.93 117.48 2k8i h MET 124 Ca -0.15 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.26 2k8i h MET 124 Cb 0.63 -0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.40 2k8i h MET 124 CO 0.24 0.08 -0.50 1.28 0.23 0.00 0.00 176.91 178.24 2k8i n LEU 125 N -5.15 0.57 0.00 3.39 7.99 -1.26 -3.52 117.00 119.02 2k8i n LEU 125 Ca 0.01 0.18 0.00 0.00 -0.01 0.00 0.00 56.01 56.20 2k8i n LEU 125 Cb 0.18 -0.24 0.00 0.00 -0.11 0.00 0.00 43.42 43.24 2k8i n LEU 125 CO 0.22 0.01 0.00 0.00 -1.51 0.00 0.00 177.39 176.11 2k8i n ALA 126 N -1.68 0.00 0.00 -1.18 0.00 0.18 -4.49 120.51 113.34 2k8i n ALA 126 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2k8i n ALA 126 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 2k8i n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k8i n GLY 127 N 0.00 0.58 3.78 0.00 0.00 -1.26 -4.16 105.19 104.13 2k8i n GLY 127 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 2k8i n GLY 127 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2k8i s GLN 128 N -0.62 4.60 0.28 1.61 1.03 -1.26 -4.86 119.66 120.44 2k8i s GLN 128 Ca 0.00 1.32 0.07 0.00 0.04 0.00 0.00 55.36 56.79 2k8i s GLN 128 Cb 0.00 -2.85 -0.03 0.00 0.03 0.00 0.00 33.01 30.16 2k8i s GLN 128 CO 0.00 0.31 0.31 -0.80 -2.54 0.00 0.00 175.29 172.58 2k8i s ASN 129 N -1.57 5.77 0.08 12.60 0.01 -1.26 -2.97 114.94 127.60 2k8i s ASN 129 Ca 0.49 -0.21 0.08 0.00 -0.71 0.00 0.00 52.86 52.51 2k8i s ASN 129 Cb -0.19 -1.39 -0.04 0.00 0.41 0.00 0.00 41.25 40.04 2k8i s ASN 129 CO 0.24 -0.19 -0.17 -0.76 -1.51 0.00 0.00 177.10 174.71 2k8i s LEU 130 N -3.98 2.72 -0.11 0.60 1.43 -0.22 -3.77 118.68 115.35 2k8i s LEU 130 Ca 0.37 -0.47 0.02 0.00 -1.03 0.00 0.00 54.13 53.02 2k8i s LEU 130 Cb -0.08 -1.57 -0.01 0.00 0.03 0.00 0.00 46.19 44.55 2k8i s LEU 130 CO 0.28 0.21 -0.17 -0.54 0.23 0.00 0.00 176.35 176.36 2k8i s LYS 131 N -1.83 3.13 -0.05 1.70 1.02 0.28 -0.98 119.74 123.00 2k8i s LYS 131 Ca 0.17 -0.76 0.05 0.00 0.02 0.00 0.00 55.97 55.45 2k8i s LYS 131 Cb -0.11 -2.47 -0.02 0.00 -0.52 0.00 0.00 37.83 34.71 2k8i s LYS 131 CO 0.08 0.27 -0.20 -0.06 -0.92 0.00 0.00 175.35 174.52 2k8i s PHE 132 N 0.18 2.55 -0.41 3.18 0.08 0.14 -0.03 117.98 123.67 2k8i s PHE 132 Ca -0.10 -0.43 -0.11 0.00 0.12 0.00 0.00 56.93 56.41 2k8i s PHE 132 Cb -0.16 -1.61 0.06 0.00 -0.57 0.00 0.00 43.02 40.74 2k8i s PHE 132 CO 0.06 -0.02 0.27 -0.80 -0.10 0.00 0.00 175.22 174.62 2k8i s ASN 133 N -0.43 5.77 -0.12 1.36 -0.87 0.14 0.26 114.94 121.06 2k8i s ASN 133 Ca 0.05 -1.30 -0.05 0.00 -1.57 0.00 0.00 52.86 49.98 2k8i s ASN 133 Cb -0.12 -2.04 -0.04 0.00 -0.02 0.00 0.00 41.25 39.04 2k8i s ASN 133 CO 0.02 -0.51 0.08 -0.69 -2.57 0.00 0.00 177.10 173.43 2k8i s VAL 134 N 1.51 4.99 -0.34 1.60 1.01 -0.66 -1.18 120.40 127.33 2k8i s VAL 134 Ca 0.03 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.01 2k8i s VAL 134 Cb -0.22 -3.16 0.12 0.00 0.00 0.00 0.00 36.38 33.13 2k8i s VAL 134 CO 0.05 0.59 0.18 -1.61 0.00 0.00 0.00 175.10 174.31 2k8i s GLU 135 N -0.80 0.58 -0.27 2.72 2.02 0.54 -2.39 118.70 121.10 2k8i s GLU 135 Ca 0.13 -1.18 -0.29 0.00 0.02 0.00 0.00 54.97 53.64 2k8i s GLU 135 Cb -0.12 -1.50 0.00 0.00 0.10 0.00 0.00 34.13 32.62 2k8i s GLU 135 CO 0.03 -1.13 1.20 0.54 0.02 0.00 0.00 175.26 175.93 2k8i s VAL 136 N 1.31 4.32 -0.01 2.63 0.11 -1.01 0.45 120.40 128.20 2k8i s VAL 136 Ca 0.15 1.54 -0.21 0.00 -2.93 0.00 0.00 61.98 60.52 2k8i s VAL 136 Cb -0.21 -4.22 -0.23 0.00 -1.53 0.00 0.00 36.38 30.19 2k8i s VAL 136 CO -0.12 -0.38 1.08 0.58 -3.33 0.00 0.00 175.10 172.92 2k8i h VAL 137 N 5.76 1.46 -2.12 2.04 2.07 -1.42 0.11 116.25 124.15 2k8i h VAL 137 Ca -0.24 -2.04 -0.01 0.00 0.82 0.00 0.00 66.70 65.24 2k8i h VAL 137 Cb 1.08 2.65 -0.18 0.00 -1.52 0.00 0.00 31.29 33.32 2k8i h VAL 137 CO 1.02 0.58 0.30 0.00 0.02 0.00 0.00 177.57 179.49 2k8i s ALA 138 N -3.18 -1.78 -0.02 1.67 0.00 -0.79 -4.60 121.76 113.06 2k8i s ALA 138 Ca -0.14 1.19 0.01 0.00 0.00 0.00 0.00 51.96 53.02 2k8i s ALA 138 Cb 0.03 0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.22 2k8i s ALA 138 CO 0.80 -0.46 -0.02 0.42 0.00 0.00 0.00 175.76 176.49 2k8i s ILE 139 N -1.85 0.30 -0.15 0.00 1.01 -1.26 -0.83 121.20 118.43 2k8i s ILE 139 Ca -0.05 -0.04 -0.14 0.00 0.00 0.00 0.00 60.65 60.42 2k8i s ILE 139 Cb -0.00 -0.34 0.04 0.00 0.01 0.00 0.00 42.46 42.17 2k8i s ILE 139 CO 0.02 0.15 0.39 -0.60 0.00 0.00 0.00 174.94 174.90 2k8i s ARG 140 N 0.63 0.46 -0.02 2.79 3.52 0.09 -5.00 118.95 121.43 2k8i s ARG 140 Ca -0.07 0.55 -0.30 0.00 -0.13 0.00 0.00 55.73 55.78 2k8i s ARG 140 Cb -0.10 0.22 -0.05 0.00 -1.56 0.00 0.00 34.95 33.47 2k8i s ARG 140 CO -0.01 -0.05 1.29 -1.83 -0.81 0.00 0.00 175.30 173.89 2k8i s GLU 141 N 0.21 4.33 0.84 5.12 -1.05 -1.26 -1.09 118.70 125.80 2k8i s GLU 141 Ca -0.00 1.82 -0.11 0.00 -0.15 0.00 0.00 54.97 56.52 2k8i s GLU 141 Cb -0.03 -3.53 0.09 0.00 -0.44 0.00 0.00 34.13 30.22 2k8i s GLU 141 CO 0.00 -0.48 1.10 0.00 0.95 0.00 0.00 175.26 176.83 2k8i s ALA 142 N 2.13 1.98 -0.36 -0.84 0.00 -1.18 -4.86 121.76 118.63 2k8i s ALA 142 Ca 0.60 -0.16 0.09 0.00 0.00 0.00 0.00 51.96 52.49 2k8i s ALA 142 Cb -0.28 -3.14 0.66 0.00 0.00 0.00 0.00 23.12 20.36 2k8i s ALA 142 CO 0.25 -1.97 1.64 0.25 0.00 0.00 0.00 175.76 175.93 2k8i n THR 143 N -3.61 2.54 0.00 0.00 -2.24 -1.26 -4.87 114.28 104.84 2k8i n THR 143 Ca 0.07 -1.34 0.00 0.00 -2.27 0.00 0.00 64.05 60.51 2k8i n THR 143 Cb 0.56 -0.39 0.00 0.00 -2.10 0.00 0.00 70.33 68.40 2k8i n THR 143 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k8i n GLU 144 N 0.08 0.00 -0.08 -0.78 1.02 -1.26 -4.66 120.64 114.96 2k8i n GLU 144 Ca 0.33 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.36 2k8i n GLU 144 Cb 1.21 -0.61 -0.04 0.00 -0.02 0.00 0.00 31.44 31.98 2k8i n GLU 144 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2k8i h GLU 145 N 0.00 0.38 -0.88 3.49 4.39 -1.98 0.71 114.58 120.70 2k8i h GLU 145 Ca 0.00 -0.10 0.13 0.00 0.34 0.00 0.00 59.36 59.73 2k8i h GLU 145 Cb 0.00 -0.05 -0.07 0.00 -0.10 0.00 0.00 28.75 28.53 2k8i h GLU 145 CO 0.00 0.50 0.57 0.93 -1.16 0.00 0.00 179.01 179.85 2k8i h GLU 146 N 0.20 0.73 -0.03 2.33 3.07 -1.83 -1.09 114.58 117.97 2k8i h GLU 146 Ca 0.07 -0.04 -0.06 0.00 -0.50 0.00 0.00 59.36 58.83 2k8i h GLU 146 Cb 0.30 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 2k8i h GLU 146 CO 0.00 0.48 -0.23 -0.07 -1.40 0.00 0.00 179.01 177.80 2k8i h LEU 147 N 0.75 0.24 -1.75 1.33 3.38 -1.67 0.14 115.31 117.74 2k8i h LEU 147 Ca 0.43 -0.71 0.12 0.00 0.09 0.00 0.00 57.88 57.81 2k8i h LEU 147 Cb 0.60 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 2k8i h LEU 147 CO -0.19 0.91 0.39 0.00 0.09 0.00 0.00 178.44 179.64 2k8i h ALA 148 N 0.34 2.17 0.00 1.53 0.00 0.97 -2.04 119.26 122.21 2k8i h ALA 148 Ca -0.02 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.67 2k8i h ALA 148 Cb 0.93 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.64 2k8i h ALA 148 CO 0.05 -0.31 -2.12 0.72 0.00 0.00 0.00 179.25 177.58 2k8i n HIS 149 N -4.45 0.12 -1.37 0.00 8.25 -0.46 -5.00 115.22 112.31 2k8i n HIS 149 Ca 0.10 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 2k8i n HIS 149 Cb 0.45 -0.83 0.00 0.00 1.12 0.00 0.00 29.99 30.73 2k8i n HIS 149 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k8i n GLY 150 N 1.52 0.85 3.18 -1.41 0.00 0.35 -5.07 105.19 104.62 2k8i n GLY 150 Ca -0.19 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.11 2k8i n GLY 150 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2k8i s HIS 151 N -2.00 0.69 0.15 1.61 3.76 -0.36 -4.89 115.29 114.25 2k8i s HIS 151 Ca 0.00 -1.09 0.13 0.00 -0.15 0.00 0.00 55.06 53.95 2k8i s HIS 151 Cb 0.00 -0.36 0.30 0.00 1.11 0.00 0.00 32.58 33.63 2k8i s HIS 151 CO 0.00 -0.54 1.56 -0.24 -0.85 0.00 0.00 174.74 174.67 2k8i h VAL 152 N 2.83 1.24 0.00 -0.90 3.04 -1.86 -3.41 116.25 117.19 2k8i h VAL 152 Ca -0.34 -2.21 0.00 0.00 -1.01 0.00 0.00 66.70 63.14 2k8i h VAL 152 Cb 1.20 2.26 0.00 0.00 -2.01 0.00 0.00 31.29 32.73 2k8i h VAL 152 CO 0.58 0.59 0.00 1.57 -1.01 0.00 0.00 177.57 179.30 2k8i n HIS 153 N -3.55 0.00 0.06 3.17 -0.00 -1.26 -3.42 115.22 110.23 2k8i n HIS 153 Ca -0.00 0.00 -0.20 0.00 -0.00 0.00 0.00 57.72 57.52 2k8i n HIS 153 Cb 0.66 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 30.51 2k8i n HIS 153 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.34 177.12 2k8i h GLY 154 N 0.00 0.36 0.00 1.57 0.00 -2.03 -3.47 103.07 99.50 2k8i h GLY 154 Ca 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 47.33 46.42 2k8i h GLY 154 CO 0.00 0.79 0.00 0.00 0.00 0.00 0.00 176.54 177.33 2k8i n ALA 155 N -2.78 0.00 0.14 3.60 0.00 -1.22 -3.84 120.51 116.40 2k8i n ALA 155 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.22 2k8i n ALA 155 Cb 1.06 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.51 2k8i n ALA 155 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2k8i n HIS 156 N 0.00 -2.65 -3.91 0.00 8.25 -1.26 -5.00 115.22 110.65 2k8i n HIS 156 Ca 0.00 0.61 -0.29 0.00 -0.26 0.00 0.00 57.72 57.78 2k8i n HIS 156 Cb 0.00 1.27 -0.13 0.00 1.12 0.00 0.00 29.99 32.25 2k8i n HIS 156 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2k8i s ASP 157 N -4.08 4.56 -0.10 0.41 1.01 -1.26 -5.07 116.67 112.14 2k8i s ASP 157 Ca 0.00 -3.50 -0.29 0.00 0.71 0.00 0.00 52.55 49.47 2k8i s ASP 157 Cb 0.00 -1.61 -0.06 0.00 1.01 0.00 0.00 42.92 42.26 2k8i s ASP 157 CO 0.00 -0.14 1.96 -2.28 0.21 0.00 0.00 175.17 174.91 2k8i s HIS 158 N -0.96 1.45 -0.47 4.23 5.65 -1.25 -4.88 115.29 119.06 2k8i s HIS 158 Ca 0.22 0.10 -0.27 0.00 0.25 0.00 0.00 55.06 55.35 2k8i s HIS 158 Cb -0.13 -4.07 -0.03 0.00 -1.18 0.00 0.00 32.58 27.17 2k8i s HIS 158 CO -0.10 -4.47 1.94 -1.01 -0.65 0.00 0.00 174.74 170.45 2k8i s HIS 159 N 5.81 1.61 -0.80 3.88 0.09 -1.26 -4.91 115.29 119.71 2k8i s HIS 159 Ca 0.88 0.83 -0.23 0.00 -0.00 0.00 0.00 55.06 56.54 2k8i s HIS 159 Cb -0.35 -4.02 0.06 0.00 -0.00 0.00 0.00 32.58 28.27 2k8i s HIS 159 CO 0.36 -2.66 1.18 -1.58 -0.00 0.00 0.00 174.74 172.04 2k8i s HIS 160 N 8.69 2.60 0.75 1.40 5.04 -1.26 -5.01 115.29 127.50 2k8i s HIS 160 Ca 0.78 -0.59 -0.11 0.00 -1.54 0.00 0.00 55.06 53.60 2k8i s HIS 160 Cb -0.18 -4.47 0.04 0.00 0.04 0.00 0.00 32.58 28.01 2k8i s HIS 160 CO 0.27 -1.81 1.08 0.16 -2.34 0.00 0.00 174.74 172.10 2k8i s ASP 161 N 3.95 4.91 0.00 9.88 -4.77 -1.26 -4.98 116.67 124.40 2k8i s ASP 161 Ca 0.32 1.49 0.00 0.00 -3.30 0.00 0.00 52.55 51.07 2k8i s ASP 161 Cb -0.09 -2.30 0.00 0.00 -1.09 0.00 0.00 42.92 39.44 2k8i s ASP 161 CO 0.05 -1.73 0.00 1.57 0.70 0.00 0.00 175.17 175.76 2k8i n HIS 162 N -3.30 0.00 -2.59 2.11 -0.00 -1.26 -5.11 115.22 105.07 2k8i n HIS 162 Ca 0.07 0.00 -0.32 0.00 0.46 0.00 0.00 57.72 57.93 2k8i n HIS 162 Cb 0.55 0.00 -0.05 0.00 -0.12 0.00 0.00 29.99 30.37 2k8i n HIS 162 CO 0.00 0.00 0.00 -0.51 0.46 0.00 0.00 176.34 176.29 2k8i s ASP 163 N 0.00 6.76 -0.19 0.26 1.01 -1.26 -4.97 116.67 118.28 2k8i s ASP 163 Ca 0.00 1.61 0.09 0.00 0.71 0.00 0.00 52.55 54.96 2k8i s ASP 163 Cb 0.00 -2.52 0.26 0.00 1.01 0.00 0.00 42.92 41.67 2k8i s ASP 163 CO 0.00 -0.48 1.29 0.00 0.21 0.00 0.00 175.17 176.19 2k8i n HIS 164 N -1.16 -0.95 -2.11 4.23 1.44 -1.26 -5.11 115.22 110.30 2k8i n HIS 164 Ca 0.07 -1.22 -0.43 0.00 -2.01 0.00 0.00 57.72 54.13 2k8i n HIS 164 Cb 0.54 0.95 -0.03 0.00 0.12 0.00 0.00 29.99 31.58 2k8i n HIS 164 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 2k8i s ASP 165 N -1.30 6.33 -0.31 4.39 1.01 -1.26 -4.84 116.67 120.68 2k8i s ASP 165 Ca 0.08 1.57 0.13 0.00 0.71 0.00 0.00 52.55 55.04 2k8i s ASP 165 Cb 0.27 -2.53 0.47 0.00 1.01 0.00 0.00 42.92 42.13 2k8i s ASP 165 CO -0.08 -1.31 1.12 1.57 0.21 0.00 0.00 175.17 176.69 2k8i n HIS 166 N 8.64 2.19 -0.47 4.23 -0.00 -1.26 -4.90 115.22 123.66 2k8i n HIS 166 Ca 0.19 -2.41 -0.03 0.00 0.46 0.00 0.00 57.72 55.93 2k8i n HIS 166 Cb 0.45 -0.27 0.01 0.00 -0.12 0.00 0.00 29.99 30.06 2k8i n HIS 166 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2k8i n HIS 167 N -0.56 0.27 -2.70 1.57 -0.00 -1.26 -4.63 115.22 107.91 2k8i n HIS 167 Ca 0.27 -1.13 -0.43 0.00 -0.00 0.00 0.00 57.72 56.44 2k8i n HIS 167 Cb 0.85 -0.56 0.01 0.00 -0.00 0.00 0.00 29.99 30.29 2k8i n HIS 167 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2k8i n HIS 168 N 1.23 2.51 -4.50 1.57 -0.00 -1.26 -4.98 115.22 109.80 2k8i n HIS 168 Ca 0.05 -2.65 -0.34 0.00 0.46 0.00 0.00 57.72 55.24 2k8i n HIS 168 Cb 0.52 -1.54 -0.11 0.00 -0.12 0.00 0.00 29.99 28.74 2k8i n HIS 168 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2k8i s HIS 169 N -1.57 3.02 0.00 1.57 5.04 -1.26 -4.50 115.29 117.59 2k8i s HIS 169 Ca 0.35 -0.02 0.00 0.00 -1.54 0.00 0.00 55.06 53.86 2k8i s HIS 169 Cb 0.08 -1.80 0.00 0.00 0.04 0.00 0.00 32.58 30.90 2k8i s HIS 169 CO 0.06 0.27 0.00 1.58 -2.34 0.00 0.00 174.74 174.31 2k8i n HIS 170 N 2.55 0.00 -0.93 3.88 -0.00 -1.26 -5.30 115.22 114.16 2k8i n HIS 170 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.54 2k8i n HIS 170 Cb 0.53 -0.54 0.00 0.00 -0.00 0.00 0.00 29.99 29.98 2k8i n HIS 170 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92