#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n51 s ILE 46 N 0.00 2.28 0.18 0.00 -4.36 -1.26 -4.78 121.20 113.26 3n51 s ILE 46 Ca 0.00 -1.05 -0.14 0.00 -0.26 0.00 0.00 60.65 59.21 3n51 s ILE 46 Cb 0.00 -1.82 0.11 0.00 1.25 0.00 0.00 42.46 42.00 3n51 s ILE 46 CO 0.00 0.56 1.70 0.15 0.24 0.00 0.00 174.94 177.59 3n51 h PHE 47 N 5.40 0.05 0.00 1.37 3.57 -1.96 -2.27 116.94 123.10 3n51 h PHE 47 Ca -0.44 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.06 3n51 h PHE 47 Cb 1.13 0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.91 3n51 h PHE 47 CO 0.42 -0.06 -0.14 0.66 -2.23 0.00 0.00 178.31 176.96 3n51 h SER 48 N 0.16 0.00 -0.08 0.41 4.64 -1.97 -0.81 113.55 115.90 3n51 h SER 48 Ca 0.24 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.52 3n51 h SER 48 Cb 0.34 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.42 3n51 h SER 48 CO -0.36 0.14 -0.06 0.44 -0.87 0.00 0.00 176.83 176.12 3n51 h ASP 49 N 0.00 0.30 0.00 4.97 3.32 -1.84 -3.35 116.42 119.82 3n51 h ASP 49 Ca -0.00 -0.05 -0.37 0.00 0.02 0.00 0.00 57.03 56.62 3n51 h ASP 49 Cb 0.55 -0.08 -0.07 0.00 0.22 0.00 0.00 39.33 39.95 3n51 h ASP 49 CO 0.02 0.40 -2.41 -1.14 -1.72 0.00 0.00 179.24 174.40 3n51 n ARG 50 N -4.31 0.70 -4.89 3.56 0.63 -0.55 -4.85 116.66 106.95 3n51 n ARG 50 Ca 0.00 0.04 -0.26 0.00 -0.92 0.00 0.00 57.85 56.72 3n51 n ARG 50 Cb 0.24 -1.51 -0.15 0.00 0.45 0.00 0.00 32.46 31.48 3n51 n ARG 50 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 3n51 s TYR 51 N -2.50 1.73 -0.10 -0.14 2.02 -0.42 -0.45 117.35 117.49 3n51 s TYR 51 Ca -0.18 -0.33 -0.00 0.00 -0.37 0.00 0.00 57.07 56.18 3n51 s TYR 51 Cb 0.07 -1.10 -0.02 0.00 -0.40 0.00 0.00 41.96 40.51 3n51 s TYR 51 CO 0.74 -0.01 -0.09 -1.59 -1.57 0.00 0.00 175.55 173.03 3n51 s LYS 52 N -0.56 3.13 0.34 -0.62 -2.85 -0.48 -4.43 119.74 114.28 3n51 s LYS 52 Ca 0.07 -0.61 -0.29 0.00 -1.00 0.00 0.00 55.97 54.15 3n51 s LYS 52 Cb -0.08 -2.64 -0.11 0.00 -2.06 0.00 0.00 37.83 32.94 3n51 s LYS 52 CO -0.00 0.42 1.44 0.20 0.10 0.00 0.00 175.35 177.51 3n51 s GLY 53 N -0.15 2.82 -0.02 0.59 0.00 -1.26 -1.13 107.32 108.16 3n51 s GLY 53 Ca 0.01 1.47 -0.02 0.00 0.00 0.00 0.00 44.72 46.17 3n51 s GLY 53 CO 0.03 2.20 -0.06 -1.06 0.00 0.00 0.00 173.10 174.21 3n51 n GLN 54 N 0.90 0.09 -3.56 2.90 6.02 0.33 -4.90 117.38 119.17 3n51 n GLN 54 Ca 0.02 0.04 -0.14 0.00 -0.01 0.00 0.00 57.00 56.91 3n51 n GLN 54 Cb 0.40 -0.66 -0.05 0.00 1.02 0.00 0.00 30.24 30.95 3n51 n GLN 54 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 3n51 s ARG 55 N -2.10 1.06 0.28 -1.09 1.70 -1.10 -5.02 118.95 112.68 3n51 s ARG 55 Ca -0.06 -0.24 -0.29 0.00 -0.47 0.00 0.00 55.73 54.67 3n51 s ARG 55 Cb 0.02 0.48 -0.09 0.00 -0.57 0.00 0.00 34.95 34.79 3n51 s ARG 55 CO 0.08 -0.39 1.05 0.08 -1.08 0.00 0.00 175.30 175.04 3n51 s VAL 56 N -2.53 3.69 -0.41 4.99 1.01 -1.26 -0.24 120.40 125.65 3n51 s VAL 56 Ca -0.05 1.64 0.13 0.00 0.00 0.00 0.00 61.98 63.71 3n51 s VAL 56 Cb -0.01 -4.02 -0.17 0.00 0.00 0.00 0.00 36.38 32.19 3n51 s VAL 56 CO -0.02 0.35 0.47 0.18 0.00 0.00 0.00 175.10 176.07 3n51 n LEU 57 N 1.10 0.40 0.00 3.92 4.77 0.21 -4.79 117.00 122.61 3n51 n LEU 57 Ca -0.01 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.65 3n51 n LEU 57 Cb 0.46 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3n51 n LEU 57 CO 0.52 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 3n51 n GLY 58 N 1.46 1.63 3.77 -0.72 0.00 -1.11 -4.98 105.19 105.24 3n51 n GLY 58 Ca 0.01 -1.97 -0.37 0.00 0.00 0.00 0.00 46.02 43.69 3n51 n GLY 58 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3n51 s LYS 59 N -1.30 4.05 0.00 1.61 2.20 -1.26 -0.71 119.74 124.33 3n51 s LYS 59 Ca 0.00 0.11 0.00 0.00 -0.36 0.00 0.00 55.97 55.72 3n51 s LYS 59 Cb 0.00 -3.35 0.00 0.00 -1.51 0.00 0.00 37.83 32.97 3n51 s LYS 59 CO 0.00 0.42 0.00 0.41 -0.36 0.00 0.00 175.35 175.82 3n51 n GLY 60 N 2.85 5.39 3.73 5.54 0.00 -0.90 -4.93 105.19 116.87 3n51 n GLY 60 Ca -0.14 -2.13 -0.42 0.00 0.00 0.00 0.00 46.02 43.34 3n51 n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3n51 s SER 61 N -0.22 6.79 0.00 1.61 0.01 -1.26 -3.21 113.70 117.42 3n51 s SER 61 Ca 0.00 2.48 0.00 0.00 1.31 0.00 0.00 55.95 59.74 3n51 s SER 61 Cb 0.00 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.62 3n51 s SER 61 CO 0.00 -0.63 0.00 0.49 0.41 0.00 0.00 173.24 173.51 3n51 n PHE 62 N 2.92 0.00 -2.23 2.43 3.72 -1.26 -4.90 117.46 118.15 3n51 n PHE 62 Ca 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 3n51 n PHE 62 Cb 0.42 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 3n51 n PHE 62 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n51 n GLY 63 N -2.00 -1.46 3.78 1.37 0.00 -1.20 -4.39 105.19 101.28 3n51 n GLY 63 Ca 0.00 -1.37 -0.39 0.00 0.00 0.00 0.00 46.02 44.26 3n51 n GLY 63 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n51 s GLU 64 N -1.95 4.49 -0.18 1.61 2.12 -1.06 -2.12 118.70 121.62 3n51 s GLU 64 Ca 0.00 1.06 -0.03 0.00 0.36 0.00 0.00 54.97 56.36 3n51 s GLU 64 Cb 0.00 -3.27 -0.02 0.00 0.26 0.00 0.00 34.13 31.10 3n51 s GLU 64 CO 0.00 0.54 -0.05 0.08 -0.54 0.00 0.00 175.26 175.29 3n51 s VAL 65 N -0.99 3.59 -0.05 3.70 1.01 0.11 -0.89 120.40 126.89 3n51 s VAL 65 Ca 0.35 -0.45 0.04 0.00 0.00 0.00 0.00 61.98 61.92 3n51 s VAL 65 Cb -0.22 -2.59 -0.00 0.00 0.00 0.00 0.00 36.38 33.57 3n51 s VAL 65 CO 0.24 0.47 -0.19 -0.63 0.00 0.00 0.00 175.10 174.99 3n51 s ILE 66 N 0.78 1.59 -0.12 2.22 1.09 -0.00 -0.62 121.20 126.14 3n51 s ILE 66 Ca -0.02 -0.79 -0.30 0.00 -1.10 0.00 0.00 60.65 58.44 3n51 s ILE 66 Cb -0.15 -1.37 -0.02 0.00 -1.06 0.00 0.00 42.46 39.86 3n51 s ILE 66 CO 0.02 0.45 1.22 -0.22 -0.10 0.00 0.00 174.94 176.31 3n51 s LEU 67 N 0.10 4.22 0.34 2.97 2.96 0.67 -0.28 118.68 129.66 3n51 s LEU 67 Ca -0.07 1.73 0.04 0.00 -0.22 0.00 0.00 54.13 55.62 3n51 s LEU 67 Cb -0.13 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 42.95 3n51 s LEU 67 CO 0.03 -0.67 0.05 0.00 -1.32 0.00 0.00 176.35 174.44 3n51 s LYS 69 N -3.86 0.78 0.13 0.00 2.20 -0.28 -0.78 119.74 117.93 3n51 s LYS 69 Ca 0.36 -0.15 -0.32 0.00 -0.36 0.00 0.00 55.97 55.49 3n51 s LYS 69 Cb 0.09 -0.77 -0.12 0.00 -1.51 0.00 0.00 37.83 35.52 3n51 s LYS 69 CO 0.16 -0.01 1.77 -3.47 -0.36 0.00 0.00 175.35 173.44 3n51 n ASP 70 N 3.71 3.79 0.19 1.43 -0.08 -0.07 -1.38 116.55 124.15 3n51 n ASP 70 Ca -0.22 1.02 0.14 0.00 -1.51 0.00 0.00 54.79 54.22 3n51 n ASP 70 Cb 0.53 -1.51 0.63 0.00 2.34 0.00 0.00 41.12 43.10 3n51 n ASP 70 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 3n51 h LYS 71 N 7.75 0.00 0.00 -0.67 1.57 -1.09 -2.21 116.57 121.92 3n51 h LYS 71 Ca -0.46 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 3n51 h LYS 71 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 3n51 h LYS 71 CO 0.94 0.00 -0.77 -0.89 -0.57 0.00 0.00 179.45 178.16 3n51 n ILE 72 N -2.53 1.29 0.79 1.86 5.41 -1.26 -4.74 119.36 120.17 3n51 n ILE 72 Ca 0.01 0.21 0.13 0.00 1.00 0.00 0.00 62.75 64.09 3n51 n ILE 72 Cb 0.20 -2.15 0.36 0.00 -0.71 0.00 0.00 39.64 37.34 3n51 n ILE 72 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 3n51 n THR 73 N -4.11 0.25 -0.90 1.39 -2.24 -1.25 -4.94 114.28 102.48 3n51 n THR 73 Ca -0.11 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3n51 n THR 73 Cb 0.40 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 3n51 n THR 73 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n51 n GLY 74 N 1.41 0.73 3.68 3.38 0.00 -0.83 -4.99 105.19 108.57 3n51 n GLY 74 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 3n51 n GLY 74 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3n51 s GLN 75 N -0.25 4.14 0.32 1.61 2.00 -1.26 -4.59 119.66 121.62 3n51 s GLN 75 Ca 0.00 2.61 -0.28 0.00 -2.00 0.00 0.00 55.36 55.69 3n51 s GLN 75 Cb 0.00 -3.73 -0.09 0.00 0.80 0.00 0.00 33.01 29.98 3n51 s GLN 75 CO 0.00 -0.87 1.09 -1.21 -0.50 0.00 0.00 175.29 173.80 3n51 s GLU 76 N 3.16 4.48 0.11 1.67 2.02 -1.26 -0.89 118.70 127.99 3n51 s GLU 76 Ca 0.83 1.73 -0.07 0.00 0.02 0.00 0.00 54.97 57.47 3n51 s GLU 76 Cb -0.45 -2.99 -0.01 0.00 0.10 0.00 0.00 34.13 30.78 3n51 s GLU 76 CO 0.38 0.09 0.19 0.00 0.02 0.00 0.00 175.26 175.93 3n51 s ALA 78 N -3.92 3.50 -0.08 0.00 0.00 0.26 -0.64 121.76 120.88 3n51 s ALA 78 Ca 0.11 -0.79 0.03 0.00 0.00 0.00 0.00 51.96 51.31 3n51 s ALA 78 Cb 0.05 -1.62 0.01 0.00 0.00 0.00 0.00 23.12 21.56 3n51 s ALA 78 CO -0.06 0.62 -0.16 0.08 0.00 0.00 0.00 175.76 176.24 3n51 s VAL 79 N -1.00 1.46 -0.25 0.00 1.01 0.61 -0.96 120.40 121.27 3n51 s VAL 79 Ca 0.16 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.37 3n51 s VAL 79 Cb -0.12 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 34.92 3n51 s VAL 79 CO 0.06 0.43 0.18 -0.75 0.00 0.00 0.00 175.10 175.01 3n51 s LYS 80 N 0.58 4.04 -0.29 2.72 2.20 -0.61 -0.82 119.74 127.55 3n51 s LYS 80 Ca -0.16 -0.27 -0.09 0.00 -0.36 0.00 0.00 55.97 55.10 3n51 s LYS 80 Cb -0.16 -3.58 -0.02 0.00 -1.51 0.00 0.00 37.83 32.56 3n51 s LYS 80 CO 0.05 -0.02 0.12 0.08 -0.36 0.00 0.00 175.35 175.23 3n51 s VAL 81 N 1.28 4.53 -0.31 4.02 1.01 -0.07 -1.20 120.40 129.66 3n51 s VAL 81 Ca 0.08 -0.31 -0.06 0.00 0.00 0.00 0.00 61.98 61.69 3n51 s VAL 81 Cb -0.14 -3.24 0.03 0.00 0.00 0.00 0.00 36.38 33.03 3n51 s VAL 81 CO 0.06 0.17 0.07 -0.63 0.00 0.00 0.00 175.10 174.78 3n51 s ILE 82 N 1.62 3.72 -0.26 2.22 1.01 -0.21 -2.55 121.20 126.75 3n51 s ILE 82 Ca 0.05 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.43 3n51 s ILE 82 Cb -0.16 -3.02 -0.01 0.00 0.01 0.00 0.00 42.46 39.28 3n51 s ILE 82 CO 0.06 -0.05 1.35 -0.55 0.00 0.00 0.00 174.94 175.75 3n51 s SER 83 N 1.42 6.67 0.48 3.58 0.15 -1.26 -0.86 113.70 123.88 3n51 s SER 83 Ca -0.00 1.36 0.14 0.00 0.70 0.00 0.00 55.95 58.15 3n51 s SER 83 Cb -0.18 -2.54 1.14 0.00 -1.71 0.00 0.00 66.02 62.73 3n51 s SER 83 CO 0.02 -1.06 2.09 0.11 1.20 0.00 0.00 173.24 175.60 3n51 h LYS 84 N 9.35 0.20 0.43 5.44 1.57 -1.41 0.51 116.57 132.66 3n51 h LYS 84 Ca -0.28 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.47 3n51 h LYS 84 Cb 1.11 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.38 3n51 h LYS 84 CO 1.02 0.13 -0.21 -0.09 -0.57 0.00 0.00 179.45 179.73 3n51 h ARG 85 N 0.20 -0.55 0.00 3.15 2.43 -1.91 -3.33 114.38 114.37 3n51 h ARG 85 Ca 0.10 0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.22 3n51 h ARG 85 Cb 0.16 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 3n51 h ARG 85 CO -0.02 -0.26 -0.43 0.37 -1.51 0.00 0.00 179.97 178.12 3n51 h GLN 86 N -1.03 0.00 -4.92 0.20 4.15 -1.86 -3.42 115.11 108.23 3n51 h GLN 86 Ca -0.06 0.00 -0.67 0.00 0.77 0.00 0.00 58.65 58.69 3n51 h GLN 86 Cb 0.54 0.00 -0.35 0.00 0.21 0.00 0.00 27.48 27.88 3n51 h GLN 86 CO 0.10 0.43 -0.80 0.08 -1.93 0.00 0.00 178.83 176.71 3n51 s VAL 87 N -3.89 2.36 0.43 2.39 1.01 0.18 -5.01 120.40 117.86 3n51 s VAL 87 Ca -0.02 -1.30 -0.25 0.00 0.00 0.00 0.00 61.98 60.42 3n51 s VAL 87 Cb 0.13 -2.24 -0.08 0.00 0.00 0.00 0.00 36.38 34.19 3n51 s VAL 87 CO 0.72 0.17 1.25 -0.75 0.00 0.00 0.00 175.10 176.48 3n51 s LYS 88 N 1.21 3.87 0.21 2.72 2.47 -1.26 -4.41 119.74 124.55 3n51 s LYS 88 Ca -0.03 2.01 -0.10 0.00 -1.56 0.00 0.00 55.97 56.29 3n51 s LYS 88 Cb -0.17 -2.62 -0.07 0.00 -1.46 0.00 0.00 37.83 33.50 3n51 s LYS 88 CO -0.07 -0.52 0.53 -0.65 0.16 0.00 0.00 175.35 174.80 3n51 s GLN 89 N -2.40 3.81 -0.06 4.03 -0.21 -1.26 -1.51 119.66 122.06 3n51 s GLN 89 Ca 0.59 0.26 0.04 0.00 0.02 0.00 0.00 55.36 56.28 3n51 s GLN 89 Cb -0.35 -2.71 -0.25 0.00 1.00 0.00 0.00 33.01 30.71 3n51 s GLN 89 CO 0.43 0.36 0.61 0.87 -2.12 0.00 0.00 175.29 175.44 3n51 h LYS 90 N 2.74 0.12 -5.32 2.91 1.57 -0.62 -3.45 116.57 114.52 3n51 h LYS 90 Ca -0.47 -0.21 -0.64 0.00 -1.87 0.00 0.00 60.65 57.46 3n51 h LYS 90 Cb 1.17 0.08 -0.13 0.00 0.08 0.00 0.00 32.23 33.43 3n51 h LYS 90 CO 0.69 0.83 -0.55 0.95 -0.57 0.00 0.00 179.45 180.80 3n51 s THR 91 N -2.59 1.35 0.67 -0.16 -4.23 -1.26 -5.04 115.64 104.38 3n51 s THR 91 Ca -0.11 -2.00 -0.14 0.00 -1.18 0.00 0.00 61.69 58.26 3n51 s THR 91 Cb 0.07 -2.46 0.00 0.00 1.34 0.00 0.00 72.50 71.46 3n51 s THR 91 CO 0.81 0.00 1.09 1.51 -0.54 0.00 0.00 174.62 177.49 3n51 s ASP 92 N -3.78 5.12 0.44 3.99 -4.77 -1.26 -4.93 116.67 111.49 3n51 s ASP 92 Ca 0.18 1.91 0.12 0.00 -3.30 0.00 0.00 52.55 51.46 3n51 s ASP 92 Cb 0.05 -2.54 0.97 0.00 -1.09 0.00 0.00 42.92 40.30 3n51 s ASP 92 CO 0.09 -1.62 2.01 0.50 0.70 0.00 0.00 175.17 176.85 3n51 h LYS 93 N -0.17 0.15 -0.44 2.11 3.64 -2.00 -2.45 116.57 117.40 3n51 h LYS 93 Ca -0.46 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 58.83 3n51 h LYS 93 Cb 1.24 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 33.01 3n51 h LYS 93 CO 0.54 0.23 -0.01 0.93 -2.27 0.00 0.00 179.45 178.88 3n51 h GLU 94 N 0.15 0.72 -0.21 1.90 5.08 -1.98 0.21 114.58 120.45 3n51 h GLU 94 Ca 0.03 -0.19 -0.12 0.00 -1.00 0.00 0.00 59.36 58.09 3n51 h GLU 94 Cb 0.22 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.38 3n51 h GLU 94 CO 0.01 0.74 -0.32 1.03 -1.00 0.00 0.00 179.01 179.47 3n51 h SER 95 N 0.68 0.65 0.03 1.42 0.87 -1.83 -1.87 113.55 113.49 3n51 h SER 95 Ca 0.14 -0.52 0.00 0.00 -1.23 0.00 0.00 61.79 60.18 3n51 h SER 95 Cb 0.43 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 3n51 h SER 95 CO 0.02 1.04 -0.03 0.25 -0.53 0.00 0.00 176.83 177.58 3n51 h LEU 96 N 0.28 -0.07 -1.01 2.23 5.85 -1.21 -0.85 115.31 120.53 3n51 h LEU 96 Ca 0.02 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.76 3n51 h LEU 96 Cb 0.90 0.03 -0.05 0.00 0.37 0.00 0.00 40.66 41.91 3n51 h LEU 96 CO 0.07 -0.04 0.67 -0.07 -0.34 0.00 0.00 178.44 178.73 3n51 h LEU 97 N -0.06 1.15 -0.19 2.25 3.38 -0.60 -0.21 115.31 121.03 3n51 h LEU 97 Ca 0.00 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 3n51 h LEU 97 Cb 0.06 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3n51 h LEU 97 CO -0.01 0.82 -0.02 -0.09 0.09 0.00 0.00 178.44 179.23 3n51 h ARG 98 N 1.35 0.36 -0.79 1.13 2.43 -1.16 -1.62 114.38 116.08 3n51 h ARG 98 Ca 0.38 -0.12 -0.04 0.00 -0.81 0.00 0.00 59.98 59.39 3n51 h ARG 98 Cb -0.12 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.36 3n51 h ARG 98 CO -0.09 0.58 0.35 1.49 -1.51 0.00 0.00 179.97 180.79 3n51 h GLU 99 N 0.10 1.16 -0.40 0.20 4.81 -0.84 -0.73 114.58 118.88 3n51 h GLU 99 Ca 0.05 -0.19 0.02 0.00 -0.13 0.00 0.00 59.36 59.11 3n51 h GLU 99 Cb 0.43 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 3n51 h GLU 99 CO 0.01 0.92 0.24 0.28 -0.73 0.00 0.00 179.01 179.73 3n51 h VAL 100 N 1.13 1.05 -0.71 0.32 2.07 -0.95 -0.11 116.25 119.05 3n51 h VAL 100 Ca 0.27 -0.17 -0.02 0.00 0.82 0.00 0.00 66.70 67.61 3n51 h VAL 100 Cb 0.16 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 3n51 h VAL 100 CO -0.03 0.09 0.37 -0.61 0.02 0.00 0.00 177.57 177.41 3n51 h GLN 101 N 0.49 0.98 -0.03 1.57 5.75 -0.87 -1.45 115.11 121.55 3n51 h GLN 101 Ca 0.16 -0.11 -0.00 0.00 -0.15 0.00 0.00 58.65 58.54 3n51 h GLN 101 Cb -0.00 -0.19 -0.00 0.00 1.07 0.00 0.00 27.48 28.35 3n51 h GLN 101 CO -0.07 0.73 0.01 1.25 -2.65 0.00 0.00 178.83 178.10 3n51 h LEU 102 N 0.99 0.04 -0.94 -2.39 5.85 -0.71 -3.14 115.31 115.00 3n51 h LEU 102 Ca 0.25 -0.18 0.10 0.00 0.84 0.00 0.00 57.88 58.88 3n51 h LEU 102 Cb 0.04 -0.01 -0.08 0.00 0.37 0.00 0.00 40.66 40.99 3n51 h LEU 102 CO -0.04 0.21 0.58 -0.07 -0.34 0.00 0.00 178.44 178.78 3n51 h LEU 103 N -0.13 0.87 -2.09 2.25 3.38 -0.37 -0.46 115.31 118.76 3n51 h LEU 103 Ca 0.01 0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.04 3n51 h LEU 103 Cb 0.18 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 3n51 h LEU 103 CO -0.00 0.51 0.07 0.11 0.09 0.00 0.00 178.44 179.21 3n51 h LYS 104 N 0.98 0.00 0.00 1.13 1.57 -1.25 -2.44 116.57 116.55 3n51 h LYS 104 Ca 0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.22 3n51 h LYS 104 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3n51 h LYS 104 CO -0.23 0.00 -0.40 1.04 -0.57 0.00 0.00 179.45 179.29 3n51 n GLN 105 N -4.36 0.05 -3.39 3.15 6.02 -0.19 -4.91 117.38 113.75 3n51 n GLN 105 Ca -0.01 0.02 -0.30 0.00 -0.01 0.00 0.00 57.00 56.70 3n51 n GLN 105 Cb 0.17 -1.53 -0.04 0.00 1.02 0.00 0.00 30.24 29.86 3n51 n GLN 105 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3n51 s LEU 106 N -3.21 4.11 -0.21 1.08 1.43 -0.92 -5.09 118.68 115.87 3n51 s LEU 106 Ca 0.11 0.77 -0.09 0.00 -1.03 0.00 0.00 54.13 53.89 3n51 s LEU 106 Cb 0.17 -3.56 0.08 0.00 0.03 0.00 0.00 46.19 42.91 3n51 s LEU 106 CO 0.66 -0.13 0.48 -0.62 0.23 0.00 0.00 176.35 176.97 3n51 s ASP 107 N -2.83 -0.53 -0.25 2.29 2.15 -1.26 -4.87 116.67 111.36 3n51 s ASP 107 Ca 0.45 1.09 -0.22 0.00 0.43 0.00 0.00 52.55 54.30 3n51 s ASP 107 Cb -0.11 1.24 0.07 0.00 -0.30 0.00 0.00 42.92 43.82 3n51 s ASP 107 CO 0.27 -0.22 0.67 -2.28 -0.17 0.00 0.00 175.17 173.44 3n51 s HIS 108 N 2.07 -0.79 -0.87 -5.34 2.46 -1.26 -5.05 115.29 106.52 3n51 s HIS 108 Ca -0.06 1.84 0.16 0.00 0.47 0.00 0.00 55.06 57.47 3n51 s HIS 108 Cb -0.10 0.32 0.68 0.00 -0.13 0.00 0.00 32.58 33.35 3n51 s HIS 108 CO -0.14 -0.38 1.50 -0.35 -2.47 0.00 0.00 174.74 172.89 3n51 n PRO 109 N 3.02 0.05 -0.31 2.88 -0.04 -1.26 -2.20 135.00 137.13 3n51 n PRO 109 Ca -0.15 0.31 0.08 0.00 -0.04 0.00 0.00 63.50 63.70 3n51 n PRO 109 Cb 0.56 -1.59 0.24 0.00 -0.04 0.00 0.00 33.50 32.66 3n51 n PRO 109 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3n51 n ASN 110 N -1.68 3.54 -4.19 3.54 5.03 -1.26 -4.67 115.26 115.57 3n51 n ASN 110 Ca 0.03 -2.17 -0.31 0.00 0.87 0.00 0.00 54.58 53.00 3n51 n ASN 110 Cb 0.17 -0.38 -0.17 0.00 -1.02 0.00 0.00 39.78 38.39 3n51 n ASN 110 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 3n51 s ILE 111 N -1.30 1.93 0.18 2.41 -1.09 -0.94 -0.17 121.20 122.23 3n51 s ILE 111 Ca 0.36 -0.95 -0.33 0.00 -2.23 0.00 0.00 60.65 57.50 3n51 s ILE 111 Cb 0.21 -1.68 -0.14 0.00 -1.58 0.00 0.00 42.46 39.27 3n51 s ILE 111 CO 0.21 0.53 1.42 0.80 -1.23 0.00 0.00 174.94 176.67 3n51 n MET 112 N 3.56 1.85 -2.83 2.79 0.00 -0.66 -4.58 117.12 117.25 3n51 n MET 112 Ca -0.20 0.66 -0.42 0.00 -0.00 0.00 0.00 57.70 57.75 3n51 n MET 112 Cb 0.53 -2.33 -0.04 0.00 0.00 0.00 0.00 33.22 31.38 3n51 n MET 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 175.97 176.18 3n51 s LYS 113 N 0.15 4.34 -0.12 2.12 2.47 -1.26 -4.99 119.74 122.45 3n51 s LYS 113 Ca 0.74 1.13 -0.16 0.00 -1.56 0.00 0.00 55.97 56.12 3n51 s LYS 113 Cb -0.72 -3.56 -0.05 0.00 -1.46 0.00 0.00 37.83 32.04 3n51 s LYS 113 CO 0.46 -0.32 0.39 -1.17 0.16 0.00 0.00 175.35 174.87 3n51 s LEU 114 N 2.10 4.29 -0.24 5.43 2.96 -1.26 -1.10 118.68 130.85 3n51 s LEU 114 Ca 0.41 0.71 -0.04 0.00 -0.22 0.00 0.00 54.13 54.99 3n51 s LEU 114 Cb -0.17 -2.55 -0.14 0.00 0.50 0.00 0.00 46.19 43.83 3n51 s LEU 114 CO 0.14 0.08 -0.25 -1.22 -1.32 0.00 0.00 176.35 173.78 3n51 n TYR 115 N 3.40 0.00 -3.63 5.38 4.01 0.16 -4.43 117.16 122.04 3n51 n TYR 115 Ca -0.10 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.54 3n51 n TYR 115 Cb 0.52 -0.90 -0.03 0.00 -0.31 0.00 0.00 39.34 38.61 3n51 n TYR 115 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 3n51 s GLU 116 N -2.47 1.33 -0.03 -0.72 2.02 -0.77 -4.98 118.70 113.08 3n51 s GLU 116 Ca -0.33 -0.73 0.01 0.00 0.02 0.00 0.00 54.97 53.94 3n51 s GLU 116 Cb 0.10 0.54 0.02 0.00 0.10 0.00 0.00 34.13 34.90 3n51 s GLU 116 CO 0.50 -0.57 -0.00 0.12 0.02 0.00 0.00 175.26 175.33 3n51 s PHE 117 N -3.83 0.32 0.17 1.61 5.36 -1.26 -0.53 117.98 119.82 3n51 s PHE 117 Ca 0.06 -0.01 0.06 0.00 -0.96 0.00 0.00 56.93 56.07 3n51 s PHE 117 Cb -0.01 -0.39 -0.04 0.00 -0.34 0.00 0.00 43.02 42.24 3n51 s PHE 117 CO -0.07 -0.12 -0.12 -0.06 -1.46 0.00 0.00 175.22 173.39 3n51 s PHE 118 N 0.89 1.46 -0.07 10.12 0.08 0.07 -4.98 117.98 125.54 3n51 s PHE 118 Ca -0.09 -0.66 -0.06 0.00 0.12 0.00 0.00 56.93 56.24 3n51 s PHE 118 Cb -0.12 -0.71 0.02 0.00 -0.57 0.00 0.00 43.02 41.63 3n51 s PHE 118 CO -0.01 0.20 0.18 -2.00 -0.10 0.00 0.00 175.22 173.49 3n51 s GLU 119 N -3.58 0.20 0.05 0.44 2.12 -1.26 -0.01 118.70 116.65 3n51 s GLU 119 Ca 0.18 0.28 0.00 0.00 0.36 0.00 0.00 54.97 55.79 3n51 s GLU 119 Cb 0.00 0.06 -0.00 0.00 0.26 0.00 0.00 34.13 34.45 3n51 s GLU 119 CO 0.03 -0.05 0.01 -0.40 -0.54 0.00 0.00 175.26 174.31 3n51 n ASP 120 N 3.19 1.43 -0.05 -1.70 5.68 -0.62 -4.96 116.55 119.53 3n51 n ASP 120 Ca -0.15 -1.22 0.14 0.00 -0.50 0.00 0.00 54.79 53.06 3n51 n ASP 120 Cb 0.58 0.08 0.56 0.00 -1.14 0.00 0.00 41.12 41.19 3n51 n ASP 120 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 3n51 h LYS 121 N 0.00 0.27 0.00 0.11 3.64 -2.04 -3.20 116.57 115.36 3n51 h LYS 121 Ca -0.04 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3n51 h LYS 121 Cb 0.13 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 3n51 h LYS 121 CO 0.06 0.18 -0.79 0.41 -2.27 0.00 0.00 179.45 177.04 3n51 n GLY 122 N -1.55 -0.14 3.19 5.01 0.00 -1.26 -4.93 105.19 105.51 3n51 n GLY 122 Ca 0.09 -0.29 -0.10 0.00 0.00 0.00 0.00 46.02 45.73 3n51 n GLY 122 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n51 s TYR 123 N -2.21 0.07 -0.06 1.61 2.02 -1.21 -1.31 117.35 116.26 3n51 s TYR 123 Ca 0.02 -0.34 -0.00 0.00 -0.37 0.00 0.00 57.07 56.38 3n51 s TYR 123 Cb 0.08 -0.03 -0.03 0.00 -0.40 0.00 0.00 41.96 41.57 3n51 s TYR 123 CO 0.44 -0.46 -0.01 -0.06 -1.57 0.00 0.00 175.55 173.89 3n51 s PHE 124 N -2.86 3.10 -0.19 2.71 0.08 -0.04 -1.59 117.98 119.21 3n51 s PHE 124 Ca -0.03 0.14 0.01 0.00 0.12 0.00 0.00 56.93 57.17 3n51 s PHE 124 Cb 0.00 -1.74 0.03 0.00 -0.57 0.00 0.00 43.02 40.75 3n51 s PHE 124 CO -0.05 0.45 -0.15 0.71 -0.10 0.00 0.00 175.22 176.08 3n51 s TYR 125 N -0.94 2.65 -0.30 0.36 2.02 0.98 -1.04 117.35 121.08 3n51 s TYR 125 Ca 0.15 -1.66 -0.07 0.00 -0.37 0.00 0.00 57.07 55.12 3n51 s TYR 125 Cb -0.11 -1.78 0.01 0.00 -0.40 0.00 0.00 41.96 39.67 3n51 s TYR 125 CO 0.05 -0.78 0.09 -0.51 -1.57 0.00 0.00 175.55 172.83 3n51 s LEU 126 N 1.32 3.91 -0.23 -1.29 1.43 -0.34 -0.75 118.68 122.73 3n51 s LEU 126 Ca 0.01 -0.71 -0.10 0.00 -1.03 0.00 0.00 54.13 52.30 3n51 s LEU 126 Cb -0.15 -1.89 -0.05 0.00 0.03 0.00 0.00 46.19 44.13 3n51 s LEU 126 CO -0.10 -0.20 0.13 -0.69 0.23 0.00 0.00 176.35 175.72 3n51 s VAL 127 N 1.51 5.14 0.15 -1.59 1.01 0.31 -1.57 120.40 125.35 3n51 s VAL 127 Ca 0.03 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.12 3n51 s VAL 127 Cb -0.17 -3.38 -0.00 0.00 0.00 0.00 0.00 36.38 32.82 3n51 s VAL 127 CO 0.03 0.37 0.18 0.61 0.00 0.00 0.00 175.10 176.29 3n51 n GLY 128 N 4.17 3.04 3.75 4.51 0.00 -0.13 0.35 105.19 120.88 3n51 n GLY 128 Ca -0.15 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 43.85 3n51 n GLY 128 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n51 s GLU 129 N -2.46 4.43 -0.10 1.61 2.12 -0.26 -0.58 118.70 123.47 3n51 s GLU 129 Ca 0.15 2.03 -0.15 0.00 0.36 0.00 0.00 54.97 57.36 3n51 s GLU 129 Cb 0.00 -3.17 -0.05 0.00 0.26 0.00 0.00 34.13 31.17 3n51 s GLU 129 CO 0.11 -0.15 0.37 0.54 -0.54 0.00 0.00 175.26 175.59 3n51 s VAL 130 N -0.35 5.20 -0.07 3.70 0.11 -1.26 -4.53 120.40 123.20 3n51 s VAL 130 Ca 0.53 0.72 0.03 0.00 -2.93 0.00 0.00 61.98 60.33 3n51 s VAL 130 Cb -0.36 -3.69 -0.02 0.00 -1.53 0.00 0.00 36.38 30.78 3n51 s VAL 130 CO 0.41 0.44 -0.16 -0.31 -3.33 0.00 0.00 175.10 172.16 3n51 s TYR 131 N -0.04 2.68 -0.89 1.54 2.02 -1.26 -4.97 117.35 116.43 3n51 s TYR 131 Ca 0.21 -0.41 0.07 0.00 -0.37 0.00 0.00 57.07 56.58 3n51 s TYR 131 Cb -0.15 -1.69 0.08 0.00 -0.40 0.00 0.00 41.96 39.80 3n51 s TYR 131 CO 0.08 -0.01 0.79 0.25 -1.57 0.00 0.00 175.55 175.10 3n51 n THR 132 N 2.79 0.13 1.75 -0.71 -2.24 -1.24 -4.59 114.28 110.17 3n51 n THR 132 Ca -0.17 -0.56 0.14 0.00 -2.27 0.00 0.00 64.05 61.19 3n51 n THR 132 Cb 0.52 1.07 0.72 0.00 -2.10 0.00 0.00 70.33 70.54 3n51 n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n51 n GLY 133 N 0.39 -0.51 3.81 3.38 0.00 -0.14 -4.61 105.19 107.51 3n51 n GLY 133 Ca 0.05 -0.31 0.03 0.00 0.00 0.00 0.00 46.02 45.78 3n51 n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n51 n GLY 134 N 1.07 -1.97 3.76 -0.02 0.00 -1.25 -3.64 105.19 103.14 3n51 n GLY 134 Ca 0.21 -1.37 -0.39 0.00 0.00 0.00 0.00 46.02 44.46 3n51 n GLY 134 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3n51 s GLU 135 N -0.64 4.56 0.20 1.61 2.02 -1.26 -0.40 118.70 124.77 3n51 s GLU 135 Ca 0.00 1.70 -0.15 0.00 0.02 0.00 0.00 54.97 56.54 3n51 s GLU 135 Cb 0.00 -3.05 0.19 0.00 0.10 0.00 0.00 34.13 31.37 3n51 s GLU 135 CO 0.00 0.17 1.64 1.25 0.02 0.00 0.00 175.26 178.33 3n51 h LEU 136 N 3.54 -0.53 -0.99 1.80 5.85 -1.12 -2.59 115.31 121.28 3n51 h LEU 136 Ca -0.47 0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.36 3n51 h LEU 136 Cb 1.21 0.35 -0.02 0.00 0.37 0.00 0.00 40.66 42.57 3n51 h LEU 136 CO 0.66 -0.19 0.06 -0.26 -0.34 0.00 0.00 178.44 178.37 3n51 h PHE 137 N -0.00 0.83 0.00 1.25 -1.00 -1.85 -1.23 116.94 114.94 3n51 h PHE 137 Ca 0.27 -0.10 -0.01 0.00 2.81 0.00 0.00 57.97 60.95 3n51 h PHE 137 Cb 0.41 -0.24 -0.00 0.00 3.61 0.00 0.00 35.95 39.74 3n51 h PHE 137 CO -0.47 0.74 -0.03 -0.44 -1.61 0.00 0.00 178.31 176.50 3n51 h ASP 138 N 0.75 0.00 0.06 2.17 3.32 -1.86 -1.24 116.42 119.62 3n51 h ASP 138 Ca 0.16 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.09 3n51 h ASP 138 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3n51 h ASP 138 CO 0.01 0.03 -0.58 -0.08 -1.72 0.00 0.00 179.24 176.90 3n51 h GLU 139 N 0.00 0.12 -0.88 3.56 4.22 -1.19 -3.39 114.58 117.02 3n51 h GLU 139 Ca -0.00 -0.20 0.04 0.00 0.08 0.00 0.00 59.36 59.28 3n51 h GLU 139 Cb 0.15 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 3n51 h GLU 139 CO 0.00 1.10 0.58 0.82 -2.18 0.00 0.00 179.01 179.33 3n51 h ILE 140 N -0.73 1.13 0.00 2.32 2.04 -0.40 -1.63 117.51 120.25 3n51 h ILE 140 Ca -0.12 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.37 3n51 h ILE 140 Cb 1.32 -0.04 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 3n51 h ILE 140 CO 0.02 0.20 0.00 2.30 0.00 0.00 0.00 178.15 180.67 3n51 n ILE 141 N -4.45 1.10 1.04 -0.67 -5.35 -0.55 -1.69 119.36 108.78 3n51 n ILE 141 Ca 0.12 0.44 0.12 0.00 -0.27 0.00 0.00 62.75 63.15 3n51 n ILE 141 Cb 0.13 -1.37 0.19 0.00 -1.74 0.00 0.00 39.64 36.84 3n51 n ILE 141 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 3n51 n SER 142 N -2.02 0.75 -4.80 7.28 3.41 -0.61 -4.94 113.62 112.68 3n51 n SER 142 Ca 0.01 -0.55 -0.34 0.00 -0.26 0.00 0.00 58.87 57.73 3n51 n SER 142 Cb 0.12 0.38 -0.05 0.00 -0.26 0.00 0.00 64.21 64.41 3n51 n SER 142 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3n51 s ARG 143 N -2.90 4.02 -0.09 4.33 0.52 -0.68 -4.98 118.95 119.17 3n51 s ARG 143 Ca 0.13 1.29 0.07 0.00 -0.52 0.00 0.00 55.73 56.70 3n51 s ARG 143 Cb 0.18 -2.20 -0.24 0.00 0.52 0.00 0.00 34.95 33.21 3n51 s ARG 143 CO 0.70 -0.23 0.47 1.63 0.02 0.00 0.00 175.30 177.88 3n51 n LYS 144 N -0.70 0.68 -4.37 3.54 5.02 -1.26 -4.93 118.16 116.14 3n51 n LYS 144 Ca 0.08 0.25 -0.25 0.00 -2.02 0.00 0.00 58.31 56.37 3n51 n LYS 144 Cb 0.53 -1.73 -0.13 0.00 -0.02 0.00 0.00 35.03 33.68 3n51 n LYS 144 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3n51 s ARG 145 N -2.57 1.21 -0.25 1.97 1.70 -1.26 -5.01 118.95 114.74 3n51 s ARG 145 Ca -0.12 -1.14 -0.09 0.00 -0.47 0.00 0.00 55.73 53.92 3n51 s ARG 145 Cb 0.07 -1.47 0.11 0.00 -0.57 0.00 0.00 34.95 33.10 3n51 s ARG 145 CO 0.80 0.35 0.54 0.12 -1.08 0.00 0.00 175.30 176.02 3n51 s PHE 146 N -1.08 -1.06 0.44 5.89 5.36 -1.26 -5.03 117.98 121.25 3n51 s PHE 146 Ca 0.07 1.92 0.01 0.00 -0.96 0.00 0.00 56.93 57.98 3n51 s PHE 146 Cb -0.10 0.55 0.01 0.00 -0.34 0.00 0.00 43.02 43.15 3n51 s PHE 146 CO 0.04 -0.57 0.11 -1.13 -1.46 0.00 0.00 175.22 172.21 3n51 n SER 147 N 5.35 2.98 0.03 6.13 3.41 -1.26 0.12 113.62 130.37 3n51 n SER 147 Ca -0.11 -2.80 0.01 0.00 -0.26 0.00 0.00 58.87 55.70 3n51 n SER 147 Cb 0.50 0.20 0.33 0.00 -0.26 0.00 0.00 64.21 64.97 3n51 n SER 147 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3n51 h GLU 148 N 0.00 0.45 -0.80 4.33 5.08 -1.91 -1.90 114.58 119.83 3n51 h GLU 148 Ca -0.34 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 57.91 3n51 h GLU 148 Cb 1.08 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.23 3n51 h GLU 148 CO 0.55 0.50 0.45 0.28 -1.00 0.00 0.00 179.01 179.79 3n51 h VAL 149 N 0.44 1.24 -0.24 3.13 2.07 -1.92 0.46 116.25 121.43 3n51 h VAL 149 Ca 0.10 -0.57 -0.05 0.00 0.82 0.00 0.00 66.70 66.99 3n51 h VAL 149 Cb 0.31 0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.23 3n51 h VAL 149 CO 0.01 0.26 -0.04 0.44 0.02 0.00 0.00 177.57 178.26 3n51 h ASP 150 N 1.11 0.44 -0.54 0.57 3.32 -1.77 -1.42 116.42 118.13 3n51 h ASP 150 Ca 0.28 -0.35 0.07 0.00 0.02 0.00 0.00 57.03 57.05 3n51 h ASP 150 Cb 0.02 -0.12 -0.06 0.00 0.22 0.00 0.00 39.33 39.39 3n51 h ASP 150 CO -0.05 0.69 0.23 0.00 -1.72 0.00 0.00 179.24 178.39 3n51 h ALA 151 N 0.77 0.69 -0.52 3.45 0.00 -1.04 -2.38 119.26 120.23 3n51 h ALA 151 Ca 0.06 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 3n51 h ALA 151 Cb 0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 3n51 h ALA 151 CO 0.02 -0.15 0.24 0.00 0.00 0.00 0.00 179.25 179.36 3n51 h ALA 152 N 1.34 0.67 -0.58 0.00 0.00 0.13 -1.28 119.26 119.53 3n51 h ALA 152 Ca 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 3n51 h ALA 152 Cb 0.24 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3n51 h ALA 152 CO -0.23 0.24 0.24 0.00 0.00 0.00 0.00 179.25 179.51 3n51 h ARG 153 N 0.69 0.86 0.08 0.00 3.08 -1.11 0.22 114.38 118.20 3n51 h ARG 153 Ca 0.18 -0.15 0.02 0.00 0.07 0.00 0.00 59.98 60.10 3n51 h ARG 153 Cb 0.13 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.01 3n51 h ARG 153 CO -0.02 0.72 -0.17 0.82 -1.07 0.00 0.00 179.97 180.25 3n51 h ILE 154 N 0.79 0.61 -0.06 2.04 2.04 -1.24 -2.92 117.51 118.77 3n51 h ILE 154 Ca 0.19 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.94 3n51 h ILE 154 Cb 0.18 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 3n51 h ILE 154 CO -0.02 0.00 -0.49 0.40 0.00 0.00 0.00 178.15 178.04 3n51 h ILE 155 N -0.32 1.35 -0.21 -0.67 1.08 -0.90 -2.31 117.51 115.53 3n51 h ILE 155 Ca 0.03 -1.70 -0.02 0.00 -0.39 0.00 0.00 64.86 62.78 3n51 h ILE 155 Cb 0.35 1.84 -0.01 0.00 -3.07 0.00 0.00 36.82 35.93 3n51 h ILE 155 CO -0.11 0.50 0.02 -0.09 -0.69 0.00 0.00 178.15 177.78 3n51 h ARG 156 N 0.13 0.30 -0.20 2.37 2.43 -0.54 -0.84 114.38 118.02 3n51 h ARG 156 Ca 0.00 -0.04 -0.20 0.00 -0.81 0.00 0.00 59.98 58.93 3n51 h ARG 156 Cb 0.91 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.41 3n51 h ARG 156 CO 0.07 0.31 -0.66 1.96 -1.51 0.00 0.00 179.97 180.14 3n51 h GLN 157 N 0.30 0.77 -0.12 0.20 4.20 -1.23 -1.14 115.11 118.09 3n51 h GLN 157 Ca 0.07 -0.56 -0.03 0.00 0.06 0.00 0.00 58.65 58.20 3n51 h GLN 157 Cb 0.18 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.04 3n51 h GLN 157 CO 0.00 1.18 -0.04 0.28 -0.67 0.00 0.00 178.83 179.58 3n51 h VAL 158 N 0.56 1.30 -0.58 -0.54 2.07 -1.21 -2.14 116.25 115.70 3n51 h VAL 158 Ca -0.02 -1.00 -0.03 0.00 0.82 0.00 0.00 66.70 66.47 3n51 h VAL 158 Cb 1.27 1.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.72 3n51 h VAL 158 CO 0.14 0.29 0.24 -0.07 0.02 0.00 0.00 177.57 178.19 3n51 h LEU 159 N -0.08 0.76 -0.07 2.57 3.38 -1.19 -0.73 115.31 119.95 3n51 h LEU 159 Ca 0.03 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3n51 h LEU 159 Cb 0.47 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 3n51 h LEU 159 CO 0.01 0.68 0.04 -1.28 0.09 0.00 0.00 178.44 177.98 3n51 h SER 160 N 0.83 0.09 -0.44 -0.43 0.87 -1.08 0.20 113.55 113.59 3n51 h SER 160 Ca 0.20 -0.10 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 3n51 h SER 160 Cb 0.15 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.06 3n51 h SER 160 CO -0.02 0.16 0.23 1.23 -0.53 0.00 0.00 176.83 177.90 3n51 h GLY 161 N 0.01 0.66 0.95 5.77 0.00 -1.07 -2.50 103.07 106.89 3n51 h GLY 161 Ca 0.02 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 3n51 h GLY 161 CO -0.00 0.29 0.19 -2.22 0.00 0.00 0.00 176.54 174.79 3n51 h ILE 162 N 0.57 1.18 -0.50 2.60 2.04 -1.03 -1.66 117.51 120.70 3n51 h ILE 162 Ca 0.15 -0.51 0.05 0.00 1.00 0.00 0.00 64.86 65.55 3n51 h ILE 162 Cb 0.07 0.77 -0.05 0.00 -0.74 0.00 0.00 36.82 36.87 3n51 h ILE 162 CO -0.02 0.19 0.23 0.74 0.00 0.00 0.00 178.15 179.29 3n51 h THR 163 N 0.51 0.91 -0.80 -0.27 2.02 -0.47 0.32 112.91 115.13 3n51 h THR 163 Ca 0.14 -0.15 -0.02 0.00 0.77 0.00 0.00 66.41 67.15 3n51 h THR 163 Cb 0.13 0.43 -0.04 0.00 -1.74 0.00 0.00 68.15 66.93 3n51 h THR 163 CO -0.02 0.08 0.44 0.22 0.37 0.00 0.00 175.52 176.61 3n51 h TYR 164 N 0.44 1.11 -0.18 3.16 3.20 -1.18 -2.08 116.97 121.45 3n51 h TYR 164 Ca 0.23 -0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.92 3n51 h TYR 164 Cb 0.18 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 38.09 3n51 h TYR 164 CO -0.12 0.77 -0.51 0.52 -1.64 0.00 0.00 178.16 177.18 3n51 h MET 165 N 1.12 0.49 -0.20 1.82 2.86 -0.61 -3.05 114.93 117.36 3n51 h MET 165 Ca 0.28 -0.29 -0.10 0.00 -2.06 0.00 0.00 59.70 57.53 3n51 h MET 165 Cb 0.04 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 3n51 h MET 165 CO -0.04 0.89 -0.30 0.45 1.06 0.00 0.00 176.91 178.97 3n51 h HIS 166 N 0.39 0.45 -0.74 -0.22 3.86 -0.73 -1.10 115.15 117.06 3n51 h HIS 166 Ca 0.01 -0.10 0.11 0.00 -1.16 0.00 0.00 60.37 59.23 3n51 h HIS 166 Cb 1.03 -0.11 -0.05 0.00 1.06 0.00 0.00 27.41 29.34 3n51 h HIS 166 CO 0.04 0.66 0.49 0.87 0.86 0.00 0.00 177.93 180.84 3n51 h LYS 167 N 0.35 0.55 -0.57 2.45 1.57 -1.28 -0.41 116.57 119.24 3n51 h LYS 167 Ca 0.05 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3n51 h LYS 167 Cb 0.70 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.88 3n51 h LYS 167 CO 0.05 0.37 0.00 0.09 -0.57 0.00 0.00 179.45 179.39 3n51 n ASN 168 N -4.49 3.15 -2.40 0.86 3.02 -0.63 -4.93 115.26 109.83 3n51 n ASN 168 Ca 0.13 -2.14 -0.19 0.00 -0.03 0.00 0.00 54.58 52.34 3n51 n ASN 168 Cb 0.39 -0.41 0.01 0.00 -0.61 0.00 0.00 39.78 39.16 3n51 n ASN 168 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3n51 n LYS 169 N 0.91 -2.82 -4.27 3.52 5.02 -0.16 -4.99 118.16 115.36 3n51 n LYS 169 Ca 0.18 0.87 -0.34 0.00 -2.02 0.00 0.00 58.31 57.00 3n51 n LYS 169 Cb 0.55 -5.47 -0.12 0.00 -0.02 0.00 0.00 35.03 29.97 3n51 n LYS 169 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3n51 s ILE 170 N -3.02 4.08 0.03 -0.18 1.01 -0.51 -5.01 121.20 117.61 3n51 s ILE 170 Ca 0.12 -0.29 0.04 0.00 0.00 0.00 0.00 60.65 60.53 3n51 s ILE 170 Cb -0.05 -2.81 -0.03 0.00 0.01 0.00 0.00 42.46 39.57 3n51 s ILE 170 CO 0.15 0.48 -0.08 -0.69 0.00 0.00 0.00 174.94 174.80 3n51 s VAL 171 N 0.46 3.55 -0.15 2.92 1.01 -1.26 -3.73 120.40 123.19 3n51 s VAL 171 Ca -0.02 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 60.94 3n51 s VAL 171 Cb -0.14 -2.57 -0.06 0.00 0.00 0.00 0.00 36.38 33.61 3n51 s VAL 171 CO 0.02 0.32 -0.11 1.57 0.00 0.00 0.00 175.10 176.91 3n51 n HIS 172 N 1.35 0.95 0.00 5.22 -0.00 -1.26 -2.23 115.22 119.26 3n51 n HIS 172 Ca -0.15 0.41 0.00 0.00 0.46 0.00 0.00 57.72 58.45 3n51 n HIS 172 Cb 0.52 -0.84 0.00 0.00 -0.12 0.00 0.00 29.99 29.56 3n51 n HIS 172 CO 0.00 0.00 0.00 -2.13 0.46 0.00 0.00 176.34 174.67 3n51 n ARG 173 N -4.58 0.00 -1.28 1.57 0.63 -1.26 -4.46 116.66 107.28 3n51 n ARG 173 Ca -0.12 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.67 3n51 n ARG 173 Cb 0.34 0.00 0.12 0.00 0.45 0.00 0.00 32.46 33.37 3n51 n ARG 173 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3n51 n ASP 174 N 1.45 3.89 -4.70 6.15 8.00 -1.26 -4.78 116.55 125.31 3n51 n ASP 174 Ca 0.00 -3.80 -0.42 0.00 0.71 0.00 0.00 54.79 51.28 3n51 n ASP 174 Cb 0.00 -0.57 -0.03 0.00 -0.02 0.00 0.00 41.12 40.51 3n51 n ASP 174 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3n51 s LEU 175 N -3.45 4.36 0.23 0.64 2.96 -1.26 -4.91 118.68 117.25 3n51 s LEU 175 Ca 0.49 2.43 -0.22 0.00 -0.22 0.00 0.00 54.13 56.60 3n51 s LEU 175 Cb 0.42 -3.57 0.04 0.00 0.50 0.00 0.00 46.19 43.57 3n51 s LEU 175 CO 0.00 -0.81 0.67 -1.59 -1.32 0.00 0.00 176.35 173.31 3n51 s LYS 176 N 2.00 1.58 0.34 1.98 -2.85 -1.26 -4.81 119.74 116.72 3n51 s LYS 176 Ca 0.70 -0.78 0.08 0.00 -1.00 0.00 0.00 55.97 54.97 3n51 s LYS 176 Cb -0.39 0.60 0.80 0.00 -2.06 0.00 0.00 37.83 36.79 3n51 s LYS 176 CO 0.31 -0.71 1.83 -1.35 0.10 0.00 0.00 175.35 175.52 3n51 h PRO 177 N 2.00 0.69 0.00 1.78 0.11 -1.95 -0.46 132.00 134.16 3n51 h PRO 177 Ca -0.25 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.82 3n51 h PRO 177 Cb 1.27 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3n51 h PRO 177 CO 0.29 0.46 -0.00 1.49 -0.21 0.00 0.00 178.00 180.02 3n51 h GLU 178 N 0.71 0.00 -0.52 1.05 4.81 -1.97 -0.71 114.58 117.96 3n51 h GLU 178 Ca 0.51 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.74 3n51 h GLU 178 Cb 0.85 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.23 3n51 h GLU 178 CO -0.27 0.00 0.00 0.09 -0.73 0.00 0.00 179.01 178.10 3n51 n ASN 179 N -3.23 2.95 -4.15 1.04 3.02 -0.18 -4.72 115.26 109.99 3n51 n ASN 179 Ca -0.03 -1.98 -0.37 0.00 -0.03 0.00 0.00 54.58 52.17 3n51 n ASN 179 Cb 0.09 -0.34 -0.11 0.00 -0.61 0.00 0.00 39.78 38.81 3n51 n ASN 179 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3n51 s LEU 180 N -1.09 5.25 0.18 3.41 1.43 -0.27 -1.04 118.68 126.54 3n51 s LEU 180 Ca 0.37 -1.93 -0.01 0.00 -1.03 0.00 0.00 54.13 51.53 3n51 s LEU 180 Cb 0.20 -1.87 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 3n51 s LEU 180 CO 0.26 -0.56 0.37 -0.76 0.23 0.00 0.00 176.35 175.90 3n51 s LEU 181 N 1.21 4.25 -0.00 1.79 1.43 -0.54 -0.68 118.68 126.14 3n51 s LEU 181 Ca 0.07 0.42 -0.01 0.00 -1.03 0.00 0.00 54.13 53.58 3n51 s LEU 181 Cb -0.23 -3.18 -0.04 0.00 0.03 0.00 0.00 46.19 42.77 3n51 s LEU 181 CO -0.03 -0.00 0.12 -0.76 0.23 0.00 0.00 176.35 175.91 3n51 s LEU 182 N -3.11 4.07 0.43 1.79 1.43 0.46 -0.26 118.68 123.50 3n51 s LEU 182 Ca 0.39 0.22 0.24 0.00 -1.03 0.00 0.00 54.13 53.94 3n51 s LEU 182 Cb -0.11 -2.41 0.82 0.00 0.03 0.00 0.00 46.19 44.51 3n51 s LEU 182 CO 0.28 0.26 1.78 -0.33 0.23 0.00 0.00 176.35 178.57 3n51 h GLU 183 N 3.96 0.00 -2.99 1.70 5.08 -1.63 -0.34 114.58 120.35 3n51 h GLU 183 Ca -0.49 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.78 3n51 h GLU 183 Cb 1.18 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 30.25 3n51 h GLU 183 CO 0.65 0.22 -0.16 -1.54 -1.00 0.00 0.00 179.01 177.19 3n51 s SER 184 N -6.18 -0.26 -1.18 1.42 1.04 -1.26 -3.74 113.70 103.54 3n51 s SER 184 Ca 0.01 0.05 -0.21 0.00 0.48 0.00 0.00 55.95 56.29 3n51 s SER 184 Cb 0.09 0.39 -0.04 0.00 0.10 0.00 0.00 66.02 66.56 3n51 s SER 184 CO 0.64 -0.58 1.90 1.17 0.98 0.00 0.00 173.24 177.35 3n51 n LYS 185 N 0.79 2.13 -3.64 4.02 4.81 -1.24 -4.54 118.16 120.49 3n51 n LYS 185 Ca -0.19 -2.62 -0.15 0.00 -0.87 0.00 0.00 58.31 54.47 3n51 n LYS 185 Cb 0.58 -3.51 -0.07 0.00 0.02 0.00 0.00 35.03 32.04 3n51 n LYS 185 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3n51 s SER 186 N 5.38 -0.48 0.51 3.14 0.15 -1.26 -5.03 113.70 116.10 3n51 s SER 186 Ca 0.61 0.59 0.33 0.00 0.70 0.00 0.00 55.95 58.18 3n51 s SER 186 Cb 0.04 0.59 1.38 0.00 -1.71 0.00 0.00 66.02 66.32 3n51 s SER 186 CO 0.10 -0.46 1.96 0.07 1.20 0.00 0.00 173.24 176.11 3n51 h LYS 187 N 3.81 0.00 -0.00 5.44 2.10 -1.96 -2.91 116.57 123.05 3n51 h LYS 187 Ca -0.28 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.37 3n51 h LYS 187 Cb 1.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.49 3n51 h LYS 187 CO 0.34 0.00 -0.44 -0.25 -2.00 0.00 0.00 179.45 177.10 3n51 n ASP 188 N -2.93 0.45 -4.80 7.07 8.00 -1.26 -4.98 116.55 118.10 3n51 n ASP 188 Ca 0.01 -0.17 -0.33 0.00 0.71 0.00 0.00 54.79 55.00 3n51 n ASP 188 Cb 0.27 0.16 -0.00 0.00 -0.02 0.00 0.00 41.12 41.53 3n51 n ASP 188 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n51 s ALA 189 N -2.99 2.76 0.38 2.24 0.00 -1.10 -5.01 121.76 118.03 3n51 s ALA 189 Ca 0.12 0.49 -0.26 0.00 0.00 0.00 0.00 51.96 52.30 3n51 s ALA 189 Cb 0.18 -3.25 -0.09 0.00 0.00 0.00 0.00 23.12 19.96 3n51 s ALA 189 CO 0.68 -0.70 1.15 -0.80 0.00 0.00 0.00 175.76 176.09 3n51 s ASN 190 N -2.50 6.69 -0.04 0.00 -0.87 -1.26 -4.83 114.94 112.13 3n51 s ASN 190 Ca 0.65 2.32 -0.19 0.00 -1.57 0.00 0.00 52.86 54.07 3n51 s ASN 190 Cb -0.17 -2.61 -0.05 0.00 -0.02 0.00 0.00 41.25 38.40 3n51 s ASN 190 CO 0.32 -0.56 0.53 -0.63 -2.57 0.00 0.00 177.10 174.19 3n51 s ILE 191 N -1.39 5.02 -0.15 0.60 1.01 -1.26 -1.62 121.20 123.40 3n51 s ILE 191 Ca 0.55 1.09 0.02 0.00 0.00 0.00 0.00 60.65 62.30 3n51 s ILE 191 Cb -0.30 -3.86 0.01 0.00 0.01 0.00 0.00 42.46 38.32 3n51 s ILE 191 CO 0.38 0.41 -0.20 -0.13 0.00 0.00 0.00 174.94 175.41 3n51 s ARG 192 N -0.07 3.07 -0.09 2.79 1.81 0.65 -4.17 118.95 122.95 3n51 s ARG 192 Ca 0.28 -0.82 -0.28 0.00 -1.72 0.00 0.00 55.73 53.19 3n51 s ARG 192 Cb -0.17 -2.52 -0.02 0.00 -0.45 0.00 0.00 34.95 31.80 3n51 s ARG 192 CO 0.14 -0.04 0.94 0.42 -0.68 0.00 0.00 175.30 176.08 3n51 s ILE 193 N 0.91 4.84 0.17 1.52 1.01 0.77 -1.46 121.20 128.95 3n51 s ILE 193 Ca -0.04 1.93 0.05 0.00 0.00 0.00 0.00 60.65 62.58 3n51 s ILE 193 Cb -0.15 -4.26 -0.04 0.00 0.01 0.00 0.00 42.46 38.02 3n51 s ILE 193 CO -0.03 0.07 0.13 0.27 0.00 0.00 0.00 174.94 175.37 3n51 s ILE 194 N 1.68 4.44 0.00 2.92 -4.36 -0.21 -1.66 121.20 124.01 3n51 s ILE 194 Ca 0.47 -1.11 0.00 0.00 -0.26 0.00 0.00 60.65 59.75 3n51 s ILE 194 Cb -0.19 -3.27 0.00 0.00 1.25 0.00 0.00 42.46 40.26 3n51 s ILE 194 CO 0.19 -0.11 0.00 0.47 0.24 0.00 0.00 174.94 175.73 3n51 n ASP 195 N -0.34 -2.73 -4.63 4.36 8.00 -1.26 -4.85 116.55 115.09 3n51 n ASP 195 Ca -0.08 0.00 -0.46 0.00 0.71 0.00 0.00 54.79 54.95 3n51 n ASP 195 Cb 0.55 -0.46 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 3n51 n ASP 195 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3n51 n PHE 196 N -2.91 1.80 0.00 1.24 3.72 -1.26 -2.42 117.46 117.63 3n51 n PHE 196 Ca 0.00 0.53 0.00 0.00 -0.05 0.00 0.00 57.45 57.93 3n51 n PHE 196 Cb 0.00 -2.39 0.00 0.00 -0.94 0.00 0.00 39.48 36.16 3n51 n PHE 196 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n51 n GLY 197 N 2.11 2.92 0.29 1.37 0.00 -0.94 -4.89 105.19 106.05 3n51 n GLY 197 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.09 3n51 n GLY 197 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3n51 h LEU 198 N 0.00 0.87 -1.78 0.99 3.38 -1.75 -3.15 115.31 113.86 3n51 h LEU 198 Ca 0.00 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.71 3n51 h LEU 198 Cb 0.00 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.51 3n51 h LEU 198 CO 0.00 0.95 -0.11 0.77 0.09 0.00 0.00 178.44 180.14 3n51 h SER 199 N 0.82 0.00 0.29 -0.43 4.64 -1.79 -1.27 113.55 115.81 3n51 h SER 199 Ca 0.15 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.42 3n51 h SER 199 Cb 0.53 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.61 3n51 h SER 199 CO 0.03 0.11 -0.23 0.74 -0.87 0.00 0.00 176.83 176.60 3n51 h THR 200 N 0.00 1.06 0.00 2.95 2.02 -1.86 -3.34 112.91 113.74 3n51 h THR 200 Ca -0.00 -0.83 0.00 0.00 0.77 0.00 0.00 66.41 66.34 3n51 h THR 200 Cb 0.42 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 3n51 h THR 200 CO 0.01 0.23 -0.55 1.41 0.37 0.00 0.00 175.52 176.99 3n51 n HIS 201 N -4.10 0.00 -4.32 3.16 8.25 -0.56 -4.60 115.22 113.04 3n51 n HIS 201 Ca -0.02 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.24 3n51 n HIS 201 Cb 0.30 -0.04 -0.15 0.00 1.12 0.00 0.00 29.99 31.22 3n51 n HIS 201 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3n51 s PHE 202 N -1.75 0.85 0.08 4.41 0.08 -0.71 0.11 117.98 121.05 3n51 s PHE 202 Ca 0.01 -0.21 -0.27 0.00 0.12 0.00 0.00 56.93 56.58 3n51 s PHE 202 Cb 0.04 -0.63 -0.06 0.00 -0.57 0.00 0.00 43.02 41.80 3n51 s PHE 202 CO 0.21 -0.10 0.85 -1.21 -0.10 0.00 0.00 175.22 174.86 3n51 s GLU 203 N 0.27 4.59 0.38 0.44 2.02 -0.57 -4.58 118.70 121.24 3n51 s GLU 203 Ca -0.04 1.23 -0.26 0.00 0.02 0.00 0.00 54.97 55.92 3n51 s GLU 203 Cb -0.09 -3.36 -0.09 0.00 0.10 0.00 0.00 34.13 30.69 3n51 s GLU 203 CO 0.00 0.28 1.14 0.00 0.02 0.00 0.00 175.26 176.70 3n51 s ALA 204 N -0.11 3.19 0.53 5.21 0.00 -1.26 -4.60 121.76 124.71 3n51 s ALA 204 Ca 0.42 0.92 -0.18 0.00 0.00 0.00 0.00 51.96 53.11 3n51 s ALA 204 Cb -0.22 -3.36 -0.07 0.00 0.00 0.00 0.00 23.12 19.48 3n51 s ALA 204 CO 0.26 -0.42 1.03 -1.54 0.00 0.00 0.00 175.76 175.10 3n51 s SER 205 N -1.15 6.20 0.00 0.00 1.04 -1.26 -4.97 113.70 113.56 3n51 s SER 205 Ca 0.55 1.83 0.22 0.00 0.48 0.00 0.00 55.95 59.03 3n51 s SER 205 Cb -0.30 -2.54 0.60 0.00 0.10 0.00 0.00 66.02 63.88 3n51 s SER 205 CO 0.37 -0.88 1.51 0.29 0.98 0.00 0.00 173.24 175.51 3n51 n LYS 206 N -1.42 2.71 -2.44 4.02 5.02 -1.26 -4.82 118.16 119.96 3n51 n LYS 206 Ca 0.09 -2.59 -0.41 0.00 -2.02 0.00 0.00 58.31 53.38 3n51 n LYS 206 Cb 0.53 -1.55 -0.03 0.00 -0.02 0.00 0.00 35.03 33.96 3n51 n LYS 206 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3n51 s LYS 207 N -1.06 4.50 0.29 1.97 1.02 -1.26 -4.95 119.74 120.25 3n51 s LYS 207 Ca 0.46 1.78 0.00 0.00 0.02 0.00 0.00 55.97 58.23 3n51 s LYS 207 Cb 0.24 -3.30 0.44 0.00 -0.52 0.00 0.00 37.83 34.70 3n51 s LYS 207 CO 0.32 -0.10 1.82 1.98 -0.92 0.00 0.00 175.35 178.45 3n51 h MET 208 N 5.83 0.72 -0.87 1.68 1.85 -1.94 -1.76 114.93 120.44 3n51 h MET 208 Ca -0.43 -0.16 0.25 0.00 -0.61 0.00 0.00 59.70 58.74 3n51 h MET 208 Cb 1.21 -0.10 -0.04 0.00 0.43 0.00 0.00 31.60 33.11 3n51 h MET 208 CO 0.76 0.70 0.62 1.57 -0.40 0.00 0.00 176.91 180.17 3n51 h LYS 209 N 0.69 0.03 0.00 0.39 2.10 -1.94 -1.98 116.57 115.86 3n51 h LYS 209 Ca 0.15 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.79 3n51 h LYS 209 Cb 0.35 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.68 3n51 h LYS 209 CO 0.01 0.02 -0.69 -0.44 -2.00 0.00 0.00 179.45 176.35 3n51 h ASP 210 N 0.03 0.00 0.00 7.07 3.32 -1.69 -3.39 116.42 121.76 3n51 h ASP 210 Ca 0.42 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.35 3n51 h ASP 210 Cb 1.62 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 41.11 3n51 h ASP 210 CO -0.02 0.04 -0.48 2.29 -1.72 0.00 0.00 179.24 179.36 3n51 n LYS 211 N -2.48 1.14 -2.22 3.56 2.85 -0.75 -4.98 118.16 115.28 3n51 n LYS 211 Ca 0.02 -2.76 -0.42 0.00 -1.05 0.00 0.00 58.31 54.10 3n51 n LYS 211 Cb 0.50 -1.24 -0.03 0.00 -0.65 0.00 0.00 35.03 33.60 3n51 n LYS 211 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 3n51 s ILE 212 N -2.39 3.49 0.00 0.58 -1.09 -1.17 -2.06 121.20 118.56 3n51 s ILE 212 Ca 0.33 1.04 0.00 0.00 -2.23 0.00 0.00 60.65 59.80 3n51 s ILE 212 Cb 0.33 -3.67 0.00 0.00 -1.58 0.00 0.00 42.46 37.54 3n51 s ILE 212 CO -0.06 0.07 0.00 0.61 -1.23 0.00 0.00 174.94 174.33 3n51 n GLY 213 N 3.48 2.74 0.34 6.18 0.00 -1.26 -4.89 105.19 111.77 3n51 n GLY 213 Ca 0.11 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.19 3n51 n GLY 213 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3n51 h THR 214 N 0.00 1.06 -0.01 2.61 1.35 -1.80 -2.78 112.91 113.34 3n51 h THR 214 Ca 0.00 -0.23 -0.03 0.00 -0.55 0.00 0.00 66.41 65.60 3n51 h THR 214 Cb 0.00 0.32 -0.00 0.00 -1.73 0.00 0.00 68.15 66.74 3n51 h THR 214 CO 0.00 0.12 -0.12 0.00 -0.25 0.00 0.00 175.52 175.28 3n51 h ALA 215 N 1.66 1.79 -0.15 6.62 0.00 -1.90 -2.82 119.26 124.46 3n51 h ALA 215 Ca 0.24 -0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3n51 h ALA 215 Cb 0.12 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3n51 h ALA 215 CO -0.07 0.16 -0.19 1.88 0.00 0.00 0.00 179.25 181.03 3n51 h TYR 216 N 0.01 0.27 0.00 0.00 0.05 -1.79 -3.31 116.97 112.20 3n51 h TYR 216 Ca 0.00 -0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.74 3n51 h TYR 216 Cb 0.22 -0.07 0.00 0.00 1.01 0.00 0.00 36.73 37.89 3n51 h TYR 216 CO 0.00 0.44 -0.83 0.66 -1.05 0.00 0.00 178.16 177.38 3n51 n TYR 217 N -4.22 0.00 -2.52 4.88 4.01 -1.07 -4.78 117.16 113.47 3n51 n TYR 217 Ca -0.01 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.32 3n51 n TYR 217 Cb 0.32 -0.06 -0.04 0.00 -0.31 0.00 0.00 39.34 39.25 3n51 n TYR 217 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 3n51 s ILE 218 N -2.41 3.90 0.37 -0.72 2.07 -1.20 -3.89 121.20 119.32 3n51 s ILE 218 Ca 0.03 1.63 -0.26 0.00 -1.41 0.00 0.00 60.65 60.65 3n51 s ILE 218 Cb 0.10 -4.04 -0.09 0.00 0.13 0.00 0.00 42.46 38.56 3n51 s ILE 218 CO 0.56 0.28 1.14 0.00 -1.91 0.00 0.00 174.94 175.01 3n51 s ALA 219 N -0.22 3.21 0.38 1.50 0.00 -1.26 -4.94 121.76 120.44 3n51 s ALA 219 Ca 0.49 0.91 0.06 0.00 0.00 0.00 0.00 51.96 53.42 3n51 s ALA 219 Cb -0.29 -3.35 0.78 0.00 0.00 0.00 0.00 23.12 20.26 3n51 s ALA 219 CO 0.35 -0.39 2.02 -1.35 0.00 0.00 0.00 175.76 176.38 3n51 h PRO 220 N 2.90 0.66 0.00 0.00 0.11 -1.93 -1.22 132.00 132.51 3n51 h PRO 220 Ca -0.48 -0.04 -0.02 0.00 0.11 0.00 0.00 66.00 65.57 3n51 h PRO 220 Cb 1.23 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 3n51 h PRO 220 CO 0.64 0.44 -0.08 1.05 -0.21 0.00 0.00 178.00 179.84 3n51 h GLU 221 N 0.68 0.00 -0.35 1.05 9.09 -1.90 -2.00 114.58 121.15 3n51 h GLU 221 Ca 0.22 0.00 -0.15 0.00 0.05 0.00 0.00 59.36 59.48 3n51 h GLU 221 Cb 0.04 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.14 3n51 h GLU 221 CO -0.06 0.08 -0.38 0.28 0.05 0.00 0.00 179.01 178.98 3n51 h VAL 222 N 0.00 1.28 -0.89 -1.06 2.07 -1.44 -2.03 116.25 114.18 3n51 h VAL 222 Ca -0.00 -1.55 0.10 0.00 0.82 0.00 0.00 66.70 66.06 3n51 h VAL 222 Cb 0.60 1.47 -0.06 0.00 -1.52 0.00 0.00 31.29 31.77 3n51 h VAL 222 CO 0.01 0.51 0.57 -0.07 0.02 0.00 0.00 177.57 178.62 3n51 h LEU 223 N 0.66 0.80 0.00 2.57 3.38 -1.27 -2.88 115.31 118.57 3n51 h LEU 223 Ca 0.05 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3n51 h LEU 223 Cb 0.97 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.57 3n51 h LEU 223 CO 0.09 0.47 -0.68 1.41 0.09 0.00 0.00 178.44 179.82 3n51 n HIS 224 N -4.53 0.14 0.00 1.13 8.25 -1.09 -5.00 115.22 114.13 3n51 n HIS 224 Ca 0.15 0.04 0.00 0.00 -0.26 0.00 0.00 57.72 57.65 3n51 n HIS 224 Cb 0.30 -0.33 0.00 0.00 1.12 0.00 0.00 29.99 31.08 3n51 n HIS 224 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n51 n GLY 225 N 1.45 1.55 3.47 -1.41 0.00 -0.77 -5.05 105.19 104.42 3n51 n GLY 225 Ca 0.04 -0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.51 3n51 n GLY 225 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3n51 s THR 226 N -1.58 5.09 0.06 2.61 2.01 -1.16 -4.95 115.64 117.72 3n51 s THR 226 Ca 0.00 -0.47 -0.06 0.00 0.31 0.00 0.00 61.69 61.47 3n51 s THR 226 Cb 0.00 -4.07 -0.01 0.00 0.01 0.00 0.00 72.50 68.42 3n51 s THR 226 CO 0.00 -0.48 0.10 -0.72 -0.69 0.00 0.00 174.62 172.83 3n51 s TYR 227 N 2.10 0.26 0.00 4.92 -0.85 -1.26 -4.47 117.35 118.04 3n51 s TYR 227 Ca 0.11 -0.67 0.00 0.00 -0.52 0.00 0.00 57.07 55.99 3n51 s TYR 227 Cb -0.18 -0.17 0.00 0.00 0.38 0.00 0.00 41.96 41.98 3n51 s TYR 227 CO 0.12 -0.43 0.00 -0.40 -1.52 0.00 0.00 175.55 173.32 3n51 n ASP 228 N 0.31 0.00 0.29 -0.18 5.68 -1.26 -5.04 116.55 116.35 3n51 n ASP 228 Ca -0.16 -0.60 0.18 0.00 -0.50 0.00 0.00 54.79 53.71 3n51 n ASP 228 Cb 0.60 0.00 0.99 0.00 -1.14 0.00 0.00 41.12 41.57 3n51 n ASP 228 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 3n51 h GLU 229 N 0.00 0.00 -0.05 0.11 9.09 -1.99 -2.25 114.58 119.49 3n51 h GLU 229 Ca 0.00 0.00 0.01 0.00 0.05 0.00 0.00 59.36 59.42 3n51 h GLU 229 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 27.10 3n51 h GLU 229 CO 0.00 0.00 0.07 0.87 0.05 0.00 0.00 179.01 180.00 3n51 h LYS 230 N 0.00 0.00 -0.05 1.06 1.79 -1.95 -1.62 116.57 115.80 3n51 h LYS 230 Ca 0.02 0.00 0.01 0.00 -2.18 0.00 0.00 60.65 58.51 3n51 h LYS 230 Cb 0.20 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.85 3n51 h LYS 230 CO -0.00 0.00 0.04 0.00 -1.08 0.00 0.00 179.45 178.41 3n51 h ASP 232 N 0.00 0.00 -0.42 0.00 3.32 -1.53 -2.26 116.42 115.53 3n51 h ASP 232 Ca 0.02 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.95 3n51 h ASP 232 Cb 0.09 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3n51 h ASP 232 CO -0.00 0.49 -0.21 0.58 -1.72 0.00 0.00 179.24 178.38 3n51 h VAL 233 N 0.00 1.28 0.32 -1.35 2.07 -1.43 -2.11 116.25 115.01 3n51 h VAL 233 Ca -0.00 -1.36 -0.01 0.00 0.82 0.00 0.00 66.70 66.15 3n51 h VAL 233 Cb 1.09 1.25 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 3n51 h VAL 233 CO 0.06 0.46 -0.18 -0.25 0.02 0.00 0.00 177.57 177.68 3n51 h TRP 234 N 0.71 -0.46 -0.94 1.57 2.91 -1.24 -0.34 115.95 118.15 3n51 h TRP 234 Ca 0.09 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.18 3n51 h TRP 234 Cb 0.77 0.16 -0.07 0.00 -0.51 0.00 0.00 29.16 29.52 3n51 h TRP 234 CO 0.06 -0.28 0.59 0.77 -1.03 0.00 0.00 178.44 178.54 3n51 h SER 235 N -0.47 0.91 -0.58 2.65 0.02 -1.46 -0.85 113.55 113.78 3n51 h SER 235 Ca -0.04 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 3n51 h SER 235 Cb 0.38 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 3n51 h SER 235 CO 0.05 0.56 0.20 0.74 -1.14 0.00 0.00 176.83 177.24 3n51 h THR 236 N 1.03 1.23 -0.47 -2.27 2.02 -1.11 -1.82 112.91 111.53 3n51 h THR 236 Ca 0.42 -0.77 -0.06 0.00 0.77 0.00 0.00 66.41 66.77 3n51 h THR 236 Cb 0.25 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 3n51 h THR 236 CO -0.20 0.30 0.05 1.23 0.37 0.00 0.00 175.52 177.27 3n51 h GLY 237 N 1.01 0.80 0.94 2.16 0.00 0.09 0.57 103.07 108.64 3n51 h GLY 237 Ca 0.20 -0.49 -0.06 0.00 0.00 0.00 0.00 47.33 46.99 3n51 h GLY 237 CO -0.01 0.46 0.02 -2.08 0.00 0.00 0.00 176.54 174.93 3n51 h VAL 238 N 0.71 1.25 -0.87 4.60 2.07 -0.85 -1.42 116.25 121.74 3n51 h VAL 238 Ca 0.15 -0.96 -0.02 0.00 0.82 0.00 0.00 66.70 66.69 3n51 h VAL 238 Cb 0.36 1.09 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 3n51 h VAL 238 CO 0.01 0.33 0.47 0.40 0.02 0.00 0.00 177.57 178.80 3n51 h ILE 239 N 0.53 1.26 -0.15 4.57 2.04 -0.94 -1.74 117.51 123.08 3n51 h ILE 239 Ca 0.12 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.31 3n51 h ILE 239 Cb 0.44 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 3n51 h ILE 239 CO 0.02 0.29 0.02 0.25 0.00 0.00 0.00 178.15 178.72 3n51 h LEU 240 N 1.22 0.25 -0.78 1.44 5.85 -0.72 -1.25 115.31 121.34 3n51 h LEU 240 Ca 0.31 -0.28 0.18 0.00 0.84 0.00 0.00 57.88 58.92 3n51 h LEU 240 Cb 0.04 -0.07 -0.12 0.00 0.37 0.00 0.00 40.66 40.89 3n51 h LEU 240 CO -0.05 0.47 0.21 0.22 -0.34 0.00 0.00 178.44 178.96 3n51 h TYR 241 N 0.03 0.34 -0.41 1.25 3.20 -1.08 -2.18 116.97 118.12 3n51 h TYR 241 Ca 0.05 0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.85 3n51 h TYR 241 Cb 0.33 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.56 3n51 h TYR 241 CO 0.02 -0.09 -0.20 0.82 -1.64 0.00 0.00 178.16 177.08 3n51 h ILE 242 N 0.28 1.27 -0.42 1.81 2.04 -0.88 -2.03 117.51 119.59 3n51 h ILE 242 Ca 0.45 -1.31 -0.03 0.00 1.00 0.00 0.00 64.86 64.98 3n51 h ILE 242 Cb 0.80 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 38.02 3n51 h ILE 242 CO -0.53 0.44 0.13 -0.07 0.00 0.00 0.00 178.15 178.12 3n51 h LEU 243 N 0.71 0.56 0.00 1.44 3.38 -0.64 0.66 115.31 121.41 3n51 h LEU 243 Ca 0.10 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3n51 h LEU 243 Cb 0.71 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.32 3n51 h LEU 243 CO 0.05 0.54 -1.19 0.18 0.09 0.00 0.00 178.44 178.11 3n51 n LEU 244 N -4.34 0.61 0.00 1.67 4.77 -0.92 -4.47 117.00 114.32 3n51 n LEU 244 Ca 0.03 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.19 3n51 n LEU 244 Cb 0.18 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 3n51 n LEU 244 CO 0.38 -0.09 -0.37 -1.54 -1.33 0.00 0.00 177.39 174.44 3n51 n SER 245 N -2.40 3.67 0.00 -1.43 3.41 -0.77 -4.81 113.62 111.28 3n51 n SER 245 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3n51 n SER 245 Cb 0.52 0.72 0.00 0.00 -0.26 0.00 0.00 64.21 65.20 3n51 n SER 245 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3n51 n GLY 246 N 1.85 0.82 3.02 5.00 0.00 0.23 -4.27 105.19 111.84 3n51 n GLY 246 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 3n51 n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n51 s PRO 248 N 0.10 4.25 0.29 0.00 0.02 -1.26 -4.18 135.00 134.22 3n51 s PRO 248 Ca -0.02 2.24 -0.00 0.00 0.02 0.00 0.00 61.00 63.24 3n51 s PRO 248 Cb -0.08 -2.99 0.44 0.00 0.02 0.00 0.00 34.50 31.89 3n51 s PRO 248 CO 0.00 -0.29 1.85 -1.00 -0.33 0.00 0.00 177.00 177.23 3n51 h PRO 249 N 3.18 0.81 -4.67 5.54 0.13 -1.92 -3.37 132.00 131.71 3n51 h PRO 249 Ca -0.49 -0.15 -0.69 0.00 -0.87 0.00 0.00 66.00 63.79 3n51 h PRO 249 Cb 1.23 -0.13 -0.32 0.00 0.13 0.00 0.00 31.00 31.92 3n51 h PRO 249 CO 0.65 0.71 -0.63 -0.06 -0.23 0.00 0.00 178.00 178.44 3n51 s PHE 250 N -5.25 3.33 0.18 1.56 0.08 -1.26 -4.77 117.98 111.85 3n51 s PHE 250 Ca -0.10 -1.84 0.04 0.00 0.12 0.00 0.00 56.93 55.16 3n51 s PHE 250 Cb 0.16 -2.43 -0.05 0.00 -0.57 0.00 0.00 43.02 40.13 3n51 s PHE 250 CO 0.79 -0.82 -0.06 1.21 -0.10 0.00 0.00 175.22 176.24 3n51 s ASN 251 N 1.46 1.81 0.00 1.36 3.84 -1.26 -4.76 114.94 117.39 3n51 s ASN 251 Ca -0.01 -1.10 0.00 0.00 0.21 0.00 0.00 52.86 51.96 3n51 s ASN 251 Cb -0.20 -0.00 0.00 0.00 -0.55 0.00 0.00 41.25 40.49 3n51 s ASN 251 CO -0.00 -0.40 0.00 0.61 -2.79 0.00 0.00 177.10 174.51 3n51 n GLY 252 N -0.29 0.55 0.05 1.21 0.00 -1.26 -4.56 105.19 100.90 3n51 n GLY 252 Ca -0.08 -0.82 0.14 0.00 0.00 0.00 0.00 46.02 45.26 3n51 n GLY 252 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n51 n ALA 253 N -0.10 2.69 -3.81 4.61 0.00 -1.26 -4.75 120.51 117.88 3n51 n ALA 253 Ca 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 53.44 53.21 3n51 n ALA 253 Cb 0.00 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.07 3n51 n ALA 253 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3n51 s ASN 254 N -2.63 -0.07 0.12 0.00 2.20 -1.26 -3.83 114.94 109.47 3n51 s ASN 254 Ca 0.25 -0.48 -0.20 0.00 -0.94 0.00 0.00 52.86 51.49 3n51 s ASN 254 Cb 0.20 0.43 -0.04 0.00 -2.00 0.00 0.00 41.25 39.83 3n51 s ASN 254 CO 0.50 -0.82 1.71 -0.08 -2.94 0.00 0.00 177.10 175.47 3n51 h GLU 255 N 2.00 0.01 -0.60 3.55 4.81 -1.89 -2.45 114.58 120.01 3n51 h GLU 255 Ca -0.26 -0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.00 3n51 h GLU 255 Cb 1.22 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.55 3n51 h GLU 255 CO 0.31 0.01 0.35 -0.92 -0.73 0.00 0.00 179.01 178.03 3n51 h TYR 256 N 0.01 0.66 -0.88 0.92 3.20 -1.97 -1.45 116.97 117.46 3n51 h TYR 256 Ca 0.08 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 3n51 h TYR 256 Cb 0.12 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 38.14 3n51 h TYR 256 CO -0.19 0.36 0.50 -0.44 -1.64 0.00 0.00 178.16 176.75 3n51 h ASP 257 N 0.69 1.08 0.09 -2.11 3.32 -1.87 -0.58 116.42 117.03 3n51 h ASP 257 Ca 0.25 -0.09 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 3n51 h ASP 257 Cb 0.07 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.35 3n51 h ASP 257 CO -0.13 0.85 -0.04 0.40 -1.72 0.00 0.00 179.24 178.61 3n51 h ILE 258 N 1.22 1.09 -0.66 0.35 2.04 -1.03 -2.77 117.51 117.74 3n51 h ILE 258 Ca 0.31 -0.66 0.06 0.00 1.00 0.00 0.00 64.86 65.58 3n51 h ILE 258 Cb -0.01 1.51 -0.04 0.00 -0.74 0.00 0.00 36.82 37.55 3n51 h ILE 258 CO -0.05 0.16 0.44 -0.07 0.00 0.00 0.00 178.15 178.62 3n51 h LEU 259 N -0.42 0.59 -0.97 1.44 3.38 -1.07 -0.70 115.31 117.56 3n51 h LEU 259 Ca -0.01 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 3n51 h LEU 259 Cb 0.35 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3n51 h LEU 259 CO 0.02 0.39 -0.08 0.50 0.09 0.00 0.00 178.44 179.35 3n51 h LYS 260 N 0.67 0.65 -0.13 1.13 3.64 -1.06 0.22 116.57 121.69 3n51 h LYS 260 Ca 0.28 -0.19 -0.21 0.00 -1.27 0.00 0.00 60.65 59.26 3n51 h LYS 260 Cb 0.26 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.01 3n51 h LYS 260 CO -0.09 0.73 -0.76 0.87 -2.27 0.00 0.00 179.45 177.94 3n51 h LYS 261 N 0.60 0.67 -0.26 1.90 1.57 -0.93 -2.41 116.57 117.72 3n51 h LYS 261 Ca 0.11 -0.54 -0.01 0.00 -1.87 0.00 0.00 60.65 58.33 3n51 h LYS 261 Cb 0.50 0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 3n51 h LYS 261 CO 0.03 1.16 0.11 0.28 -0.57 0.00 0.00 179.45 180.46 3n51 h VAL 262 N 0.46 1.16 -0.93 0.50 2.07 -0.91 -0.26 116.25 118.34 3n51 h VAL 262 Ca -0.04 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.00 3n51 h VAL 262 Cb 1.37 1.00 -0.05 0.00 -1.52 0.00 0.00 31.29 32.09 3n51 h VAL 262 CO 0.15 0.16 0.58 -0.08 0.02 0.00 0.00 177.57 178.41 3n51 h GLU 263 N 0.28 1.24 0.00 1.57 4.81 -0.94 -0.59 114.58 120.95 3n51 h GLU 263 Ca 0.09 -0.10 -0.09 0.00 -0.13 0.00 0.00 59.36 59.14 3n51 h GLU 263 Cb 0.15 -0.27 -0.01 0.00 0.63 0.00 0.00 28.75 29.25 3n51 h GLU 263 CO -0.01 0.85 -0.41 -0.22 -0.73 0.00 0.00 179.01 178.49 3n51 h LYS 264 N 1.27 0.00 0.00 1.92 3.64 -1.33 -3.47 116.57 118.60 3n51 h LYS 264 Ca 0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.72 3n51 h LYS 264 Cb -0.10 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.72 3n51 h LYS 264 CO -0.07 0.41 0.00 0.41 -2.27 0.00 0.00 179.45 177.93 3n51 n GLY 265 N -0.33 0.44 3.76 5.01 0.00 -0.12 -4.99 105.19 108.96 3n51 n GLY 265 Ca -0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 3n51 n GLY 265 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n51 s LYS 266 N -0.40 4.13 0.14 1.61 1.02 -1.25 -4.96 119.74 120.03 3n51 s LYS 266 Ca 0.00 0.16 -0.13 0.00 0.02 0.00 0.00 55.97 56.02 3n51 s LYS 266 Cb 0.00 -3.37 0.02 0.00 -0.52 0.00 0.00 37.83 33.96 3n51 s LYS 266 CO 0.00 0.36 0.36 1.52 -0.92 0.00 0.00 175.35 176.67 3n51 s TYR 267 N 0.07 0.01 0.20 3.18 -0.85 -1.26 -4.90 117.35 113.80 3n51 s TYR 267 Ca 0.18 -0.36 0.01 0.00 -0.52 0.00 0.00 57.07 56.38 3n51 s TYR 267 Cb -0.14 0.16 -0.05 0.00 0.38 0.00 0.00 41.96 42.31 3n51 s TYR 267 CO 0.06 -0.71 0.07 0.95 -1.52 0.00 0.00 175.55 174.40 3n51 s THR 268 N -3.86 0.39 -0.41 -3.49 -4.23 -1.26 -5.03 115.64 97.75 3n51 s THR 268 Ca 0.07 -1.98 0.05 0.00 -1.18 0.00 0.00 61.69 58.66 3n51 s THR 268 Cb 0.02 -2.37 0.62 0.00 1.34 0.00 0.00 72.50 72.11 3n51 s THR 268 CO -0.08 -0.20 1.80 0.49 -0.54 0.00 0.00 174.62 176.09 3n51 n PHE 269 N -0.30 2.57 0.01 3.99 3.72 -1.26 -4.76 117.46 121.43 3n51 n PHE 269 Ca -0.02 -1.81 0.14 0.00 -0.05 0.00 0.00 57.45 55.70 3n51 n PHE 269 Cb 0.65 -0.84 0.59 0.00 -0.94 0.00 0.00 39.48 38.94 3n51 n PHE 269 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 3n51 h GLU 270 N 1.02 0.19 -7.13 -1.08 4.81 -2.00 -3.43 114.58 106.96 3n51 h GLU 270 Ca 0.53 -0.01 -0.53 0.00 -0.13 0.00 0.00 59.36 59.22 3n51 h GLU 270 Cb 2.52 -0.04 0.13 0.00 0.63 0.00 0.00 28.75 31.99 3n51 h GLU 270 CO 0.93 0.12 0.44 -0.51 -0.73 0.00 0.00 179.01 179.27 3n51 s LEU 271 N -9.09 3.52 0.24 1.64 1.43 -1.26 -4.91 118.68 110.24 3n51 s LEU 271 Ca -0.06 2.38 -0.07 0.00 -1.03 0.00 0.00 54.13 55.35 3n51 s LEU 271 Cb 0.19 -4.59 0.26 0.00 0.03 0.00 0.00 46.19 42.08 3n51 s LEU 271 CO 0.73 -1.87 1.88 -0.65 0.23 0.00 0.00 176.35 176.68 3n51 h PRO 272 N 0.39 1.08 0.00 1.29 0.11 -2.01 -2.63 132.00 130.23 3n51 h PRO 272 Ca -0.49 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.55 3n51 h PRO 272 Cb 1.30 -0.24 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3n51 h PRO 272 CO 0.53 0.72 0.00 0.00 -0.21 0.00 0.00 178.00 179.04 3n51 n GLN 273 N -4.53 0.03 0.08 1.05 0.00 -1.26 -1.66 117.38 111.10 3n51 n GLN 273 Ca 0.11 0.30 0.12 0.00 0.00 0.00 0.00 57.00 57.52 3n51 n GLN 273 Cb 0.08 -1.50 0.45 0.00 0.00 0.00 0.00 30.24 29.28 3n51 n GLN 273 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 3n51 n TRP 274 N -1.45 0.58 0.10 2.61 7.02 -0.99 -3.04 117.44 122.26 3n51 n TRP 274 Ca 0.03 0.20 -0.00 0.00 -1.02 0.00 0.00 57.50 56.70 3n51 n TRP 274 Cb 0.11 -0.82 0.29 0.00 -2.42 0.00 0.00 31.31 28.47 3n51 n TRP 274 CO 0.00 0.00 0.00 0.87 -2.02 0.00 0.00 177.69 176.54 3n51 h LYS 275 N 0.00 0.24 -0.00 -0.99 1.79 -1.51 -2.89 116.57 113.21 3n51 h LYS 275 Ca 0.00 -0.09 0.00 0.00 -2.18 0.00 0.00 60.65 58.38 3n51 h LYS 275 Cb 0.48 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.11 3n51 h LYS 275 CO 0.00 0.52 0.00 1.63 -1.08 0.00 0.00 179.45 180.52 3n51 n LYS 276 N -4.12 1.01 -4.79 3.15 5.02 -1.17 -4.83 118.16 112.43 3n51 n LYS 276 Ca -0.01 -0.01 -0.33 0.00 -2.02 0.00 0.00 58.31 55.94 3n51 n LYS 276 Cb 0.40 -1.17 -0.12 0.00 -0.02 0.00 0.00 35.03 34.11 3n51 n LYS 276 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3n51 s VAL 277 N -2.00 3.31 0.56 -0.18 1.01 -1.09 -5.01 120.40 116.99 3n51 s VAL 277 Ca 0.17 -0.63 -0.21 0.00 0.00 0.00 0.00 61.98 61.31 3n51 s VAL 277 Cb 0.08 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.09 3n51 s VAL 277 CO 0.13 0.59 1.29 -0.94 0.00 0.00 0.00 175.10 176.17 3n51 s SER 278 N -0.74 5.30 0.46 3.32 1.04 -1.26 -4.90 113.70 116.92 3n51 s SER 278 Ca 0.11 2.61 0.12 0.00 0.48 0.00 0.00 55.95 59.27 3n51 s SER 278 Cb -0.11 -2.62 1.07 0.00 0.10 0.00 0.00 66.02 64.46 3n51 s SER 278 CO 0.01 -1.54 2.09 -0.08 0.98 0.00 0.00 173.24 174.70 3n51 h GLU 279 N 1.32 0.28 0.01 4.02 4.57 -1.97 -2.84 114.58 119.96 3n51 h GLU 279 Ca -0.51 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 57.66 3n51 h GLU 279 Cb 1.30 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 3n51 h GLU 279 CO 0.57 0.18 -0.01 1.03 -1.18 0.00 0.00 179.01 179.60 3n51 h SER 280 N 0.29 -0.02 -0.51 1.04 0.87 -1.99 0.99 113.55 114.21 3n51 h SER 280 Ca 0.10 -0.05 0.10 0.00 -1.23 0.00 0.00 61.79 60.71 3n51 h SER 280 Cb 0.06 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 61.94 3n51 h SER 280 CO -0.02 0.04 0.01 0.00 -0.53 0.00 0.00 176.83 176.33 3n51 h ALA 281 N 0.91 0.50 -0.85 6.23 0.00 -1.89 -2.46 119.26 121.71 3n51 h ALA 281 Ca -0.00 0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 3n51 h ALA 281 Cb 0.07 0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 3n51 h ALA 281 CO 0.00 -0.38 0.41 0.87 0.00 0.00 0.00 179.25 180.16 3n51 h LYS 282 N 0.13 1.22 -0.54 0.00 1.57 -1.28 -1.82 116.57 115.85 3n51 h LYS 282 Ca 0.26 -0.18 0.04 0.00 -1.87 0.00 0.00 60.65 58.91 3n51 h LYS 282 Cb 0.39 -0.22 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 3n51 h LYS 282 CO -0.42 0.93 0.29 0.22 -0.57 0.00 0.00 179.45 179.91 3n51 h ASP 283 N 1.21 0.44 -0.70 0.86 3.58 -0.49 -0.85 116.42 120.48 3n51 h ASP 283 Ca 0.29 0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.70 3n51 h ASP 283 Cb 0.11 -0.07 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 3n51 h ASP 283 CO -0.04 0.30 0.19 0.25 -2.88 0.00 0.00 179.24 177.06 3n51 h LEU 284 N 0.57 1.04 -1.22 2.28 5.85 -1.06 -2.31 115.31 120.47 3n51 h LEU 284 Ca 0.23 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3n51 h LEU 284 Cb 0.11 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.83 3n51 h LEU 284 CO -0.14 1.00 0.49 0.40 -0.34 0.00 0.00 178.44 179.84 3n51 h ILE 285 N 1.04 1.20 -0.59 4.05 2.04 -0.97 0.93 117.51 125.22 3n51 h ILE 285 Ca 0.22 -0.40 -0.10 0.00 1.00 0.00 0.00 64.86 65.58 3n51 h ILE 285 Cb 0.35 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 3n51 h ILE 285 CO -0.00 0.20 -0.02 0.03 0.00 0.00 0.00 178.15 178.36 3n51 h ARG 286 N 1.04 1.05 -0.29 2.37 3.08 -0.78 -0.12 114.38 120.73 3n51 h ARG 286 Ca 0.28 -0.34 -0.16 0.00 0.07 0.00 0.00 59.98 59.82 3n51 h ARG 286 Cb -0.09 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 29.86 3n51 h ARG 286 CO -0.06 1.04 -0.47 0.87 -1.07 0.00 0.00 179.97 180.28 3n51 h LYS 287 N 0.95 0.79 0.00 0.04 1.57 -1.03 -2.46 116.57 116.44 3n51 h LYS 287 Ca 0.17 -0.45 -0.13 0.00 -1.87 0.00 0.00 60.65 58.36 3n51 h LYS 287 Cb 0.58 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.91 3n51 h LYS 287 CO 0.03 1.09 -0.61 0.52 -0.57 0.00 0.00 179.45 179.91 3n51 h MET 288 N 0.63 0.00 -0.67 3.15 2.86 -0.64 -3.01 114.93 117.25 3n51 h MET 288 Ca 0.03 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.56 3n51 h MET 288 Cb 1.05 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.64 3n51 h MET 288 CO 0.10 0.61 0.15 1.28 1.06 0.00 0.00 176.91 180.11 3n51 n LEU 289 N -3.64 5.98 -4.74 1.22 4.77 -0.08 -3.69 117.00 116.83 3n51 n LEU 289 Ca -0.01 -3.09 -0.41 0.00 -0.03 0.00 0.00 56.01 52.47 3n51 n LEU 289 Cb 0.64 -0.72 -0.03 0.00 -2.33 0.00 0.00 43.42 40.98 3n51 n LEU 289 CO 0.41 0.73 1.04 -0.89 -1.33 0.00 0.00 177.39 177.35 3n51 s THR 290 N -2.90 3.03 -0.01 -5.08 2.01 -0.93 -4.95 115.64 106.82 3n51 s THR 290 Ca 0.55 0.83 -0.24 0.00 0.31 0.00 0.00 61.69 63.14 3n51 s THR 290 Cb 0.43 -3.53 -0.17 0.00 0.01 0.00 0.00 72.50 69.24 3n51 s THR 290 CO 0.15 0.12 1.19 0.22 -0.69 0.00 0.00 174.62 175.60 3n51 h TYR 291 N 5.55 -0.21 -3.12 4.92 3.20 -1.92 -3.42 116.97 121.96 3n51 h TYR 291 Ca -0.45 -0.00 -0.57 0.00 3.14 0.00 0.00 58.73 60.85 3n51 h TYR 291 Cb 1.21 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 39.51 3n51 h TYR 291 CO 0.62 0.18 0.71 0.08 -1.64 0.00 0.00 178.16 178.11 3n51 s VAL 292 N -4.33 4.61 0.39 1.81 1.01 -1.26 -4.89 120.40 117.74 3n51 s VAL 292 Ca -0.14 1.91 0.06 0.00 0.00 0.00 0.00 61.98 63.81 3n51 s VAL 292 Cb 0.02 -4.23 0.23 0.00 0.00 0.00 0.00 36.38 32.39 3n51 s VAL 292 CO 0.57 -0.08 2.00 -0.65 0.00 0.00 0.00 175.10 176.94 3n51 h PRO 293 N 7.42 0.51 0.00 2.72 0.11 -1.94 -1.19 132.00 139.63 3n51 h PRO 293 Ca -0.26 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.75 3n51 h PRO 293 Cb 1.11 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 3n51 h PRO 293 CO 0.92 0.41 -0.16 0.66 -0.21 0.00 0.00 178.00 179.62 3n51 h SER 294 N 0.52 0.00 1.11 -2.05 4.64 -1.95 -1.22 113.55 114.59 3n51 h SER 294 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 3n51 h SER 294 Cb 0.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.17 3n51 h SER 294 CO -0.02 0.16 -0.71 0.24 -0.87 0.00 0.00 176.83 175.64 3n51 h MET 295 N 0.00 0.00 -6.79 4.77 2.86 -1.63 -3.47 114.93 110.68 3n51 h MET 295 Ca -0.00 0.00 -0.51 0.00 -2.06 0.00 0.00 59.70 57.12 3n51 h MET 295 Cb 0.50 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.20 3n51 h MET 295 CO 0.02 0.00 0.56 0.50 1.06 0.00 0.00 176.91 179.05 3n51 s ARG 296 N -3.27 4.50 0.63 1.72 3.52 -0.46 -4.97 118.95 120.62 3n51 s ARG 296 Ca 0.03 1.96 -0.19 0.00 -0.13 0.00 0.00 55.73 57.41 3n51 s ARG 296 Cb 0.10 -3.17 -0.02 0.00 -1.56 0.00 0.00 34.95 30.30 3n51 s ARG 296 CO 0.74 -0.01 1.23 1.51 -0.81 0.00 0.00 175.30 177.96 3n51 n ILE 297 N 1.50 4.55 -1.83 4.11 3.06 -1.14 -4.99 119.36 124.63 3n51 n ILE 297 Ca 0.01 -0.50 -0.31 0.00 -2.50 0.00 0.00 62.75 59.45 3n51 n ILE 297 Cb 0.44 -1.44 0.02 0.00 0.54 0.00 0.00 39.64 39.20 3n51 n ILE 297 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3n51 s SER 298 N -1.29 5.92 0.28 9.51 1.04 -1.26 -4.90 113.70 123.00 3n51 s SER 298 Ca 0.80 1.38 -0.02 0.00 0.48 0.00 0.00 55.95 58.59 3n51 s SER 298 Cb -0.39 -2.35 0.43 0.00 0.10 0.00 0.00 66.02 63.80 3n51 s SER 298 CO 0.43 -1.07 1.93 0.00 0.98 0.00 0.00 173.24 175.51 3n51 h ALA 299 N -0.46 1.42 0.07 5.32 0.00 -1.95 -0.56 119.26 123.09 3n51 h ALA 299 Ca -0.44 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 3n51 h ALA 299 Cb 1.21 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.67 3n51 h ALA 299 CO 0.62 0.49 -0.03 -0.09 0.00 0.00 0.00 179.25 180.24 3n51 h ARG 300 N 1.15 -0.09 0.00 0.00 9.65 -1.92 -2.30 114.38 120.88 3n51 h ARG 300 Ca 0.37 0.01 -0.04 0.00 -1.10 0.00 0.00 59.98 59.21 3n51 h ARG 300 Cb 0.02 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.62 3n51 h ARG 300 CO -0.11 0.01 -0.19 -0.44 2.80 0.00 0.00 179.97 182.04 3n51 h ASP 301 N -0.17 0.00 -0.13 -3.80 3.32 -1.92 -2.76 116.42 110.96 3n51 h ASP 301 Ca -0.01 0.00 -0.19 0.00 0.02 0.00 0.00 57.03 56.85 3n51 h ASP 301 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3n51 h ASP 301 CO 0.02 0.19 -0.61 0.00 -1.72 0.00 0.00 179.24 177.12 3n51 h ALA 302 N 1.81 0.51 -0.83 3.45 0.00 -0.85 -2.70 119.26 120.65 3n51 h ALA 302 Ca -0.00 -0.54 0.15 0.00 0.00 0.00 0.00 54.91 54.52 3n51 h ALA 302 Cb 0.65 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.31 3n51 h ALA 302 CO 0.02 0.69 0.55 -0.07 0.00 0.00 0.00 179.25 180.44 3n51 h LEU 303 N 0.55 0.52 0.00 0.00 3.38 -1.13 -1.34 115.31 117.29 3n51 h LEU 303 Ca -0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3n51 h LEU 303 Cb 1.20 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.88 3n51 h LEU 303 CO 0.13 0.26 0.00 0.47 0.09 0.00 0.00 178.44 179.38 3n51 n ASP 304 N -4.52 0.00 -4.77 -0.43 8.00 -1.04 -4.49 116.55 109.30 3n51 n ASP 304 Ca 0.16 -0.16 -0.41 0.00 0.71 0.00 0.00 54.79 55.09 3n51 n ASP 304 Cb 0.52 -0.28 -0.01 0.00 -0.02 0.00 0.00 41.12 41.33 3n51 n ASP 304 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 3n51 s HIS 305 N -2.56 2.83 0.30 1.24 2.46 -0.51 -4.76 115.29 114.30 3n51 s HIS 305 Ca 0.29 1.30 -0.02 0.00 0.47 0.00 0.00 55.06 57.11 3n51 s HIS 305 Cb 0.20 -3.84 0.65 0.00 -0.13 0.00 0.00 32.58 29.47 3n51 s HIS 305 CO 0.46 -2.38 1.57 1.49 -2.47 0.00 0.00 174.74 173.41 3n51 h GLU 306 N 3.19 0.01 -0.43 2.88 4.81 -1.91 -0.08 114.58 123.04 3n51 h GLU 306 Ca -0.50 -0.00 0.04 0.00 -0.13 0.00 0.00 59.36 58.77 3n51 h GLU 306 Cb 1.23 -0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.57 3n51 h GLU 306 CO 0.65 0.00 0.21 2.35 -0.73 0.00 0.00 179.01 181.49 3n51 h TRP 307 N 0.01 0.38 -0.00 0.92 7.01 -1.90 0.20 115.95 122.56 3n51 h TRP 307 Ca 0.55 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.57 3n51 h TRP 307 Cb 1.06 -0.11 -0.00 0.00 -2.10 0.00 0.00 29.16 28.01 3n51 h TRP 307 CO -0.58 0.19 -0.00 0.82 -2.79 0.00 0.00 178.44 176.08 3n51 h ILE 308 N 0.42 1.26 -0.20 2.65 1.08 -1.37 -0.47 117.51 120.87 3n51 h ILE 308 Ca 0.18 -0.76 0.06 0.00 -0.39 0.00 0.00 64.86 63.95 3n51 h ILE 308 Cb 0.10 1.76 -0.06 0.00 -3.07 0.00 0.00 36.82 35.55 3n51 h ILE 308 CO -0.14 0.20 -0.23 1.56 -0.69 0.00 0.00 178.15 178.85 3n51 h GLN 309 N -0.31 -0.25 -0.27 2.37 1.08 -0.98 -2.23 115.11 114.52 3n51 h GLN 309 Ca 0.00 0.02 -0.10 0.00 -1.45 0.00 0.00 58.65 57.11 3n51 h GLN 309 Cb 0.32 0.06 -0.00 0.00 -0.05 0.00 0.00 27.48 27.80 3n51 h GLN 309 CO 0.00 -0.16 -0.24 1.15 -0.95 0.00 0.00 178.83 178.63 3n51 h THR 310 N -0.26 1.31 -0.01 -0.54 2.02 -0.57 -3.32 112.91 111.55 3n51 h THR 310 Ca 0.12 -1.39 0.00 0.00 0.77 0.00 0.00 66.41 65.91 3n51 h THR 310 Cb 0.44 1.61 0.00 0.00 -1.74 0.00 0.00 68.15 68.46 3n51 h THR 310 CO -0.35 0.44 -0.39 -1.22 0.37 0.00 0.00 175.52 174.38 3n51 n TYR 311 N -4.34 0.00 -0.42 3.16 4.01 -0.19 -4.01 117.16 115.37 3n51 n TYR 311 Ca -0.04 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.77 3n51 n TYR 311 Cb 0.43 -0.12 0.22 0.00 -0.31 0.00 0.00 39.34 39.56 3n51 n TYR 311 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3n51 n THR 312 N -0.76 1.37 -1.71 -0.72 -2.24 -0.84 -4.57 114.28 104.81 3n51 n THR 312 Ca 0.10 -1.21 -0.43 0.00 -2.27 0.00 0.00 64.05 60.25 3n51 n THR 312 Cb 0.36 0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.86 3n51 n THR 312 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3n51 n LYS 313 N 0.48 2.70 -0.26 -0.78 5.02 -1.25 -4.90 118.16 119.16 3n51 n LYS 313 Ca 0.16 0.97 -0.01 0.00 -2.02 0.00 0.00 58.31 57.42 3n51 n LYS 313 Cb 0.60 -2.81 0.05 0.00 -0.02 0.00 0.00 35.03 32.84 3n51 n LYS 313 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 3n51 h GLU 314 N 6.79 -0.06 -6.46 1.97 5.08 -1.96 -3.35 114.58 116.60 3n51 h GLU 314 Ca -0.44 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.35 3n51 h GLU 314 Cb 1.21 0.01 -0.08 0.00 0.50 0.00 0.00 28.75 30.39 3n51 h GLU 314 CO 0.95 -0.04 0.80 -0.65 -1.00 0.00 0.00 179.01 179.06 3n51 s GLN 315 N -6.10 3.74 -0.48 2.33 -1.52 -1.26 -4.99 119.66 111.38 3n51 s GLN 315 Ca -0.14 0.54 -0.28 0.00 -1.95 0.00 0.00 55.36 53.52 3n51 s GLN 315 Cb 0.20 -3.88 -0.01 0.00 -0.22 0.00 0.00 33.01 29.10 3n51 s GLN 315 CO 0.72 -1.23 1.64 0.42 -0.25 0.00 0.00 175.29 176.59 3n51 s ILE 316 N 4.08 3.61 -1.55 1.08 1.01 -1.26 -4.80 121.20 123.37 3n51 s ILE 316 Ca 0.44 0.54 0.15 0.00 0.00 0.00 0.00 60.65 61.78 3n51 s ILE 316 Cb -0.09 -4.03 0.03 0.00 0.01 0.00 0.00 42.46 38.38 3n51 s ILE 316 CO 0.27 -0.80 0.87 -1.54 0.00 0.00 0.00 174.94 173.73 3n51 n SER 317 N 10.45 1.77 -4.63 3.58 3.41 -1.26 -5.01 113.62 121.93 3n51 n SER 317 Ca 0.18 -1.39 -0.24 0.00 -0.26 0.00 0.00 58.87 57.17 3n51 n SER 317 Cb 0.49 0.33 -0.08 0.00 -0.26 0.00 0.00 64.21 64.69 3n51 n SER 317 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3n51 s VAL 318 N -1.65 2.87 0.33 -3.33 1.01 -1.26 -5.10 120.40 113.27 3n51 s VAL 318 Ca 0.14 -1.96 -0.29 0.00 0.00 0.00 0.00 61.98 59.87 3n51 s VAL 318 Cb 0.12 -2.79 -0.11 0.00 0.00 0.00 0.00 36.38 33.61 3n51 s VAL 318 CO 0.32 -0.26 1.49 -1.81 0.00 0.00 0.00 175.10 174.84 3n51 s ASP 319 N -3.70 6.45 -0.47 3.32 1.01 -1.26 -4.98 116.67 117.03 3n51 s ASP 319 Ca 0.34 2.93 0.09 0.00 0.71 0.00 0.00 52.55 56.61 3n51 s ASP 319 Cb -0.02 -2.65 0.32 0.00 1.01 0.00 0.00 42.92 41.58 3n51 s ASP 319 CO 0.20 -0.82 0.77 1.33 0.21 0.00 0.00 175.17 176.86 3n51 n VAL 320 N 1.25 1.02 -1.91 -1.27 0.24 -1.26 -4.91 118.33 111.48 3n51 n VAL 320 Ca 0.04 -4.88 -0.42 0.00 -2.04 0.00 0.00 64.34 57.04 3n51 n VAL 320 Cb 0.39 -1.04 -0.03 0.00 -1.47 0.00 0.00 33.84 31.69 3n51 n VAL 320 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3n51 s PRO 321 N -2.58 4.21 0.19 7.34 0.04 -1.26 -4.89 135.00 138.04 3n51 s PRO 321 Ca 0.42 2.39 -0.32 0.00 0.04 0.00 0.00 61.00 63.54 3n51 s PRO 321 Cb 0.28 -3.13 -0.11 0.00 0.04 0.00 0.00 34.50 31.58 3n51 s PRO 321 CO -0.10 -0.61 1.69 0.45 0.04 0.00 0.00 177.00 178.47 3n51 s SER 322 N 1.04 6.44 -1.28 6.66 0.15 -1.26 -4.59 113.70 120.86 3n51 s SER 322 Ca 0.69 2.78 -0.16 0.00 0.70 0.00 0.00 55.95 59.97 3n51 s SER 322 Cb -0.44 -2.59 0.11 0.00 -1.71 0.00 0.00 66.02 61.38 3n51 s SER 322 CO 0.33 -0.93 1.69 0.18 1.20 0.00 0.00 173.24 175.71 3n51 n LEU 323 N 4.14 5.26 -0.12 3.45 4.77 0.12 -4.81 117.00 129.80 3n51 n LEU 323 Ca 0.15 -4.15 -0.12 0.00 -0.03 0.00 0.00 56.01 51.87 3n51 n LEU 323 Cb 0.36 -1.69 -0.02 0.00 -2.33 0.00 0.00 43.42 39.74 3n51 n LEU 323 CO 0.63 0.47 0.64 0.44 -1.33 0.00 0.00 177.39 178.24 3n51 h ASP 324 N 7.22 0.84 -0.26 -1.43 3.32 -1.90 -2.31 116.42 121.90 3n51 h ASP 324 Ca 0.41 -0.42 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 3n51 h ASP 324 Cb 0.84 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 3n51 h ASP 324 CO 1.43 1.08 -0.29 -1.13 -1.72 0.00 0.00 179.24 178.61 3n51 h ASN 325 N 0.61 0.80 -0.96 6.45 -0.00 -1.96 -2.30 115.58 118.21 3n51 h ASN 325 Ca 0.08 -0.32 0.04 0.00 -0.00 0.00 0.00 56.30 56.10 3n51 h ASN 325 Cb 0.77 -0.22 -0.06 0.00 -0.00 0.00 0.00 38.32 38.82 3n51 h ASN 325 CO 0.06 1.03 0.62 0.00 -0.00 0.00 0.00 177.43 179.15 3n51 h ALA 326 N 1.02 1.28 -0.22 1.57 0.00 -1.71 0.17 119.26 121.36 3n51 h ALA 326 Ca 0.08 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3n51 h ALA 326 Cb 0.82 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3n51 h ALA 326 CO 0.07 0.48 -0.04 0.82 0.00 0.00 0.00 179.25 180.59 3n51 h ILE 327 N 1.19 1.28 -0.80 0.00 2.04 -1.20 0.51 117.51 120.53 3n51 h ILE 327 Ca 0.39 -1.00 0.04 0.00 1.00 0.00 0.00 64.86 65.29 3n51 h ILE 327 Cb 0.03 1.48 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 3n51 h ILE 327 CO -0.13 0.31 0.50 -0.07 0.00 0.00 0.00 178.15 178.75 3n51 h LEU 328 N 0.16 0.80 -0.32 1.44 3.38 -1.13 0.10 115.31 119.74 3n51 h LEU 328 Ca 0.06 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.89 3n51 h LEU 328 Cb 0.47 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.06 3n51 h LEU 328 CO 0.02 0.54 -0.35 0.78 0.09 0.00 0.00 178.44 179.52 3n51 h ASN 329 N 0.94 0.86 -0.66 -0.43 2.35 -0.42 -1.83 115.58 116.39 3n51 h ASN 329 Ca 0.33 -0.48 -0.06 0.00 -0.55 0.00 0.00 56.30 55.54 3n51 h ASN 329 Cb 0.08 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 3n51 h ASN 329 CO -0.14 1.16 0.18 -0.29 -1.65 0.00 0.00 177.43 176.70 3n51 h ILE 330 N 0.57 1.25 -0.53 2.81 2.10 0.33 0.04 117.51 124.08 3n51 h ILE 330 Ca 0.05 -0.91 0.01 0.00 1.08 0.00 0.00 64.86 65.09 3n51 h ILE 330 Cb 0.94 0.53 -0.03 0.00 -1.09 0.00 0.00 36.82 37.17 3n51 h ILE 330 CO 0.09 0.35 0.34 0.03 -1.08 0.00 0.00 178.15 177.87 3n51 h ARG 331 N 1.01 0.66 -0.75 2.19 3.08 -0.91 0.45 114.38 120.12 3n51 h ARG 331 Ca 0.22 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 3n51 h ARG 331 Cb 0.33 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.19 3n51 h ARG 331 CO -0.00 0.44 0.39 0.37 -1.07 0.00 0.00 179.97 180.09 3n51 h GLN 332 N 0.68 1.05 0.02 0.04 4.15 -1.04 -0.31 115.11 119.70 3n51 h GLN 332 Ca 0.20 -0.13 -0.00 0.00 0.77 0.00 0.00 58.65 59.49 3n51 h GLN 332 Cb -0.04 -0.20 0.00 0.00 0.21 0.00 0.00 27.48 27.45 3n51 h GLN 332 CO -0.06 0.79 -0.01 0.35 -1.93 0.00 0.00 178.83 177.97 3n51 h PHE 333 N 1.05 -0.03 -0.44 3.99 3.57 -0.16 -1.65 116.94 123.27 3n51 h PHE 333 Ca 0.26 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 3n51 h PHE 333 Cb 0.06 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 3n51 h PHE 333 CO 0.01 0.46 0.24 0.37 -2.23 0.00 0.00 178.31 177.16 3n51 h GLN 334 N -0.53 0.62 -0.66 1.11 5.75 -0.07 -1.60 115.11 119.74 3n51 h GLN 334 Ca -0.00 -0.07 0.03 0.00 -0.15 0.00 0.00 58.65 58.45 3n51 h GLN 334 Cb 0.50 -0.12 -0.04 0.00 1.07 0.00 0.00 27.48 28.89 3n51 h GLN 334 CO 0.00 0.49 0.41 0.78 -2.65 0.00 0.00 178.83 177.87 3n51 h GLY 335 N 0.58 0.94 0.83 2.39 0.00 -1.05 0.53 103.07 107.29 3n51 h GLY 335 Ca 0.15 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.16 3n51 h GLY 335 CO -0.02 0.26 0.03 -0.84 0.00 0.00 0.00 176.54 175.97 3n51 h THR 336 N 0.80 1.21 -0.94 4.70 2.02 -1.11 -0.70 112.91 118.89 3n51 h THR 336 Ca 0.26 -0.69 0.02 0.00 0.77 0.00 0.00 66.41 66.78 3n51 h THR 336 Cb 0.02 1.35 -0.05 0.00 -1.74 0.00 0.00 68.15 67.73 3n51 h THR 336 CO -0.11 0.21 0.62 1.56 0.37 0.00 0.00 175.52 178.17 3n51 h GLN 337 N 0.07 1.21 -0.17 6.66 1.08 -0.98 -1.09 115.11 121.90 3n51 h GLN 337 Ca 0.05 -0.07 -0.21 0.00 -1.45 0.00 0.00 58.65 56.97 3n51 h GLN 337 Cb 0.29 -0.27 0.00 0.00 -0.05 0.00 0.00 27.48 27.45 3n51 h GLN 337 CO 0.00 0.80 -0.72 0.87 -0.95 0.00 0.00 178.83 178.84 3n51 h LYS 338 N 1.25 0.73 -0.31 1.46 1.79 -0.72 -2.15 116.57 118.62 3n51 h LYS 338 Ca 0.35 -0.56 -0.08 0.00 -2.18 0.00 0.00 60.65 58.18 3n51 h LYS 338 Cb -0.10 0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 3n51 h LYS 338 CO -0.09 1.18 -0.14 1.25 -1.08 0.00 0.00 179.45 180.57 3n51 h LEU 339 N 0.51 0.65 -0.48 2.94 5.85 -0.97 0.12 115.31 123.94 3n51 h LEU 339 Ca -0.03 -0.40 0.03 0.00 0.84 0.00 0.00 57.88 58.31 3n51 h LEU 339 Cb 1.33 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 42.14 3n51 h LEU 339 CO 0.14 0.91 0.27 0.00 -0.34 0.00 0.00 178.44 179.42 3n51 h ALA 340 N 0.76 0.61 -0.23 1.25 0.00 -1.25 0.74 119.26 121.14 3n51 h ALA 340 Ca 0.07 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 3n51 h ALA 340 Cb 0.66 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3n51 h ALA 340 CO 0.04 -0.05 0.14 0.37 0.00 0.00 0.00 179.25 179.75 3n51 h GLN 341 N 0.54 0.31 -0.97 0.00 4.15 -1.26 -2.29 115.11 115.59 3n51 h GLN 341 Ca 0.20 -0.03 0.03 0.00 0.77 0.00 0.00 58.65 59.62 3n51 h GLN 341 Cb 0.05 -0.07 -0.05 0.00 0.21 0.00 0.00 27.48 27.62 3n51 h GLN 341 CO -0.11 0.25 0.63 0.00 -1.93 0.00 0.00 178.83 177.68 3n51 h ALA 342 N 1.05 1.26 0.06 3.38 0.00 -0.55 -1.16 119.26 123.31 3n51 h ALA 342 Ca 0.08 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3n51 h ALA 342 Cb 0.01 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.44 3n51 h ALA 342 CO -0.02 0.56 -0.03 0.00 0.00 0.00 0.00 179.25 179.76 3n51 h ALA 343 N 1.38 -0.09 -0.80 0.00 0.00 -0.63 0.07 119.26 119.20 3n51 h ALA 343 Ca 0.37 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.26 3n51 h ALA 343 Cb -0.06 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3n51 h ALA 343 CO -0.10 -0.53 0.53 -0.07 0.00 0.00 0.00 179.25 179.07 3n51 h LEU 344 N -0.12 0.90 -1.06 0.00 3.38 -1.22 -2.11 115.31 115.09 3n51 h LEU 344 Ca -0.01 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 3n51 h LEU 344 Cb 0.10 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3n51 h LEU 344 CO 0.01 0.65 -0.22 -0.07 0.09 0.00 0.00 178.44 178.90 3n51 h LEU 345 N 1.06 0.40 -0.35 1.67 3.38 -0.98 -0.40 115.31 120.09 3n51 h LEU 345 Ca 0.30 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 3n51 h LEU 345 Cb -0.09 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 3n51 h LEU 345 CO -0.08 0.63 -0.10 0.22 0.09 0.00 0.00 178.44 179.20 3n51 h TYR 346 N 0.36 0.79 -0.31 1.13 3.20 -0.68 -0.57 116.97 120.89 3n51 h TYR 346 Ca 0.06 -0.18 -0.05 0.00 3.14 0.00 0.00 58.73 61.71 3n51 h TYR 346 Cb 0.60 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 3n51 h TYR 346 CO 0.02 0.86 0.01 0.52 -1.64 0.00 0.00 178.16 177.93 3n51 h MET 347 N 0.49 0.54 -0.71 1.82 2.86 -1.22 -1.41 114.93 117.29 3n51 h MET 347 Ca 0.09 -0.17 0.12 0.00 -2.06 0.00 0.00 59.70 57.68 3n51 h MET 347 Cb 0.62 -0.05 -0.08 0.00 0.06 0.00 0.00 31.60 32.14 3n51 h MET 347 CO 0.04 0.67 0.30 0.78 1.06 0.00 0.00 176.91 179.76 3n51 h GLY 348 N 0.34 1.06 1.54 8.32 0.00 -1.03 -2.38 103.07 110.93 3n51 h GLY 348 Ca 0.09 -0.17 -0.14 0.00 0.00 0.00 0.00 47.33 47.12 3n51 h GLY 348 CO 0.01 -0.03 -0.45 1.76 0.00 0.00 0.00 176.54 177.84 3n51 h SER 349 N 0.49 0.53 0.21 0.19 0.02 -0.86 -1.89 113.55 112.23 3n51 h SER 349 Ca 0.37 -0.25 -0.11 0.00 -0.84 0.00 0.00 61.79 60.96 3n51 h SER 349 Cb 0.49 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 3n51 h SER 349 CO -0.34 0.91 -0.42 0.50 -1.14 0.00 0.00 176.83 176.34 3n51 h LYS 350 N 0.40 0.27 0.03 3.45 1.63 -0.95 -0.96 116.57 120.44 3n51 h LYS 350 Ca 0.03 -0.13 -0.00 0.00 -0.85 0.00 0.00 60.65 59.69 3n51 h LYS 350 Cb 0.94 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.57 3n51 h LYS 350 CO 0.08 0.65 -0.01 -0.07 -3.45 0.00 0.00 179.45 176.65 3n51 h LEU 351 N 0.23 -0.03 -0.68 5.20 3.38 -1.23 -2.73 115.31 119.44 3n51 h LEU 351 Ca 0.02 -0.46 0.10 0.00 0.09 0.00 0.00 57.88 57.63 3n51 h LEU 351 Cb 0.84 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.52 3n51 h LEU 351 CO 0.07 0.45 0.30 0.74 0.09 0.00 0.00 178.44 180.09 3n51 h THR 352 N -0.52 0.79 0.00 0.22 2.02 -1.29 -2.03 112.91 112.09 3n51 h THR 352 Ca -0.00 -0.17 -0.06 0.00 0.77 0.00 0.00 66.41 66.94 3n51 h THR 352 Cb 0.49 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 3n51 h THR 352 CO 0.01 0.09 -0.28 0.77 0.37 0.00 0.00 175.52 176.47 3n51 h SER 353 N 0.50 0.00 -0.06 4.18 4.64 -1.22 -1.92 113.55 119.67 3n51 h SER 353 Ca 0.34 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.65 3n51 h SER 353 Cb 0.41 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3n51 h SER 353 CO -0.30 0.28 -0.01 1.56 -0.87 0.00 0.00 176.83 177.49 3n51 h GLN 354 N 0.00 0.10 0.43 4.77 4.20 -1.05 -0.39 115.11 123.17 3n51 h GLN 354 Ca -0.00 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 3n51 h GLN 354 Cb 0.66 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 3n51 h GLN 354 CO 0.04 0.42 -0.36 -0.44 -0.67 0.00 0.00 178.83 177.82 3n51 h ASP 355 N -0.22 -0.96 -0.47 1.46 3.32 -1.39 -2.87 116.42 115.29 3n51 h ASP 355 Ca 0.01 0.08 0.03 0.00 0.02 0.00 0.00 57.03 57.17 3n51 h ASP 355 Cb 0.38 0.31 -0.03 0.00 0.22 0.00 0.00 39.33 40.22 3n51 h ASP 355 CO 0.00 -0.52 0.31 -0.33 -1.72 0.00 0.00 179.24 176.98 3n51 h GLU 356 N -0.79 0.51 -0.45 3.56 5.08 -1.35 0.09 114.58 121.23 3n51 h GLU 356 Ca -0.04 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3n51 h GLU 356 Cb 0.69 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 3n51 h GLU 356 CO -0.02 0.34 0.27 1.15 -1.00 0.00 0.00 179.01 179.74 3n51 h THR 357 N 0.53 1.06 0.04 1.13 2.02 -0.97 -1.25 112.91 115.46 3n51 h THR 357 Ca 0.19 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 3n51 h THR 357 Cb 0.10 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 3n51 h THR 357 CO -0.05 0.10 -0.02 0.11 0.37 0.00 0.00 175.52 176.04 3n51 h LYS 358 N 0.54 -0.05 -0.38 6.66 1.57 -0.81 -2.55 116.57 121.57 3n51 h LYS 358 Ca 0.17 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.00 3n51 h LYS 358 Cb -0.00 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.28 3n51 h LYS 358 CO -0.07 0.09 0.16 0.93 -0.57 0.00 0.00 179.45 179.98 3n51 h GLU 359 N -0.17 0.32 -0.35 3.15 4.39 -1.16 -1.91 114.58 118.85 3n51 h GLU 359 Ca -0.01 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.69 3n51 h GLU 359 Cb 0.16 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 3n51 h GLU 359 CO 0.01 0.21 0.22 1.25 -1.16 0.00 0.00 179.01 179.54 3n51 h LEU 360 N 0.33 0.36 -0.92 1.33 5.85 -1.18 0.27 115.31 121.35 3n51 h LEU 360 Ca 0.17 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.86 3n51 h LEU 360 Cb 0.11 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 3n51 h LEU 360 CO -0.15 0.26 0.43 0.74 -0.34 0.00 0.00 178.44 179.38 3n51 h THR 361 N 0.44 1.25 -0.08 1.05 2.02 -1.33 -0.67 112.91 115.60 3n51 h THR 361 Ca 0.13 -0.68 -0.00 0.00 0.77 0.00 0.00 66.41 66.63 3n51 h THR 361 Cb -0.02 0.15 -0.00 0.00 -1.74 0.00 0.00 68.15 66.53 3n51 h THR 361 CO -0.05 0.30 0.05 0.00 0.37 0.00 0.00 175.52 176.19 3n51 h ALA 362 N 1.27 0.10 0.54 6.16 0.00 -0.80 0.65 119.26 127.18 3n51 h ALA 362 Ca 0.29 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 3n51 h ALA 362 Cb 0.08 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3n51 h ALA 362 CO -0.04 -0.39 -0.37 0.82 0.00 0.00 0.00 179.25 179.27 3n51 h ILE 363 N 0.07 0.25 -0.91 0.00 2.04 -0.68 -0.89 117.51 117.39 3n51 h ILE 363 Ca 0.03 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.96 3n51 h ILE 363 Cb 0.03 0.25 -0.06 0.00 -0.74 0.00 0.00 36.82 36.30 3n51 h ILE 363 CO -0.01 0.00 0.59 -0.26 0.00 0.00 0.00 178.15 178.48 3n51 h PHE 364 N -0.87 1.04 -0.01 1.37 0.05 -1.11 -2.12 116.94 115.28 3n51 h PHE 364 Ca -0.06 0.03 0.02 0.00 3.82 0.00 0.00 57.97 61.78 3n51 h PHE 364 Cb 0.72 -0.34 -0.03 0.00 2.00 0.00 0.00 35.95 38.31 3n51 h PHE 364 CO -0.13 0.52 -0.13 1.25 -0.18 0.00 0.00 178.31 179.64 3n51 h HIS 365 N 1.00 -0.34 -0.40 -0.55 2.76 -0.37 0.34 115.15 117.58 3n51 h HIS 365 Ca 0.41 0.01 0.08 0.00 -2.20 0.00 0.00 60.37 58.67 3n51 h HIS 365 Cb 0.27 0.15 -0.08 0.00 1.55 0.00 0.00 27.41 29.31 3n51 h HIS 365 CO -0.00 -0.20 -0.11 0.87 -1.30 0.00 0.00 177.93 177.19 3n51 h LYS 366 N -0.22 -0.01 0.00 5.26 1.57 -0.56 -0.64 116.57 121.97 3n51 h LYS 366 Ca 0.05 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 3n51 h LYS 366 Cb 0.28 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 3n51 h LYS 366 CO -0.14 -0.01 -0.05 0.52 -0.57 0.00 0.00 179.45 179.21 3n51 h MET 367 N -0.01 0.00 -4.71 3.15 2.86 -1.11 -3.36 114.93 111.75 3n51 h MET 367 Ca 0.19 0.00 -0.68 0.00 -2.06 0.00 0.00 59.70 57.16 3n51 h MET 367 Cb 0.31 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.92 3n51 h MET 367 CO -0.42 0.05 2.66 -3.47 1.06 0.00 0.00 176.91 176.79 3n51 n ASP 368 N -3.82 4.04 0.09 1.22 2.03 0.08 -4.72 116.55 115.48 3n51 n ASP 368 Ca -0.03 -2.84 -0.03 0.00 0.52 0.00 0.00 54.79 52.41 3n51 n ASP 368 Cb 0.14 -1.64 0.20 0.00 -0.72 0.00 0.00 41.12 39.09 3n51 n ASP 368 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 3n51 h LYS 369 N 6.86 0.22 -0.80 -0.67 1.57 -1.79 -2.39 116.57 119.58 3n51 h LYS 369 Ca 0.50 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 59.15 3n51 h LYS 369 Cb 0.73 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.01 3n51 h LYS 369 CO 1.73 0.65 0.45 -0.91 -0.57 0.00 0.00 179.45 180.80 3n51 h ASN 370 N 0.18 0.98 -0.27 0.86 4.21 -1.96 -3.47 115.58 116.11 3n51 h ASN 370 Ca 0.01 -0.07 -0.12 0.00 1.21 0.00 0.00 56.30 57.33 3n51 h ASN 370 Cb 0.90 -0.25 -0.05 0.00 -1.12 0.00 0.00 38.32 37.80 3n51 h ASN 370 CO 0.07 0.78 -0.11 0.61 -1.29 0.00 0.00 177.43 177.50 3n51 n GLY 371 N -1.21 0.81 0.73 2.83 0.00 -0.90 -4.93 105.19 102.53 3n51 n GLY 371 Ca 0.08 -0.66 0.13 0.00 0.00 0.00 0.00 46.02 45.57 3n51 n GLY 371 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3n51 n ASP 372 N 0.78 2.28 -0.23 1.61 5.68 -1.26 -4.96 116.55 120.45 3n51 n ASP 372 Ca -0.06 -1.76 -0.03 0.00 -0.50 0.00 0.00 54.79 52.44 3n51 n ASP 372 Cb 0.21 -0.03 -0.01 0.00 -1.14 0.00 0.00 41.12 40.15 3n51 n ASP 372 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3n51 n GLY 373 N 1.27 0.51 3.30 6.12 0.00 -1.26 -5.00 105.19 110.13 3n51 n GLY 373 Ca 0.17 -0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3n51 n GLY 373 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n51 s GLN 374 N -1.55 2.31 0.19 1.61 -0.21 -1.26 -1.68 119.66 119.07 3n51 s GLN 374 Ca 0.00 -0.91 0.03 0.00 0.02 0.00 0.00 55.36 54.50 3n51 s GLN 374 Cb 0.00 -2.11 -0.05 0.00 1.00 0.00 0.00 33.01 31.86 3n51 s GLN 374 CO 0.00 0.49 -0.04 -0.51 -2.12 0.00 0.00 175.29 173.11 3n51 s LEU 375 N -0.42 2.29 0.61 2.90 1.43 0.08 -4.86 118.68 120.72 3n51 s LEU 375 Ca 0.04 -1.14 0.01 0.00 -1.03 0.00 0.00 54.13 52.02 3n51 s LEU 375 Cb -0.12 -0.24 0.07 0.00 0.03 0.00 0.00 46.19 45.94 3n51 s LEU 375 CO 0.01 -0.47 0.86 1.51 0.23 0.00 0.00 176.35 178.49 3n51 s ASP 376 N -3.22 4.91 0.22 2.29 1.47 -1.26 -0.31 116.67 120.78 3n51 s ASP 376 Ca 0.23 -0.22 -0.09 0.00 1.18 0.00 0.00 52.55 53.65 3n51 s ASP 376 Cb 0.05 -0.45 0.34 0.00 -0.34 0.00 0.00 42.92 42.52 3n51 s ASP 376 CO 0.05 -1.43 1.67 -0.09 0.68 0.00 0.00 175.17 176.05 3n51 h ARG 377 N -0.14 0.16 -0.15 2.11 2.43 -1.99 -1.75 114.38 115.06 3n51 h ARG 377 Ca -0.39 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 58.81 3n51 h ARG 377 Cb 1.28 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 30.77 3n51 h ARG 377 CO 0.47 0.11 -0.06 0.00 -1.51 0.00 0.00 179.97 178.97 3n51 h ALA 378 N 1.57 0.06 -0.76 2.80 0.00 -2.00 -1.01 119.26 119.92 3n51 h ALA 378 Ca 0.35 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.26 3n51 h ALA 378 Cb 0.57 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 3n51 h ALA 378 CO -0.52 -0.51 0.25 0.93 0.00 0.00 0.00 179.25 179.41 3n51 h GLU 379 N -0.05 1.18 -0.80 0.00 5.08 -1.83 -2.27 114.58 115.89 3n51 h GLU 379 Ca 0.08 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.16 3n51 h GLU 379 Cb 0.16 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.20 3n51 h GLU 379 CO -0.18 0.99 0.35 -0.07 -1.00 0.00 0.00 179.01 179.11 3n51 h LEU 380 N 1.13 1.08 -0.14 1.33 3.38 -0.93 -1.18 115.31 119.99 3n51 h LEU 380 Ca 0.25 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 3n51 h LEU 380 Cb 0.29 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 3n51 h LEU 380 CO -0.01 0.94 0.06 0.40 0.09 0.00 0.00 178.44 179.92 3n51 h ILE 381 N 1.16 1.14 -0.62 1.22 2.04 -0.83 -1.74 117.51 119.86 3n51 h ILE 381 Ca 0.27 -0.41 -0.05 0.00 1.00 0.00 0.00 64.86 65.68 3n51 h ILE 381 Cb 0.17 1.15 -0.03 0.00 -0.74 0.00 0.00 36.82 37.37 3n51 h ILE 381 CO -0.03 0.13 0.20 -0.08 0.00 0.00 0.00 178.15 178.37 3n51 h GLU 382 N 0.08 0.97 -0.91 2.37 4.81 -1.31 -1.92 114.58 118.66 3n51 h GLU 382 Ca 0.05 -0.21 0.09 0.00 -0.13 0.00 0.00 59.36 59.16 3n51 h GLU 382 Cb 0.15 -0.14 -0.07 0.00 0.63 0.00 0.00 28.75 29.31 3n51 h GLU 382 CO -0.00 0.85 0.56 0.78 -0.73 0.00 0.00 179.01 180.47 3n51 h GLY 383 N 0.89 1.43 1.25 1.92 0.00 -1.08 0.25 103.07 107.74 3n51 h GLY 383 Ca 0.20 -0.39 -0.20 0.00 0.00 0.00 0.00 47.33 46.94 3n51 h GLY 383 CO -0.01 0.20 -0.67 -1.82 0.00 0.00 0.00 176.54 174.24 3n51 h TYR 384 N 0.95 0.99 -0.49 5.60 -0.00 -1.08 -2.01 116.97 120.93 3n51 h TYR 384 Ca 0.43 -0.40 0.04 0.00 -0.00 0.00 0.00 58.73 58.80 3n51 h TYR 384 Cb 0.33 -0.17 -0.04 0.00 -0.00 0.00 0.00 36.73 36.85 3n51 h TYR 384 CO -0.03 1.21 0.24 0.87 -0.00 0.00 0.00 178.16 180.46 3n51 h LYS 385 N 0.55 0.46 -0.69 1.82 1.57 -0.98 -2.91 116.57 116.39 3n51 h LYS 385 Ca -0.02 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3n51 h LYS 385 Cb 1.28 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 33.45 3n51 h LYS 385 CO 0.14 0.31 0.46 1.49 -0.57 0.00 0.00 179.45 181.27 3n51 h GLU 386 N 0.48 0.90 -0.37 3.15 4.57 -0.29 -2.69 114.58 120.34 3n51 h GLU 386 Ca 0.21 -0.05 0.08 0.00 -1.18 0.00 0.00 59.36 58.42 3n51 h GLU 386 Cb 0.13 -0.20 -0.08 0.00 -0.16 0.00 0.00 28.75 28.44 3n51 h GLU 386 CO -0.15 0.60 -0.15 1.25 -1.18 0.00 0.00 179.01 179.38 3n51 h LEU 387 N 0.93 -0.50 0.00 1.64 5.85 -1.16 -3.51 115.31 118.56 3n51 h LEU 387 Ca 0.25 0.13 0.00 0.00 0.84 0.00 0.00 57.88 59.10 3n51 h LEU 387 Cb -0.11 0.29 0.00 0.00 0.37 0.00 0.00 40.66 41.21 3n51 h LEU 387 CO -0.05 -0.18 0.00 0.23 -0.34 0.00 0.00 178.44 178.10 3n51 n MET 388 N -5.33 0.00 0.06 1.25 2.81 -1.02 -5.08 117.12 109.80 3n51 n MET 388 Ca 0.02 0.31 0.00 0.00 -1.81 0.00 0.00 57.70 56.22 3n51 n MET 388 Cb 0.25 -0.94 0.00 0.00 -0.71 0.00 0.00 33.22 31.81 3n51 n MET 388 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 3n51 n GLU 404 N -1.44 0.00 0.12 0.03 2.13 -1.26 -5.12 120.64 115.10 3n51 n GLU 404 Ca 0.00 0.00 0.03 0.00 0.66 0.00 0.00 57.16 57.85 3n51 n GLU 404 Cb 0.00 0.00 0.42 0.00 0.27 0.00 0.00 31.44 32.13 3n51 n GLU 404 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 3n51 h HIS 405 N 0.00 0.26 -0.45 4.31 2.76 -2.03 -0.01 115.15 120.00 3n51 h HIS 405 Ca 0.00 -0.02 -0.13 0.00 -2.20 0.00 0.00 60.37 58.02 3n51 h HIS 405 Cb 0.00 -0.08 -0.01 0.00 1.55 0.00 0.00 27.41 28.87 3n51 h HIS 405 CO 0.00 0.32 -0.21 1.49 -1.30 0.00 0.00 177.93 178.23 3n51 h GLU 406 N 0.25 0.94 -0.53 5.26 4.57 -2.05 -1.80 114.58 121.22 3n51 h GLU 406 Ca 0.06 -0.41 0.05 0.00 -1.18 0.00 0.00 59.36 57.88 3n51 h GLU 406 Cb 0.26 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.78 3n51 h GLU 406 CO 0.01 1.07 0.27 0.28 -1.18 0.00 0.00 179.01 179.46 3n51 h VAL 407 N 0.77 0.95 -0.25 0.32 2.07 -1.79 -1.68 116.25 116.65 3n51 h VAL 407 Ca 0.10 -0.18 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 3n51 h VAL 407 Cb 0.79 0.39 -0.01 0.00 -1.52 0.00 0.00 31.29 30.93 3n51 h VAL 407 CO 0.06 0.10 -0.08 0.44 0.02 0.00 0.00 177.57 178.11 3n51 h ASP 408 N 0.52 0.37 0.08 0.57 3.45 -0.87 0.31 116.42 120.84 3n51 h ASP 408 Ca 0.23 -0.08 -0.11 0.00 0.43 0.00 0.00 57.03 57.51 3n51 h ASP 408 Cb 0.14 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 38.80 3n51 h ASP 408 CO -0.16 0.50 -0.35 1.56 -1.57 0.00 0.00 179.24 179.21 3n51 h GLN 409 N 0.37 0.38 0.00 3.56 1.08 -0.99 -1.36 115.11 118.16 3n51 h GLN 409 Ca 0.08 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.11 3n51 h GLN 409 Cb 0.38 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.80 3n51 h GLN 409 CO 0.02 0.69 -0.00 0.28 -0.95 0.00 0.00 178.83 178.87 3n51 h VAL 410 N 0.33 1.40 -0.45 -0.54 2.07 -0.51 -3.21 116.25 115.32 3n51 h VAL 410 Ca 0.04 -1.19 0.02 0.00 0.82 0.00 0.00 66.70 66.39 3n51 h VAL 410 Cb 0.78 2.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.72 3n51 h VAL 410 CO 0.06 0.31 0.30 -0.07 0.02 0.00 0.00 177.57 178.19 3n51 h LEU 411 N -0.51 0.47 -0.65 2.57 3.38 -0.96 0.05 115.31 119.66 3n51 h LEU 411 Ca -0.00 -0.01 0.13 0.00 0.09 0.00 0.00 57.88 58.09 3n51 h LEU 411 Cb 0.51 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 41.02 3n51 h LEU 411 CO 0.00 0.33 -0.17 -0.78 0.09 0.00 0.00 178.44 177.91 3n51 h ASP 412 N 0.55 -0.64 -0.06 -0.43 1.82 -1.26 0.14 116.42 116.55 3n51 h ASP 412 Ca 0.18 0.20 -0.08 0.00 -0.39 0.00 0.00 57.03 56.93 3n51 h ASP 412 Cb 0.03 0.41 0.00 0.00 0.68 0.00 0.00 39.33 40.46 3n51 h ASP 412 CO -0.04 -0.22 -0.28 0.00 -1.61 0.00 0.00 179.24 177.09 3n51 h ALA 413 N 1.62 0.11 0.51 -0.78 0.00 -1.30 -3.28 119.26 116.14 3n51 h ALA 413 Ca 0.31 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3n51 h ALA 413 Cb 0.48 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3n51 h ALA 413 CO -0.67 0.14 -0.24 0.28 0.00 0.00 0.00 179.25 178.75 3n51 h VAL 414 N -0.22 0.24 -3.04 0.00 2.07 -0.63 -3.41 116.25 111.27 3n51 h VAL 414 Ca -0.02 -0.49 -0.57 0.00 0.82 0.00 0.00 66.70 66.45 3n51 h VAL 414 Cb 0.93 0.36 -0.40 0.00 -1.52 0.00 0.00 31.29 30.65 3n51 h VAL 414 CO 0.06 0.04 -0.76 -0.62 0.02 0.00 0.00 177.57 176.31 3n51 s ASP 415 N -4.78 3.86 0.18 0.57 2.15 0.47 -5.03 116.67 114.09 3n51 s ASP 415 Ca -0.13 -1.60 -0.14 0.00 0.43 0.00 0.00 52.55 51.12 3n51 s ASP 415 Cb 0.01 -0.72 0.11 0.00 -0.30 0.00 0.00 42.92 42.02 3n51 s ASP 415 CO 0.42 -0.41 1.80 0.15 -0.17 0.00 0.00 175.17 176.96 3n51 h PHE 416 N 8.09 0.51 0.00 -5.34 3.57 -1.64 -2.49 116.94 119.65 3n51 h PHE 416 Ca -0.14 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.32 3n51 h PHE 416 Cb 1.01 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 3n51 h PHE 416 CO 0.35 0.27 -0.25 -0.44 -2.23 0.00 0.00 178.31 176.01 3n51 h ASP 417 N 0.54 0.00 -5.98 0.41 3.32 -1.91 -3.48 116.42 109.34 3n51 h ASP 417 Ca 0.21 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.86 3n51 h ASP 417 Cb 0.07 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.71 3n51 h ASP 417 CO -0.12 0.25 -0.79 1.17 -1.72 0.00 0.00 179.24 178.02 3n51 n LYS 418 N -3.46 -5.73 0.04 3.56 4.81 -0.94 -4.92 118.16 111.52 3n51 n LYS 418 Ca -0.00 0.70 -0.03 0.00 -0.87 0.00 0.00 58.31 58.11 3n51 n LYS 418 Cb 0.42 -5.47 0.22 0.00 0.02 0.00 0.00 35.03 30.23 3n51 n LYS 418 CO 0.00 0.00 0.00 -0.91 1.17 0.00 0.00 177.40 177.66 3n51 h ASN 419 N -1.98 0.41 0.00 3.14 2.35 -1.92 -3.48 115.58 114.10 3n51 h ASN 419 Ca -0.60 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.01 3n51 h ASN 419 Cb 1.36 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 39.62 3n51 h ASN 419 CO 0.56 0.68 0.00 0.61 -1.65 0.00 0.00 177.43 177.63 3n51 n GLY 420 N -0.37 2.95 3.96 2.83 0.00 -1.26 -5.17 105.19 108.13 3n51 n GLY 420 Ca -0.01 0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 3n51 n GLY 420 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n51 s TYR 421 N 1.91 3.34 -0.13 1.61 1.51 -1.26 -4.86 117.35 119.47 3n51 s TYR 421 Ca 0.00 0.10 -0.00 0.00 -1.01 0.00 0.00 57.07 56.16 3n51 s TYR 421 Cb 0.00 -1.92 -0.02 0.00 -0.11 0.00 0.00 41.96 39.91 3n51 s TYR 421 CO 0.00 0.07 -0.12 0.42 -1.11 0.00 0.00 175.55 174.81 3n51 s ILE 422 N -2.25 3.09 -0.38 2.71 -1.09 0.58 -4.88 121.20 118.98 3n51 s ILE 422 Ca 0.41 -0.65 -0.27 0.00 -2.23 0.00 0.00 60.65 57.92 3n51 s ILE 422 Cb -0.09 -2.30 -0.06 0.00 -1.58 0.00 0.00 42.46 38.42 3n51 s ILE 422 CO 0.34 0.52 2.34 -0.62 -1.23 0.00 0.00 174.94 176.29 3n51 n GLU 423 N 3.55 1.42 0.26 2.79 -0.58 -1.26 -0.74 120.64 126.08 3n51 n GLU 423 Ca -0.18 0.22 0.09 0.00 -0.42 0.00 0.00 57.16 56.87 3n51 n GLU 423 Cb 0.53 -3.34 0.67 0.00 -0.57 0.00 0.00 31.44 28.73 3n51 n GLU 423 CO 0.00 0.00 0.00 0.10 -0.48 0.00 0.00 177.13 176.75 3n51 h TYR 424 N 17.61 0.00 -0.59 -0.32 -0.00 -1.67 -1.53 116.97 130.47 3n51 h TYR 424 Ca -0.31 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.42 3n51 h TYR 424 Cb 1.26 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 37.96 3n51 h TYR 424 CO 0.95 0.02 0.37 0.66 -0.00 0.00 0.00 178.16 180.16 3n51 h SER 425 N 0.00 0.69 0.13 0.10 4.64 -1.89 0.13 113.55 117.35 3n51 h SER 425 Ca -0.00 -0.04 -0.05 0.00 -0.47 0.00 0.00 61.79 61.23 3n51 h SER 425 Cb 0.03 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.94 3n51 h SER 425 CO 0.00 0.52 -0.19 -0.33 -0.87 0.00 0.00 176.83 175.97 3n51 h GLU 426 N 0.80 0.13 -0.28 4.77 5.08 -1.68 -2.84 114.58 120.55 3n51 h GLU 426 Ca 0.21 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.41 3n51 h GLU 426 Cb -0.06 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 3n51 h GLU 426 CO -0.04 0.32 -0.33 0.35 -1.00 0.00 0.00 179.01 178.31 3n51 h PHE 427 N 0.12 0.88 -0.07 4.33 3.57 -0.71 -2.87 116.94 122.19 3n51 h PHE 427 Ca 0.02 -0.28 0.03 0.00 3.53 0.00 0.00 57.97 61.27 3n51 h PHE 427 Cb 0.41 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.94 3n51 h PHE 427 CO 0.00 1.04 -0.11 0.28 -2.23 0.00 0.00 178.31 177.29 3n51 h VAL 428 N 0.47 0.71 0.06 1.41 2.07 -0.57 0.38 116.25 120.78 3n51 h VAL 428 Ca 0.04 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.58 3n51 h VAL 428 Cb 0.91 0.71 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 3n51 h VAL 428 CO 0.08 0.00 -0.52 0.74 0.02 0.00 0.00 177.57 177.89 3n51 h THR 429 N -0.15 0.03 -0.15 2.57 2.02 -1.55 -1.83 112.91 113.84 3n51 h THR 429 Ca 0.06 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.26 3n51 h THR 429 Cb 0.24 0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 66.66 3n51 h THR 429 CO -0.16 0.00 0.04 0.58 0.37 0.00 0.00 175.52 176.36 3n51 h VAL 430 N -0.70 0.95 -0.47 3.16 2.07 -1.26 1.36 116.25 121.36 3n51 h VAL 430 Ca 0.01 -0.04 0.09 0.00 0.82 0.00 0.00 66.70 67.58 3n51 h VAL 430 Cb 0.73 0.83 -0.10 0.00 -1.52 0.00 0.00 31.29 31.23 3n51 h VAL 430 CO -0.32 0.02 -0.32 0.00 0.02 0.00 0.00 177.57 176.97 3n51 h ALA 431 N 1.10 -0.12 0.16 1.67 0.00 -0.78 0.50 119.26 121.79 3n51 h ALA 431 Ca 0.07 0.13 -0.32 0.00 0.00 0.00 0.00 54.91 54.78 3n51 h ALA 431 Cb 0.05 0.72 0.01 0.00 0.00 0.00 0.00 17.79 18.57 3n51 h ALA 431 CO -0.08 -0.70 -1.59 0.52 0.00 0.00 0.00 179.25 177.40 3n51 h MET 432 N -0.21 0.35 0.00 0.00 2.86 -1.05 -1.67 114.93 115.20 3n51 h MET 432 Ca 0.19 -0.59 0.00 0.00 -2.06 0.00 0.00 59.70 57.24 3n51 h MET 432 Cb 0.54 0.22 0.00 0.00 0.06 0.00 0.00 31.60 32.42 3n51 h MET 432 CO -0.59 1.28 0.00 -3.47 1.06 0.00 0.00 176.91 175.20 3n51 n ASP 433 N -3.73 0.00 -0.12 1.22 2.03 0.46 -2.57 116.55 113.85 3n51 n ASP 433 Ca -0.24 0.36 -0.21 0.00 0.52 0.00 0.00 54.79 55.22 3n51 n ASP 433 Cb 1.01 -0.43 -0.07 0.00 -0.72 0.00 0.00 41.12 40.90 3n51 n ASP 433 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3n51 n ARG 434 N -1.43 0.56 -0.08 -0.67 1.74 0.16 -4.70 116.66 112.24 3n51 n ARG 434 Ca 0.05 0.29 0.26 0.00 -0.77 0.00 0.00 57.85 57.67 3n51 n ARG 434 Cb 0.16 -1.51 0.65 0.00 -1.02 0.00 0.00 32.46 30.74 3n51 n ARG 434 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 3n51 h LYS 435 N -1.00 0.00 0.00 5.56 3.64 -1.02 1.04 116.57 124.79 3n51 h LYS 435 Ca -0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.98 3n51 h LYS 435 Cb 1.32 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 3n51 h LYS 435 CO -0.24 0.00 0.00 0.25 -2.27 0.00 0.00 179.45 177.19 3n51 n THR 436 N -3.60 0.00 0.29 1.00 -2.24 -1.08 -4.25 114.28 104.39 3n51 n THR 436 Ca 0.16 0.00 -0.18 0.00 -2.27 0.00 0.00 64.05 61.76 3n51 n THR 436 Cb 1.03 -0.47 -0.09 0.00 -2.10 0.00 0.00 70.33 68.70 3n51 n THR 436 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3n51 h LEU 437 N 0.00 -1.30 -0.92 3.22 5.85 0.84 -1.80 115.31 121.21 3n51 h LEU 437 Ca 0.00 0.10 0.24 0.00 0.84 0.00 0.00 57.88 59.07 3n51 h LEU 437 Cb 0.00 0.43 -0.13 0.00 0.37 0.00 0.00 40.66 41.32 3n51 h LEU 437 CO 0.00 -0.64 0.39 0.25 -0.34 0.00 0.00 178.44 178.10 3n51 h LEU 438 N -0.96 0.29 -0.30 2.25 5.85 -1.81 0.36 115.31 120.99 3n51 h LEU 438 Ca -0.05 0.17 -0.20 0.00 0.84 0.00 0.00 57.88 58.64 3n51 h LEU 438 Cb 0.84 0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.04 3n51 h LEU 438 CO -0.06 -0.06 -0.70 0.77 -0.34 0.00 0.00 178.44 178.05 3n51 h SER 439 N 0.34 0.78 0.13 1.25 4.64 -1.83 -1.50 113.55 117.36 3n51 h SER 439 Ca 0.60 -0.48 -0.16 0.00 -0.47 0.00 0.00 61.79 61.27 3n51 h SER 439 Cb 1.20 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 3n51 h SER 439 CO -0.58 1.25 -0.59 0.03 -0.87 0.00 0.00 176.83 176.08 3n51 h ARG 440 N 0.48 0.47 0.10 4.77 3.08 0.44 -0.76 114.38 122.95 3n51 h ARG 440 Ca -0.03 -0.31 -0.29 0.00 0.07 0.00 0.00 59.98 59.42 3n51 h ARG 440 Cb 1.29 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.37 3n51 h ARG 440 CO 0.14 0.92 -1.47 0.93 -1.07 0.00 0.00 179.97 179.41 3n51 h GLU 441 N 0.35 0.21 -0.36 0.04 5.08 -0.74 -2.71 114.58 116.45 3n51 h GLU 441 Ca -0.00 -0.35 -0.05 0.00 -1.00 0.00 0.00 59.36 57.95 3n51 h GLU 441 Cb 1.12 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.49 3n51 h GLU 441 CO 0.10 1.06 -0.01 -0.09 -1.00 0.00 0.00 179.01 179.08 3n51 h ARG 442 N 0.06 0.56 -0.12 2.33 2.43 -1.27 0.29 114.38 118.66 3n51 h ARG 442 Ca -0.22 -0.13 -0.02 0.00 -0.81 0.00 0.00 59.98 58.81 3n51 h ARG 442 Cb 1.99 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 31.46 3n51 h ARG 442 CO 0.15 0.60 -0.01 1.25 -1.51 0.00 0.00 179.97 180.46 3n51 h LEU 443 N 0.54 0.21 -0.33 3.80 5.85 -1.14 -1.30 115.31 122.94 3n51 h LEU 443 Ca 0.11 -0.32 0.02 0.00 0.84 0.00 0.00 57.88 58.53 3n51 h LEU 443 Cb 0.36 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.31 3n51 h LEU 443 CO 0.01 0.48 0.18 -0.08 -0.34 0.00 0.00 178.44 178.70 3n51 h GLU 444 N -0.06 0.36 -1.00 1.25 4.81 -1.33 -1.09 114.58 117.51 3n51 h GLU 444 Ca 0.03 -0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.34 3n51 h GLU 444 Cb 0.38 -0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.60 3n51 h GLU 444 CO 0.01 0.24 0.64 0.00 -0.73 0.00 0.00 179.01 179.16 3n51 h ARG 445 N 0.37 1.04 -0.27 1.92 3.08 -0.87 0.57 114.38 120.22 3n51 h ARG 445 Ca 0.13 -0.06 -0.17 0.00 0.07 0.00 0.00 59.98 59.95 3n51 h ARG 445 Cb 0.03 -0.23 -0.00 0.00 0.08 0.00 0.00 29.97 29.84 3n51 h ARG 445 CO -0.08 0.69 -0.52 0.00 -1.07 0.00 0.00 179.97 178.98 3n51 h ALA 446 N 1.51 0.56 -0.12 0.04 0.00 -0.67 -0.99 119.26 119.58 3n51 h ALA 446 Ca 0.47 -0.50 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3n51 h ALA 446 Cb 0.35 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3n51 h ALA 446 CO -0.22 0.68 0.07 0.35 0.00 0.00 0.00 179.25 180.13 3n51 h PHE 447 N 0.61 0.16 -0.66 0.00 3.57 -0.73 -0.30 116.94 119.60 3n51 h PHE 447 Ca 0.02 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.51 3n51 h PHE 447 Cb 1.11 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.76 3n51 h PHE 447 CO 0.06 0.16 0.40 0.00 -2.23 0.00 0.00 178.31 176.70 3n51 h ARG 448 N 0.11 0.90 -0.26 1.11 2.47 -0.81 -1.01 114.38 116.90 3n51 h ARG 448 Ca 0.04 -0.08 -0.01 0.00 -1.26 0.00 0.00 59.98 58.67 3n51 h ARG 448 Cb 0.05 -0.19 -0.01 0.00 -1.65 0.00 0.00 29.97 28.17 3n51 h ARG 448 CO -0.01 0.64 0.11 1.98 0.56 0.00 0.00 179.97 183.25 3n51 h MET 449 N 0.90 0.38 -0.77 0.04 4.05 -1.02 -2.63 114.93 115.88 3n51 h MET 449 Ca 0.24 -0.07 0.08 0.00 -0.28 0.00 0.00 59.70 59.67 3n51 h MET 449 Cb -0.03 -0.06 -0.05 0.00 -0.80 0.00 0.00 31.60 30.65 3n51 h MET 449 CO -0.04 0.41 0.50 0.35 0.23 0.00 0.00 176.91 178.36 3n51 h PHE 450 N 0.27 0.79 -0.03 1.39 3.57 -0.82 -3.31 116.94 118.81 3n51 h PHE 450 Ca 0.09 0.02 -0.71 0.00 3.53 0.00 0.00 57.97 60.90 3n51 h PHE 450 Cb 0.17 -0.26 -0.04 0.00 2.79 0.00 0.00 35.95 38.61 3n51 h PHE 450 CO -0.01 0.39 3.15 -3.47 -2.23 0.00 0.00 178.31 176.14 3n51 n ASP 451 N -4.49 4.11 0.16 0.41 2.03 -0.40 -4.79 116.55 113.57 3n51 n ASP 451 Ca 0.12 -2.83 0.05 0.00 0.52 0.00 0.00 54.79 52.65 3n51 n ASP 451 Cb 0.28 -1.65 0.50 0.00 -0.72 0.00 0.00 41.12 39.52 3n51 n ASP 451 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3n51 h SER 452 N 5.95 0.17 -0.09 1.67 4.64 -1.75 -1.32 113.55 122.82 3n51 h SER 452 Ca 0.58 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.88 3n51 h SER 452 Cb 0.62 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.67 3n51 h SER 452 CO 1.88 0.22 0.00 0.47 -0.87 0.00 0.00 176.83 178.53 3n51 n ASP 453 N -4.41 1.37 -3.82 4.97 8.00 -1.26 -4.94 116.55 116.46 3n51 n ASP 453 Ca -0.01 -1.57 -0.28 0.00 0.71 0.00 0.00 54.79 53.64 3n51 n ASP 453 Cb 0.16 -0.06 0.04 0.00 -0.02 0.00 0.00 41.12 41.25 3n51 n ASP 453 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3n51 n ASN 454 N 0.10 -4.91 0.18 -2.24 4.13 -0.50 -4.89 115.26 107.14 3n51 n ASN 454 Ca 0.17 -0.72 0.06 0.00 1.68 0.00 0.00 54.58 55.77 3n51 n ASN 454 Cb 0.30 -4.19 0.16 0.00 -1.54 0.00 0.00 39.78 34.51 3n51 n ASN 454 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 3n51 h SER 455 N -2.22 0.00 0.00 6.41 4.64 -1.92 -3.47 113.55 116.98 3n51 h SER 455 Ca -0.58 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.74 3n51 h SER 455 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 3n51 h SER 455 CO 0.64 0.33 0.00 0.61 -0.87 0.00 0.00 176.83 177.54 3n51 n GLY 456 N 0.95 0.77 3.07 -0.77 0.00 -1.26 -5.01 105.19 102.93 3n51 n GLY 456 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 3n51 n GLY 456 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n51 s LYS 457 N -0.10 0.55 -0.15 1.61 1.02 -1.26 -4.00 119.74 117.40 3n51 s LYS 457 Ca 0.00 -0.88 0.00 0.00 0.02 0.00 0.00 55.97 55.11 3n51 s LYS 457 Cb 0.00 -0.13 -0.00 0.00 -0.52 0.00 0.00 37.83 37.18 3n51 s LYS 457 CO 0.00 -0.00 -0.16 0.42 -0.92 0.00 0.00 175.35 174.69 3n51 s ILE 458 N -2.10 2.61 0.84 2.17 1.01 -0.29 -4.94 121.20 120.49 3n51 s ILE 458 Ca -0.05 -0.79 -0.11 0.00 0.00 0.00 0.00 60.65 59.70 3n51 s ILE 458 Cb -0.05 -2.09 0.09 0.00 0.01 0.00 0.00 42.46 40.42 3n51 s ILE 458 CO -0.02 0.52 1.09 -0.94 0.00 0.00 0.00 174.94 175.59 3n51 s SER 459 N 0.79 3.97 0.27 3.58 1.04 -1.26 -1.61 113.70 120.49 3n51 s SER 459 Ca -0.06 1.64 -0.03 0.00 0.48 0.00 0.00 55.95 57.98 3n51 s SER 459 Cb -0.15 -2.33 0.36 0.00 0.10 0.00 0.00 66.02 64.00 3n51 s SER 459 CO 0.00 -2.34 1.87 -1.28 0.98 0.00 0.00 173.24 172.47 3n51 h SER 460 N -1.34 0.92 -0.60 7.02 0.87 -1.60 0.17 113.55 118.99 3n51 h SER 460 Ca -0.47 -0.10 0.06 0.00 -1.23 0.00 0.00 61.79 60.05 3n51 h SER 460 Cb 1.26 -0.24 -0.05 0.00 -0.44 0.00 0.00 62.40 62.93 3n51 h SER 460 CO 0.53 0.78 0.31 0.74 -0.53 0.00 0.00 176.83 178.66 3n51 h THR 461 N 1.01 0.94 -0.31 2.23 2.02 -1.93 -0.51 112.91 116.36 3n51 h THR 461 Ca 0.25 -0.20 -0.15 0.00 0.77 0.00 0.00 66.41 67.08 3n51 h THR 461 Cb 0.11 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 3n51 h THR 461 CO -0.03 0.11 -0.41 -0.33 0.37 0.00 0.00 175.52 175.23 3n51 h GLU 462 N 0.58 0.74 -0.79 6.66 5.08 -1.62 -2.62 114.58 122.60 3n51 h GLU 462 Ca 0.27 -0.39 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3n51 h GLU 462 Cb 0.19 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 3n51 h GLU 462 CO -0.19 1.01 0.51 -0.07 -1.00 0.00 0.00 179.01 179.27 3n51 h LEU 463 N 0.61 0.93 -0.83 1.33 3.38 -0.74 0.61 115.31 120.59 3n51 h LEU 463 Ca 0.05 -0.04 0.03 0.00 0.09 0.00 0.00 57.88 58.01 3n51 h LEU 463 Cb 0.95 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.42 3n51 h LEU 463 CO 0.09 0.69 0.53 0.00 0.09 0.00 0.00 178.44 179.84 3n51 h ALA 464 N 1.28 1.09 0.21 1.53 0.00 -0.81 0.15 119.26 122.70 3n51 h ALA 464 Ca 0.29 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 3n51 h ALA 464 Cb -0.09 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.42 3n51 h ALA 464 CO -0.06 0.37 -0.10 1.15 0.00 0.00 0.00 179.25 180.61 3n51 h THR 465 N 1.04 0.88 -0.39 0.00 2.02 -1.16 -0.49 112.91 114.81 3n51 h THR 465 Ca 0.33 -0.61 0.03 0.00 0.77 0.00 0.00 66.41 66.93 3n51 h THR 465 Cb -0.00 1.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.61 3n51 h THR 465 CO -0.11 0.13 0.20 0.40 0.37 0.00 0.00 175.52 176.51 3n51 h ILE 466 N -0.59 0.99 -0.05 3.11 2.04 -0.51 -1.31 117.51 121.18 3n51 h ILE 466 Ca -0.03 -0.14 -0.17 0.00 1.00 0.00 0.00 64.86 65.53 3n51 h ILE 466 Cb 0.43 0.54 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3n51 h ILE 466 CO 0.05 0.07 -0.70 -0.26 0.00 0.00 0.00 178.15 177.32 3n51 h PHE 467 N 0.41 0.35 0.58 1.37 0.04 -0.76 -2.22 116.94 116.71 3n51 h PHE 467 Ca 0.17 -0.15 -0.02 0.00 2.80 0.00 0.00 57.97 60.76 3n51 h PHE 467 Cb 0.07 -0.06 -0.01 0.00 2.20 0.00 0.00 35.95 38.15 3n51 h PHE 467 CO -0.10 0.87 -0.41 0.78 -0.60 0.00 0.00 178.31 178.85 3n51 h GLY 468 N 1.53 -1.08 -0.26 -1.45 0.00 -0.63 0.37 103.07 101.55 3n51 h GLY 468 Ca -0.02 0.47 0.29 0.00 0.00 0.00 0.00 47.33 48.07 3n51 h GLY 468 CO 0.11 -0.37 0.71 -2.08 0.00 0.00 0.00 176.54 174.91 3n51 h VAL 469 N -0.96 0.47 -0.02 4.60 2.07 -1.26 -0.56 116.25 120.58 3n51 h VAL 469 Ca -0.07 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.35 3n51 h VAL 469 Cb 0.80 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.70 3n51 h VAL 469 CO 0.03 0.06 0.00 -1.20 0.02 0.00 0.00 177.57 176.48 3n51 n SER 470 N -4.57 1.08 -2.65 0.57 7.64 -0.65 -4.86 113.62 110.19 3n51 n SER 470 Ca 0.26 -1.38 -0.19 0.00 1.01 0.00 0.00 58.87 58.57 3n51 n SER 470 Cb 0.98 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 64.18 3n51 n SER 470 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3n51 n ASP 471 N -0.14 -5.16 -4.58 6.43 2.03 -0.06 -4.96 116.55 110.10 3n51 n ASP 471 Ca 0.20 -0.05 -0.41 0.00 0.52 0.00 0.00 54.79 55.04 3n51 n ASP 471 Cb 0.28 -4.28 -0.07 0.00 -0.72 0.00 0.00 41.12 36.33 3n51 n ASP 471 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3n51 s VAL 472 N -2.94 4.98 0.12 5.18 1.01 -0.19 -5.02 120.40 123.54 3n51 s VAL 472 Ca 0.11 0.62 -0.35 0.00 0.00 0.00 0.00 61.98 62.36 3n51 s VAL 472 Cb -0.05 -3.97 -0.17 0.00 0.00 0.00 0.00 36.38 32.19 3n51 s VAL 472 CO 0.14 -0.16 1.23 -0.67 0.00 0.00 0.00 175.10 175.64 3n51 n ASP 473 N 5.80 1.35 -0.01 3.32 2.03 -1.26 -4.43 116.55 123.34 3n51 n ASP 473 Ca -0.03 1.13 -0.10 0.00 0.52 0.00 0.00 54.79 56.32 3n51 n ASP 473 Cb 0.49 -1.18 -0.03 0.00 -0.72 0.00 0.00 41.12 39.68 3n51 n ASP 473 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3n51 h SER 474 N 3.89 -0.82 -0.10 1.67 0.02 -1.95 -1.28 113.55 114.98 3n51 h SER 474 Ca -0.46 0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 60.58 3n51 h SER 474 Cb 1.35 0.36 -0.01 0.00 0.14 0.00 0.00 62.40 64.24 3n51 h SER 474 CO 0.73 -0.31 -0.06 -0.08 -1.14 0.00 0.00 176.83 175.97 3n51 h GLU 475 N -0.31 0.38 0.15 3.45 4.81 -2.00 -2.85 114.58 118.21 3n51 h GLU 475 Ca 0.11 -0.08 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 3n51 h GLU 475 Cb 0.48 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.81 3n51 h GLU 475 CO -0.34 0.46 -0.07 1.15 -0.73 0.00 0.00 179.01 179.48 3n51 h THR 476 N 0.36 0.95 0.00 0.32 2.02 -1.64 -2.47 112.91 112.45 3n51 h THR 476 Ca 0.08 -0.45 -0.11 0.00 0.77 0.00 0.00 66.41 66.70 3n51 h THR 476 Cb 0.35 1.23 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 3n51 h THR 476 CO 0.02 0.11 -0.50 4.11 0.37 0.00 0.00 175.52 179.62 3n51 h TRP 477 N -0.42 0.00 -0.46 3.16 5.08 -1.17 -2.33 115.95 119.81 3n51 h TRP 477 Ca -0.02 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 59.83 3n51 h TRP 477 Cb 0.33 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.48 3n51 h TRP 477 CO -0.00 0.50 -0.19 0.87 -1.28 0.00 0.00 178.44 178.34 3n51 h LYS 478 N 0.00 0.91 -0.30 0.12 1.57 -1.56 0.09 116.57 117.41 3n51 h LYS 478 Ca -0.01 -0.37 -0.00 0.00 -1.87 0.00 0.00 60.65 58.40 3n51 h LYS 478 Cb 0.95 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.20 3n51 h LYS 478 CO 0.07 1.02 0.17 1.03 -0.57 0.00 0.00 179.45 181.17 3n51 h SER 479 N 0.80 0.36 -0.74 0.86 0.87 -1.09 -0.86 113.55 113.75 3n51 h SER 479 Ca 0.11 -0.07 -0.04 0.00 -1.23 0.00 0.00 61.79 60.56 3n51 h SER 479 Cb 0.74 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.58 3n51 h SER 479 CO 0.06 0.33 0.29 0.58 -0.53 0.00 0.00 176.83 177.56 3n51 h VAL 480 N 0.37 1.25 -0.55 2.23 2.07 -1.26 -1.92 116.25 118.45 3n51 h VAL 480 Ca 0.11 -0.80 0.02 0.00 0.82 0.00 0.00 66.70 66.85 3n51 h VAL 480 Cb 0.04 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 3n51 h VAL 480 CO -0.02 0.33 0.33 0.25 0.02 0.00 0.00 177.57 178.48 3n51 h LEU 481 N 1.10 0.54 -1.02 2.57 5.85 -0.70 -0.84 115.31 122.81 3n51 h LEU 481 Ca 0.25 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.98 3n51 h LEU 481 Cb 0.21 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.09 3n51 h LEU 481 CO -0.02 0.38 0.62 -1.28 -0.34 0.00 0.00 178.44 177.80 3n51 h SER 482 N 0.65 1.12 -0.34 1.25 0.87 -0.67 -0.18 113.55 116.25 3n51 h SER 482 Ca 0.22 -0.04 -0.13 0.00 -1.23 0.00 0.00 61.79 60.61 3n51 h SER 482 Cb 0.02 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.68 3n51 h SER 482 CO -0.09 0.83 -0.26 -0.33 -0.53 0.00 0.00 176.83 176.45 3n51 h GLU 483 N 1.32 0.85 -0.30 2.24 5.08 -0.76 -2.98 114.58 120.03 3n51 h GLU 483 Ca 0.35 -0.37 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 3n51 h GLU 483 Cb -0.12 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 3n51 h GLU 483 CO -0.07 1.01 -0.25 0.28 -1.00 0.00 0.00 179.01 178.97 3n51 h VAL 484 N 0.73 1.30 -2.02 3.13 2.07 -0.64 -3.42 116.25 117.39 3n51 h VAL 484 Ca 0.09 -1.41 -0.34 0.00 0.82 0.00 0.00 66.70 65.86 3n51 h VAL 484 Cb 0.80 1.53 -0.32 0.00 -1.52 0.00 0.00 31.29 31.79 3n51 h VAL 484 CO 0.07 0.45 -0.66 -0.62 0.02 0.00 0.00 177.57 176.83 3n51 s ASP 485 N -6.51 1.35 0.27 0.57 -1.08 -0.13 -5.02 116.67 106.13 3n51 s ASP 485 Ca -0.12 -1.14 0.01 0.00 -0.52 0.00 0.00 52.55 50.77 3n51 s ASP 485 Cb 0.09 0.57 0.58 0.00 -1.46 0.00 0.00 42.92 42.69 3n51 s ASP 485 CO 0.83 -0.32 1.77 0.11 0.52 0.00 0.00 175.17 178.07 3n51 h LYS 486 N 7.66 0.67 -1.06 4.34 1.79 -1.76 -1.82 116.57 126.39 3n51 h LYS 486 Ca -0.04 -0.04 -0.39 0.00 -2.18 0.00 0.00 60.65 58.00 3n51 h LYS 486 Cb 1.07 -0.15 -0.22 0.00 -1.58 0.00 0.00 32.23 31.35 3n51 h LYS 486 CO 0.26 0.44 0.50 0.09 -1.08 0.00 0.00 179.45 179.67 3n51 n ASN 487 N -4.83 4.24 -4.77 0.86 3.02 -1.26 -4.96 115.26 107.56 3n51 n ASN 487 Ca 0.19 -3.20 -0.35 0.00 -0.03 0.00 0.00 54.58 51.19 3n51 n ASN 487 Cb 0.46 -0.80 0.01 0.00 -0.61 0.00 0.00 39.78 38.84 3n51 n ASN 487 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3n51 s ASN 488 N -0.66 5.62 -0.30 6.41 2.20 -0.69 -4.95 114.94 122.58 3n51 s ASN 488 Ca 0.42 2.17 0.07 0.00 -0.94 0.00 0.00 52.86 54.58 3n51 s ASN 488 Cb 0.35 -2.58 0.46 0.00 -2.00 0.00 0.00 41.25 37.48 3n51 s ASN 488 CO 0.06 -1.29 1.18 -0.90 -2.94 0.00 0.00 177.10 173.22 3n51 n ASP 489 N -1.44 4.88 -2.08 3.54 5.75 -1.26 -4.90 116.55 121.04 3n51 n ASP 489 Ca 0.12 -3.73 -0.15 0.00 -0.01 0.00 0.00 54.79 51.02 3n51 n ASP 489 Cb 0.51 -0.35 0.03 0.00 -1.03 0.00 0.00 41.12 40.28 3n51 n ASP 489 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3n51 n GLY 490 N -0.70 -0.11 3.55 6.12 0.00 -1.26 -4.99 105.19 107.81 3n51 n GLY 490 Ca 0.43 -0.18 -0.14 0.00 0.00 0.00 0.00 46.02 46.14 3n51 n GLY 490 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3n51 s GLU 491 N -5.32 0.82 0.02 1.61 -1.05 -1.26 -1.34 118.70 112.17 3n51 s GLU 491 Ca 0.21 0.18 0.04 0.00 -0.15 0.00 0.00 54.97 55.25 3n51 s GLU 491 Cb -0.09 0.39 -0.02 0.00 -0.44 0.00 0.00 34.13 33.97 3n51 s GLU 491 CO 0.26 -0.26 -0.12 0.14 0.95 0.00 0.00 175.26 176.23 3n51 s VAL 492 N -1.22 0.95 0.86 1.83 -7.23 -0.63 -4.94 120.40 110.02 3n51 s VAL 492 Ca -0.06 -0.75 -0.13 0.00 -1.81 0.00 0.00 61.98 59.24 3n51 s VAL 492 Cb -0.00 -0.84 0.19 0.00 0.56 0.00 0.00 36.38 36.29 3n51 s VAL 492 CO 0.05 0.09 1.17 -0.90 -0.31 0.00 0.00 175.10 175.20 3n51 n ASP 493 N 2.31 0.28 -0.08 4.85 5.68 -1.26 -1.14 116.55 127.19 3n51 n ASP 493 Ca -0.16 -1.54 -0.09 0.00 -0.50 0.00 0.00 54.79 52.50 3n51 n ASP 493 Cb 0.55 -0.87 -0.02 0.00 -1.14 0.00 0.00 41.12 39.64 3n51 n ASP 493 CO 0.00 0.00 0.00 0.15 -1.33 0.00 0.00 177.20 176.02 3n51 h PHE 494 N -1.52 0.36 -0.62 2.11 3.57 -1.99 -1.43 116.94 117.42 3n51 h PHE 494 Ca -0.38 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.07 3n51 h PHE 494 Cb 1.09 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 39.68 3n51 h PHE 494 CO 0.00 0.22 0.16 0.22 -2.23 0.00 0.00 178.31 176.68 3n51 h ASP 495 N 0.38 0.90 -0.48 0.41 3.58 -1.95 0.40 116.42 119.67 3n51 h ASP 495 Ca 0.10 -0.17 -0.07 0.00 0.42 0.00 0.00 57.03 57.32 3n51 h ASP 495 Cb -0.04 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 40.75 3n51 h ASP 495 CO -0.02 0.87 0.04 -0.33 -2.88 0.00 0.00 179.24 176.91 3n51 h GLU 496 N 0.92 0.82 0.00 0.28 5.08 -1.89 0.56 114.58 120.36 3n51 h GLU 496 Ca 0.20 -0.24 0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3n51 h GLU 496 Cb 0.32 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 3n51 h GLU 496 CO -0.00 0.85 -0.08 0.35 -1.00 0.00 0.00 179.01 179.12 3n51 h PHE 497 N 0.68 -0.21 -0.78 4.33 3.57 -0.72 0.67 116.94 124.48 3n51 h PHE 497 Ca 0.14 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.72 3n51 h PHE 497 Cb 0.45 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 39.24 3n51 h PHE 497 CO 0.03 -0.13 0.51 0.37 -2.23 0.00 0.00 178.31 176.86 3n51 h GLN 498 N -0.15 0.77 -0.48 1.11 4.15 -0.78 -0.99 115.11 118.73 3n51 h GLN 498 Ca 0.03 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.34 3n51 h GLN 498 Cb 0.19 -0.17 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 3n51 h GLN 498 CO -0.08 0.51 0.05 1.96 -1.93 0.00 0.00 178.83 179.34 3n51 h GLN 499 N 0.79 0.82 0.13 1.69 4.20 -0.18 -1.55 115.11 121.00 3n51 h GLN 499 Ca 0.34 -0.24 0.01 0.00 0.06 0.00 0.00 58.65 58.83 3n51 h GLN 499 Cb 0.31 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 3n51 h GLN 499 CO -0.12 0.84 -0.18 0.52 -0.67 0.00 0.00 178.83 179.21 3n51 h MET 500 N 0.69 -0.36 -0.97 1.46 2.86 0.10 -1.95 114.93 116.76 3n51 h MET 500 Ca 0.14 0.02 0.13 0.00 -2.06 0.00 0.00 59.70 57.94 3n51 h MET 500 Cb 0.44 0.08 -0.08 0.00 0.06 0.00 0.00 31.60 32.09 3n51 h MET 500 CO 0.01 -0.24 0.61 -0.07 1.06 0.00 0.00 176.91 178.29 3n51 h LEU 501 N -0.37 0.84 -0.60 1.22 3.38 -1.09 0.04 115.31 118.73 3n51 h LEU 501 Ca 0.02 0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 3n51 h LEU 501 Cb 0.38 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 3n51 h LEU 501 CO -0.08 0.43 0.24 -0.07 0.09 0.00 0.00 178.44 179.04 3n51 h LEU 502 N 0.89 0.82 -1.24 1.67 3.38 -0.90 -2.54 115.31 117.40 3n51 h LEU 502 Ca 0.49 -0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.25 3n51 h LEU 502 Cb 0.59 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 3n51 h LEU 502 CO -0.26 0.77 -0.20 0.11 0.09 0.00 0.00 178.44 178.95 3n51 h LYS 503 N 0.83 0.00 -0.00 1.13 1.57 -0.51 0.05 116.57 119.64 3n51 h LYS 503 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 3n51 h LYS 503 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3n51 h LYS 503 CO -0.02 0.20 -0.03 1.28 -0.57 0.00 0.00 179.45 180.31 3n51 n LEU 504 N -3.41 0.21 -2.41 2.94 4.77 -0.10 -3.40 117.00 115.60 3n51 n LEU 504 Ca -0.00 0.09 -0.13 0.00 -0.03 0.00 0.00 56.01 55.94 3n51 n LEU 504 Cb 0.40 -0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.36 3n51 n LEU 504 CO 0.33 0.04 0.09 0.00 -1.33 0.00 0.00 177.39 176.51 3n51 n GLY 506 N -0.64 0.37 0.00 0.00 0.00 -1.22 -4.89 105.19 98.80 3n51 n GLY 506 Ca 0.27 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3n51 n GLY 506 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02