#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k0f n HIS 15 N 0.00 0.97 -4.04 4.31 8.25 -1.26 -4.91 115.22 118.54 3k0f n HIS 15 Ca 0.00 -0.42 -0.23 0.00 -0.26 0.00 0.00 57.72 56.81 3k0f n HIS 15 Cb 0.00 -0.11 -0.06 0.00 1.12 0.00 0.00 29.99 30.94 3k0f n HIS 15 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3k0f s GLN 16 N -1.54 2.43 0.64 -0.41 -1.52 -1.26 -5.12 119.66 112.88 3k0f s GLN 16 Ca 0.38 -1.51 -0.13 0.00 -1.95 0.00 0.00 55.36 52.15 3k0f s GLN 16 Cb 0.23 -2.23 -0.02 0.00 -0.22 0.00 0.00 33.01 30.77 3k0f s GLN 16 CO 0.22 0.10 1.05 0.00 -0.25 0.00 0.00 175.29 176.41 3k0f s ALA 17 N -2.41 2.78 0.17 6.09 0.00 -1.26 -4.92 121.76 122.21 3k0f s ALA 17 Ca 0.38 0.18 -0.33 0.00 0.00 0.00 0.00 51.96 52.19 3k0f s ALA 17 Cb -0.03 -3.18 -0.15 0.00 0.00 0.00 0.00 23.12 19.76 3k0f s ALA 17 CO 0.23 -0.93 1.22 0.44 0.00 0.00 0.00 175.76 176.72 3k0f n ILE 18 N -2.58 0.78 -3.44 0.00 -5.35 -1.26 -4.95 119.36 102.56 3k0f n ILE 18 Ca 0.08 -0.19 -0.29 0.00 -0.27 0.00 0.00 62.75 62.07 3k0f n ILE 18 Cb 0.53 -0.92 -0.04 0.00 -1.74 0.00 0.00 39.64 37.47 3k0f n ILE 18 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3k0f s ALA 19 N -0.08 3.66 0.17 -1.28 0.00 -1.26 -4.93 121.76 118.04 3k0f s ALA 19 Ca 0.74 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 52.22 3k0f s ALA 19 Cb -0.84 -2.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 3k0f s ALA 19 CO 0.51 0.38 0.12 0.15 0.00 0.00 0.00 175.76 176.91 3k0f s LYS 20 N -3.26 2.82 -0.23 0.00 1.02 -1.26 -1.27 119.74 117.56 3k0f s LYS 20 Ca 0.44 -0.92 -0.03 0.00 0.02 0.00 0.00 55.97 55.48 3k0f s LYS 20 Cb -0.11 -2.59 0.01 0.00 -0.52 0.00 0.00 37.83 34.61 3k0f s LYS 20 CO 0.27 0.48 -0.05 1.41 -0.92 0.00 0.00 175.35 176.53 3k0f s MET 21 N -3.12 3.14 0.25 1.68 -2.45 0.23 -4.80 119.30 114.24 3k0f s MET 21 Ca 0.30 -0.78 -0.31 0.00 -1.25 0.00 0.00 55.69 53.66 3k0f s MET 21 Cb -0.10 -2.99 -0.12 0.00 1.25 0.00 0.00 34.83 32.88 3k0f s MET 21 CO 0.23 -0.28 1.66 0.54 1.05 0.00 0.00 175.02 178.21 3k0f n ARG 22 N 4.74 2.74 0.04 4.11 1.74 -1.21 -1.11 116.66 127.72 3k0f n ARG 22 Ca -0.18 0.98 0.06 0.00 -0.77 0.00 0.00 57.85 57.94 3k0f n ARG 22 Cb 0.49 -2.80 -0.07 0.00 -1.02 0.00 0.00 32.46 29.06 3k0f n ARG 22 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3k0f n THR 23 N 3.02 0.74 -0.74 0.55 -2.24 -1.26 -4.92 114.28 109.43 3k0f n THR 23 Ca 0.12 -0.61 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 3k0f n THR 23 Cb 0.36 -0.41 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 3k0f n THR 23 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3k0f n MET 24 N -2.67 -0.19 -2.39 -0.78 2.81 -1.26 -4.71 117.12 107.94 3k0f n MET 24 Ca -0.07 0.05 -0.43 0.00 -1.81 0.00 0.00 57.70 55.44 3k0f n MET 24 Cb 0.70 -3.80 -0.02 0.00 -0.71 0.00 0.00 33.22 29.38 3k0f n MET 24 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 3k0f s ILE 25 N -2.04 4.13 -0.16 2.02 1.01 -1.26 -4.90 121.20 120.00 3k0f s ILE 25 Ca 0.00 1.31 -0.40 0.00 0.00 0.00 0.00 60.65 61.56 3k0f s ILE 25 Cb 0.00 -4.05 -0.17 0.00 0.01 0.00 0.00 42.46 38.25 3k0f s ILE 25 CO 0.00 -0.34 1.52 1.21 0.00 0.00 0.00 174.94 177.33 3k0f n GLU 26 N 7.12 0.87 0.00 2.79 0.00 -1.26 -1.06 120.64 129.11 3k0f n GLU 26 Ca 0.15 0.32 0.00 0.00 0.00 0.00 0.00 57.16 57.63 3k0f n GLU 26 Cb 0.46 -1.94 0.00 0.00 0.00 0.00 0.00 31.44 29.96 3k0f n GLU 26 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3k0f n GLY 27 N 3.33 2.58 0.07 8.31 0.00 -1.25 -0.83 105.19 117.39 3k0f n GLY 27 Ca 0.24 -0.19 -0.12 0.00 0.00 0.00 0.00 46.02 45.95 3k0f n GLY 27 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3k0f h PHE 28 N 0.00 0.08 -0.09 1.61 3.57 -1.41 -2.88 116.94 117.82 3k0f h PHE 28 Ca 0.00 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.52 3k0f h PHE 28 Cb 0.00 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.71 3k0f h PHE 28 CO 0.00 0.29 0.12 -0.44 -2.23 0.00 0.00 178.31 176.04 3k0f h ASP 29 N -0.15 0.00 -0.02 0.41 5.19 -1.90 0.15 116.42 120.10 3k0f h ASP 29 Ca 0.01 0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 56.17 3k0f h ASP 29 Cb 0.25 0.00 0.02 0.00 0.18 0.00 0.00 39.33 39.78 3k0f h ASP 29 CO 0.00 0.00 -0.98 0.44 -3.12 0.00 0.00 179.24 175.58 3k0f h ASP 30 N 0.00 0.91 0.02 6.45 3.32 -1.88 0.39 116.42 125.64 3k0f h ASP 30 Ca 0.04 -0.70 -0.16 0.00 0.02 0.00 0.00 57.03 56.24 3k0f h ASP 30 Cb 0.28 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3k0f h ASP 30 CO -0.00 1.50 -0.53 0.40 -1.72 0.00 0.00 179.24 178.89 3k0f h ILE 31 N 0.43 1.32 -0.01 0.35 2.04 -0.94 -3.03 117.51 117.66 3k0f h ILE 31 Ca -0.11 -1.77 0.00 0.00 1.00 0.00 0.00 64.86 63.98 3k0f h ILE 31 Cb 1.63 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 39.45 3k0f h ILE 31 CO 0.19 0.55 -0.10 -1.54 0.00 0.00 0.00 178.15 177.25 3k0f n SER 32 N -3.97 1.41 -3.52 1.72 3.41 0.37 0.07 113.62 113.11 3k0f n SER 32 Ca -0.03 -1.31 -0.19 0.00 -0.26 0.00 0.00 58.87 57.08 3k0f n SER 32 Cb 0.59 0.06 0.07 0.00 -0.26 0.00 0.00 64.21 64.67 3k0f n SER 32 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3k0f n HIS 33 N -0.07 -2.15 0.00 7.33 8.25 -0.19 -4.00 115.22 124.39 3k0f n HIS 33 Ca 0.16 0.92 0.00 0.00 -0.26 0.00 0.00 57.72 58.54 3k0f n HIS 33 Cb 0.37 -4.87 0.00 0.00 1.12 0.00 0.00 29.99 26.60 3k0f n HIS 33 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k0f n GLY 34 N -1.31 3.77 0.00 -1.41 0.00 0.12 -4.96 105.19 101.41 3k0f n GLY 34 Ca -0.27 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 44.98 3k0f n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k0f n GLY 35 N 0.00 0.81 3.83 -0.02 0.00 -1.26 -3.29 105.19 105.26 3k0f n GLY 35 Ca 0.00 -1.68 -0.38 0.00 0.00 0.00 0.00 46.02 43.96 3k0f n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k0f s LEU 36 N 0.00 4.46 0.09 0.99 1.43 -0.26 -4.63 118.68 120.76 3k0f s LEU 36 Ca 0.00 1.06 -0.33 0.00 -1.03 0.00 0.00 54.13 53.83 3k0f s LEU 36 Cb 0.00 -2.80 -0.12 0.00 0.03 0.00 0.00 46.19 43.29 3k0f s LEU 36 CO 0.00 0.27 1.73 -2.65 0.23 0.00 0.00 176.35 175.93 3k0f n PRO 37 N 1.58 2.34 -1.77 1.29 -0.02 -1.26 0.78 135.00 137.94 3k0f n PRO 37 Ca -0.11 0.85 -0.38 0.00 -2.02 0.00 0.00 63.50 61.84 3k0f n PRO 37 Cb 0.52 -2.67 0.04 0.00 -0.02 0.00 0.00 33.50 31.37 3k0f n PRO 37 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3k0f s ILE 38 N 2.23 2.05 0.00 4.25 1.01 -0.40 -3.03 121.20 127.32 3k0f s ILE 38 Ca 0.83 0.04 0.00 0.00 0.00 0.00 0.00 60.65 61.52 3k0f s ILE 38 Cb -0.63 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 38.83 3k0f s ILE 38 CO 0.41 -0.00 0.00 0.61 0.00 0.00 0.00 174.94 175.96 3k0f n GLY 39 N 0.74 0.93 3.78 6.18 0.00 -1.26 -4.91 105.19 110.65 3k0f n GLY 39 Ca 0.11 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 3k0f n GLY 39 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k0f s ARG 40 N -0.11 2.46 -0.10 1.61 0.52 -1.17 -4.37 118.95 117.79 3k0f s ARG 40 Ca 0.00 -1.52 -0.02 0.00 -0.52 0.00 0.00 55.73 53.67 3k0f s ARG 40 Cb 0.00 -2.25 -0.03 0.00 0.52 0.00 0.00 34.95 33.19 3k0f s ARG 40 CO 0.00 0.04 -0.01 -1.54 0.02 0.00 0.00 175.30 173.81 3k0f s SER 41 N -3.93 5.12 -0.13 0.23 1.04 -1.26 -1.98 113.70 112.79 3k0f s SER 41 Ca 0.40 0.08 -0.06 0.00 0.48 0.00 0.00 55.95 56.86 3k0f s SER 41 Cb -0.03 -1.49 -0.04 0.00 0.10 0.00 0.00 66.02 64.56 3k0f s SER 41 CO 0.24 0.34 0.09 -0.89 0.98 0.00 0.00 173.24 174.00 3k0f s THR 42 N -0.65 5.04 -0.20 2.02 2.01 0.93 -3.64 115.64 121.14 3k0f s THR 42 Ca 0.10 0.04 -0.15 0.00 0.31 0.00 0.00 61.69 62.00 3k0f s THR 42 Cb -0.12 -3.21 -0.04 0.00 0.01 0.00 0.00 72.50 69.15 3k0f s THR 42 CO 0.02 0.56 0.35 -0.22 -0.69 0.00 0.00 174.62 174.64 3k0f s LEU 43 N -0.54 4.16 -0.33 4.42 2.96 -0.30 0.03 118.68 129.08 3k0f s LEU 43 Ca 0.11 0.45 0.04 0.00 -0.22 0.00 0.00 54.13 54.51 3k0f s LEU 43 Cb -0.12 -2.43 0.09 0.00 0.50 0.00 0.00 46.19 44.24 3k0f s LEU 43 CO 0.02 -0.03 0.03 -0.69 -1.32 0.00 0.00 176.35 174.36 3k0f s VAL 44 N 1.18 2.24 0.16 1.68 1.01 0.21 0.59 120.40 127.46 3k0f s VAL 44 Ca 0.17 -2.23 0.10 0.00 0.00 0.00 0.00 61.98 60.02 3k0f s VAL 44 Cb -0.14 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 3k0f s VAL 44 CO 0.07 -0.52 -0.20 -0.94 0.00 0.00 0.00 175.10 173.51 3k0f s SER 45 N 0.94 3.73 -0.12 3.32 1.04 -0.75 -1.73 113.70 120.13 3k0f s SER 45 Ca 0.08 -0.69 -0.33 0.00 0.48 0.00 0.00 55.95 55.49 3k0f s SER 45 Cb -0.19 -0.44 0.13 0.00 0.10 0.00 0.00 66.02 65.62 3k0f s SER 45 CO -0.08 0.14 1.16 -0.83 0.98 0.00 0.00 173.24 174.61 3k0f s GLY 46 N -2.44 -0.34 1.27 7.32 0.00 -1.03 -1.32 107.32 110.78 3k0f s GLY 46 Ca 0.20 1.31 -0.20 0.00 0.00 0.00 0.00 44.72 46.03 3k0f s GLY 46 CO 0.10 0.42 1.03 -0.51 0.00 0.00 0.00 173.10 174.14 3k0f s THR 47 N -2.57 1.52 0.55 0.90 -4.23 -1.26 -2.50 115.64 108.04 3k0f s THR 47 Ca 0.09 0.00 -0.21 0.00 -1.18 0.00 0.00 61.69 60.39 3k0f s THR 47 Cb -0.00 -2.30 -0.06 0.00 1.34 0.00 0.00 72.50 71.48 3k0f s THR 47 CO -0.05 0.00 1.17 -0.24 -0.54 0.00 0.00 174.62 174.96 3k0f n SER 48 N -5.07 1.82 -3.50 3.99 2.88 -1.26 -3.15 113.62 109.32 3k0f n SER 48 Ca 0.11 0.93 -0.25 0.00 -1.33 0.00 0.00 58.87 58.33 3k0f n SER 48 Cb 0.59 -1.48 0.04 0.00 -0.75 0.00 0.00 64.21 62.61 3k0f n SER 48 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3k0f n GLY 49 N 1.00 -0.52 0.05 0.46 0.00 -1.26 -4.91 105.19 100.02 3k0f n GLY 49 Ca 0.11 0.18 0.01 0.00 0.00 0.00 0.00 46.02 46.33 3k0f n GLY 49 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k0f n THR 50 N -4.64 0.62 0.00 2.61 -2.24 -1.19 -5.01 114.28 104.43 3k0f n THR 50 Ca -0.02 -0.65 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 3k0f n THR 50 Cb 0.56 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 3k0f n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k0f n GLY 51 N 1.52 0.93 0.30 3.38 0.00 -1.26 -4.89 105.19 105.16 3k0f n GLY 51 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.74 3k0f n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k0f h LYS 52 N 0.00 -0.61 -0.98 1.61 1.57 -1.92 0.20 116.57 116.44 3k0f h LYS 52 Ca 0.00 0.04 0.21 0.00 -1.87 0.00 0.00 60.65 59.03 3k0f h LYS 52 Cb 0.00 0.14 -0.11 0.00 0.08 0.00 0.00 32.23 32.33 3k0f h LYS 52 CO 0.00 -0.40 0.58 1.15 -0.57 0.00 0.00 179.45 180.20 3k0f h THR 53 N -0.63 0.63 0.90 -0.16 2.02 -1.97 -0.86 112.91 112.85 3k0f h THR 53 Ca -0.04 -0.23 -0.04 0.00 0.77 0.00 0.00 66.41 66.87 3k0f h THR 53 Cb 0.53 -0.09 0.01 0.00 -1.74 0.00 0.00 68.15 66.86 3k0f h THR 53 CO -0.02 0.12 -0.43 0.25 0.37 0.00 0.00 175.52 175.81 3k0f h LEU 54 N 0.66 -1.03 -0.90 2.58 5.85 -1.86 -2.23 115.31 118.38 3k0f h LEU 54 Ca 0.59 0.04 0.24 0.00 0.84 0.00 0.00 57.88 59.59 3k0f h LEU 54 Cb 1.01 0.27 -0.13 0.00 0.37 0.00 0.00 40.66 42.17 3k0f h LEU 54 CO -0.43 -0.71 0.35 0.15 -0.34 0.00 0.00 178.44 177.46 3k0f h PHE 55 N -1.26 0.56 -0.17 1.25 3.57 0.34 0.26 116.94 121.49 3k0f h PHE 55 Ca -0.12 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.36 3k0f h PHE 55 Cb 0.93 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.55 3k0f h PHE 55 CO 0.02 -0.13 -0.15 0.66 -2.23 0.00 0.00 178.31 176.47 3k0f h SER 56 N 0.31 0.27 0.32 0.41 4.64 -1.07 -1.72 113.55 116.71 3k0f h SER 56 Ca 0.58 -0.06 -0.02 0.00 -0.47 0.00 0.00 61.79 61.82 3k0f h SER 56 Cb 1.16 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 3k0f h SER 56 CO -0.59 0.45 -0.15 0.40 -0.87 0.00 0.00 176.83 176.07 3k0f h ILE 57 N 0.27 0.03 -1.15 0.95 1.08 0.07 -3.12 117.51 115.63 3k0f h ILE 57 Ca 0.05 -0.70 0.33 0.00 -0.39 0.00 0.00 64.86 64.15 3k0f h ILE 57 Cb 0.43 0.04 -0.09 0.00 -3.07 0.00 0.00 36.82 34.14 3k0f h ILE 57 CO 0.03 0.01 0.76 -0.61 -0.69 0.00 0.00 178.15 177.65 3k0f h GLN 58 N -1.11 0.23 0.29 2.37 4.15 -1.10 0.52 115.11 120.46 3k0f h GLN 58 Ca -0.04 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.35 3k0f h GLN 58 Cb 0.34 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 27.98 3k0f h GLN 58 CO 0.07 0.15 -0.14 0.35 -1.93 0.00 0.00 178.83 177.33 3k0f h PHE 59 N 0.24 -0.36 -0.69 3.99 3.57 -1.37 -0.28 116.94 122.04 3k0f h PHE 59 Ca 0.65 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 62.07 3k0f h PHE 59 Cb 1.95 0.12 -0.03 0.00 2.79 0.00 0.00 35.95 40.78 3k0f h PHE 59 CO -0.00 -0.12 0.15 -0.07 -2.23 0.00 0.00 178.31 176.04 3k0f h LEU 60 N -0.55 1.06 0.83 0.59 3.38 -0.62 -2.80 115.31 117.20 3k0f h LEU 60 Ca -0.04 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 3k0f h LEU 60 Cb 0.41 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.88 3k0f h LEU 60 CO 0.07 1.03 -0.41 0.22 0.09 0.00 0.00 178.44 179.43 3k0f h TYR 61 N 1.06 -1.08 -0.10 1.13 3.20 0.10 -1.25 116.97 120.02 3k0f h TYR 61 Ca 0.22 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.09 3k0f h TYR 61 Cb 0.39 0.36 -0.00 0.00 1.54 0.00 0.00 36.73 39.02 3k0f h TYR 61 CO 0.03 -0.66 0.16 -0.91 -1.64 0.00 0.00 178.16 175.14 3k0f h ASN 62 N -1.14 0.00 -0.33 -2.11 2.35 -1.11 -1.44 115.58 111.80 3k0f h ASN 62 Ca -0.11 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.60 3k0f h ASN 62 Cb 0.88 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.24 3k0f h ASN 62 CO 0.18 0.00 0.08 1.23 -1.65 0.00 0.00 177.43 177.27 3k0f h GLY 63 N 0.00 0.58 0.79 2.83 0.00 -0.96 -0.11 103.07 106.20 3k0f h GLY 63 Ca 0.05 -0.36 -0.16 0.00 0.00 0.00 0.00 47.33 46.86 3k0f h GLY 63 CO -0.00 0.34 -0.63 -2.22 0.00 0.00 0.00 176.54 174.02 3k0f h ILE 64 N 0.38 1.43 0.00 2.60 2.04 -0.85 0.12 117.51 123.24 3k0f h ILE 64 Ca 0.10 -2.13 -0.11 0.00 1.00 0.00 0.00 64.86 63.72 3k0f h ILE 64 Cb 0.30 2.65 -0.02 0.00 -0.74 0.00 0.00 36.82 39.01 3k0f h ILE 64 CO 0.00 0.62 -0.55 0.40 0.00 0.00 0.00 178.15 178.62 3k0f h ILE 65 N -0.11 1.32 0.00 -0.67 1.08 -1.40 -2.41 117.51 115.32 3k0f h ILE 65 Ca -0.08 -1.92 -0.05 0.00 -0.39 0.00 0.00 64.86 62.42 3k0f h ILE 65 Cb 1.35 2.05 -0.01 0.00 -3.07 0.00 0.00 36.82 37.15 3k0f h ILE 65 CO 0.12 0.54 -1.81 -0.62 -0.69 0.00 0.00 178.15 175.69 3k0f n GLU 66 N -3.79 0.69 -0.24 2.37 -0.58 -0.06 -4.68 120.64 114.35 3k0f n GLU 66 Ca -0.01 -0.12 0.00 0.00 -0.42 0.00 0.00 57.16 56.61 3k0f n GLU 66 Cb 0.57 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 30.05 3k0f n GLU 66 CO 0.00 0.00 0.00 1.19 -0.48 0.00 0.00 177.13 177.84 3k0f n PHE 67 N -2.17 0.00 -4.19 -0.32 3.01 -1.10 -5.00 117.46 107.70 3k0f n PHE 67 Ca -0.07 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.04 3k0f n PHE 67 Cb 0.54 -0.02 -0.02 0.00 -0.01 0.00 0.00 39.48 39.96 3k0f n PHE 67 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 3k0f n ASP 68 N 0.00 -3.25 -4.50 4.37 -0.08 -0.91 -4.90 116.55 107.28 3k0f n ASP 68 Ca 0.00 -0.99 -0.41 0.00 -1.51 0.00 0.00 54.79 51.87 3k0f n ASP 68 Cb 0.60 -2.86 -0.10 0.00 2.34 0.00 0.00 41.12 41.09 3k0f n ASP 68 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 3k0f s GLU 69 N -6.89 3.29 0.86 -0.67 2.02 0.41 -4.92 118.70 112.81 3k0f s GLU 69 Ca 0.69 -0.79 -0.11 0.00 0.02 0.00 0.00 54.97 54.79 3k0f s GLU 69 Cb -0.38 -3.87 0.11 0.00 0.10 0.00 0.00 34.13 30.10 3k0f s GLU 69 CO 0.92 -0.56 1.15 -2.14 0.02 0.00 0.00 175.26 174.65 3k0f s PRO 70 N 1.70 1.41 0.05 0.39 0.02 -1.26 -2.79 135.00 134.52 3k0f s PRO 70 Ca 0.06 1.51 -0.06 0.00 0.02 0.00 0.00 61.00 62.53 3k0f s PRO 70 Cb -0.18 -1.78 -0.01 0.00 0.02 0.00 0.00 34.50 32.55 3k0f s PRO 70 CO 0.10 -2.33 0.10 0.20 -0.33 0.00 0.00 177.00 174.74 3k0f s GLY 71 N -2.72 0.18 -0.10 0.52 0.00 -1.03 -1.00 107.32 103.18 3k0f s GLY 71 Ca 0.67 -0.60 0.03 0.00 0.00 0.00 0.00 44.72 44.82 3k0f s GLY 71 CO 0.56 -0.74 -0.19 0.14 0.00 0.00 0.00 173.10 172.86 3k0f s VAL 72 N -2.88 2.52 -0.26 1.40 1.01 0.34 -2.39 120.40 120.14 3k0f s VAL 72 Ca -0.03 -0.87 -0.03 0.00 0.00 0.00 0.00 61.98 61.05 3k0f s VAL 72 Cb 0.00 -1.99 0.02 0.00 0.00 0.00 0.00 36.38 34.41 3k0f s VAL 72 CO -0.06 0.55 -0.01 0.12 0.00 0.00 0.00 175.10 175.70 3k0f s PHE 73 N 0.11 3.10 -0.26 5.22 5.36 -0.43 -0.72 117.98 130.36 3k0f s PHE 73 Ca -0.09 -1.34 -0.11 0.00 -0.96 0.00 0.00 56.93 54.43 3k0f s PHE 73 Cb -0.16 -2.13 -0.05 0.00 -0.34 0.00 0.00 43.02 40.35 3k0f s PHE 73 CO 0.06 -0.67 0.18 0.08 -1.46 0.00 0.00 175.22 173.40 3k0f s VAL 74 N 1.39 5.34 -0.15 3.12 1.01 0.71 -0.82 120.40 131.00 3k0f s VAL 74 Ca 0.01 0.18 0.01 0.00 0.00 0.00 0.00 61.98 62.18 3k0f s VAL 74 Cb -0.17 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.70 3k0f s VAL 74 CO -0.02 0.30 -0.18 0.28 0.00 0.00 0.00 175.10 175.48 3k0f s THR 75 N 1.39 2.42 -0.10 3.92 -1.32 -1.08 -0.73 115.64 120.14 3k0f s THR 75 Ca 0.07 -0.86 0.21 0.00 -1.21 0.00 0.00 61.69 59.91 3k0f s THR 75 Cb -0.15 -2.00 -0.24 0.00 -1.51 0.00 0.00 72.50 68.61 3k0f s THR 75 CO 0.08 0.53 0.60 0.49 -2.21 0.00 0.00 174.62 174.10 3k0f n PHE 76 N 4.04 0.31 0.05 9.09 3.01 -1.22 -1.07 117.46 131.67 3k0f n PHE 76 Ca -0.19 0.09 0.00 0.00 1.01 0.00 0.00 57.45 58.36 3k0f n PHE 76 Cb 0.52 -0.71 0.00 0.00 -0.01 0.00 0.00 39.48 39.28 3k0f n PHE 76 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 3k0f n GLU 77 N -2.46 0.00 -1.74 -1.08 2.13 -1.26 -3.72 120.64 112.51 3k0f n GLU 77 Ca -0.06 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.37 3k0f n GLU 77 Cb 0.64 -0.31 0.05 0.00 0.27 0.00 0.00 31.44 32.09 3k0f n GLU 77 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 3k0f n GLU 78 N -3.23 1.56 -3.09 5.31 1.02 -1.26 -4.86 120.64 116.08 3k0f n GLU 78 Ca 0.00 0.58 -0.34 0.00 -0.02 0.00 0.00 57.16 57.38 3k0f n GLU 78 Cb 0.00 -2.55 -0.06 0.00 -0.02 0.00 0.00 31.44 28.81 3k0f n GLU 78 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3k0f s THR 79 N -1.31 4.60 0.34 2.62 -1.32 -1.26 -4.86 115.64 114.45 3k0f s THR 79 Ca 0.74 1.15 0.11 0.00 -1.21 0.00 0.00 61.69 62.48 3k0f s THR 79 Cb -0.41 -3.73 0.33 0.00 -1.51 0.00 0.00 72.50 67.19 3k0f s THR 79 CO 0.47 -0.02 1.77 -0.65 -2.21 0.00 0.00 174.62 173.99 3k0f h PRO 80 N 2.74 0.58 -0.67 7.08 0.11 -1.95 0.15 132.00 140.05 3k0f h PRO 80 Ca -0.48 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.52 3k0f h PRO 80 Cb 1.18 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.13 3k0f h PRO 80 CO 0.65 0.38 0.12 -0.56 -0.21 0.00 0.00 178.00 178.38 3k0f h GLN 81 N 0.60 1.09 -0.17 1.05 -0.00 -1.99 -1.52 115.11 114.17 3k0f h GLN 81 Ca 0.58 -0.28 -0.18 0.00 -0.00 0.00 0.00 58.65 58.77 3k0f h GLN 81 Cb 1.14 -0.13 -0.00 0.00 -0.00 0.00 0.00 27.48 28.49 3k0f h GLN 81 CO -0.36 0.99 -0.62 -0.44 -0.00 0.00 0.00 178.83 178.40 3k0f h ASP 82 N 1.02 0.68 0.28 0.06 3.32 -1.19 0.24 116.42 120.83 3k0f h ASP 82 Ca 0.20 -0.39 -0.01 0.00 0.02 0.00 0.00 57.03 56.85 3k0f h ASP 82 Cb 0.42 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3k0f h ASP 82 CO 0.01 1.13 -0.13 0.40 -1.72 0.00 0.00 179.24 178.93 3k0f h ILE 83 N 0.44 0.73 -0.08 0.35 5.03 -0.72 0.18 117.51 123.44 3k0f h ILE 83 Ca -0.01 -0.04 0.03 0.00 -0.12 0.00 0.00 64.86 64.72 3k0f h ILE 83 Cb 1.19 0.76 -0.03 0.00 -3.03 0.00 0.00 36.82 35.71 3k0f h ILE 83 CO 0.12 0.01 -0.11 0.40 -0.68 0.00 0.00 178.15 177.89 3k0f h ILE 84 N -0.39 0.69 0.02 -0.67 2.04 -1.23 -1.85 117.51 116.12 3k0f h ILE 84 Ca -0.04 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.83 3k0f h ILE 84 Cb 0.30 0.69 -0.04 0.00 -0.74 0.00 0.00 36.82 37.04 3k0f h ILE 84 CO 0.06 0.00 -0.37 0.50 0.00 0.00 0.00 178.15 178.35 3k0f h LYS 85 N -0.15 -0.46 -0.51 2.37 1.63 -0.71 -1.35 116.57 117.39 3k0f h LYS 85 Ca 0.07 0.03 0.15 0.00 -0.85 0.00 0.00 60.65 60.05 3k0f h LYS 85 Cb 0.25 0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 31.96 3k0f h LYS 85 CO -0.17 -0.31 0.44 -0.91 -3.45 0.00 0.00 179.45 175.05 3k0f h ASN 86 N -0.48 0.00 -0.12 4.20 2.35 -0.47 -0.31 115.58 120.74 3k0f h ASN 86 Ca 0.00 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 3k0f h ASN 86 Cb 0.50 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.86 3k0f h ASN 86 CO -0.23 0.00 -0.02 0.00 -1.65 0.00 0.00 177.43 175.53 3k0f h ALA 87 N 1.59 1.54 -0.22 -0.83 0.00 -0.38 -1.02 119.26 119.93 3k0f h ALA 87 Ca 0.24 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.05 3k0f h ALA 87 Cb 1.12 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3k0f h ALA 87 CO -0.00 0.34 0.38 0.00 0.00 0.00 0.00 179.25 179.97 3k0f h ARG 88 N 0.35 0.00 -0.32 0.00 3.08 -0.96 0.62 114.38 117.14 3k0f h ARG 88 Ca 0.08 0.00 0.09 0.00 0.07 0.00 0.00 59.98 60.22 3k0f h ARG 88 Cb 0.26 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3k0f h ARG 88 CO 0.01 0.00 0.35 1.03 -1.07 0.00 0.00 179.97 180.28 3k0f h SER 89 N 0.00 0.00 -0.04 7.04 0.87 -1.32 -0.98 113.55 119.12 3k0f h SER 89 Ca 0.10 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 3k0f h SER 89 Cb 0.87 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.82 3k0f h SER 89 CO -0.00 0.00 -0.19 0.49 -0.53 0.00 0.00 176.83 176.60 3k0f n PHE 90 N -3.77 0.13 -3.41 2.24 3.01 0.21 -4.73 117.46 111.15 3k0f n PHE 90 Ca 0.05 -1.22 -0.19 0.00 1.01 0.00 0.00 57.45 57.10 3k0f n PHE 90 Cb 0.50 -0.22 0.07 0.00 -0.01 0.00 0.00 39.48 39.82 3k0f n PHE 90 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3k0f n GLY 91 N -1.24 -0.34 3.09 1.37 0.00 -0.37 -4.76 105.19 102.93 3k0f n GLY 91 Ca 0.19 0.11 -0.29 0.00 0.00 0.00 0.00 46.02 46.03 3k0f n GLY 91 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3k0f s TRP 92 N -3.29 2.04 -1.07 1.61 0.51 -1.19 -5.02 118.94 112.53 3k0f s TRP 92 Ca 0.36 -0.91 -0.06 0.00 -2.12 0.00 0.00 56.10 53.37 3k0f s TRP 92 Cb -0.16 -1.44 0.28 0.00 -0.81 0.00 0.00 33.47 31.34 3k0f s TRP 92 CO 0.64 -0.44 1.17 -3.47 -0.51 0.00 0.00 176.95 174.35 3k0f n ASP 93 N 3.99 5.57 -0.23 2.95 2.03 -1.26 -3.59 116.55 126.02 3k0f n ASP 93 Ca -0.20 -3.17 -0.04 0.00 0.52 0.00 0.00 54.79 51.90 3k0f n ASP 93 Cb 0.52 -1.29 0.07 0.00 -0.72 0.00 0.00 41.12 39.70 3k0f n ASP 93 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 3k0f h LEU 94 N 6.14 0.66 -0.99 -2.67 3.38 -1.95 -1.36 115.31 118.52 3k0f h LEU 94 Ca 0.18 0.00 0.35 0.00 0.09 0.00 0.00 57.88 58.51 3k0f h LEU 94 Cb 0.78 -0.14 -0.16 0.00 0.09 0.00 0.00 40.66 41.23 3k0f h LEU 94 CO 1.08 0.46 0.52 0.00 0.09 0.00 0.00 178.44 180.59 3k0f h ALA 95 N 1.28 1.97 0.43 1.53 0.00 -1.90 0.18 119.26 122.76 3k0f h ALA 95 Ca 0.26 0.23 -0.02 0.00 0.00 0.00 0.00 54.91 55.38 3k0f h ALA 95 Cb 0.02 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3k0f h ALA 95 CO -0.11 -0.72 -0.21 -0.22 0.00 0.00 0.00 179.25 178.00 3k0f h LYS 96 N 0.18 -0.55 -0.44 0.00 3.64 -1.66 -2.03 116.57 115.71 3k0f h LYS 96 Ca 0.76 0.04 0.13 0.00 -1.27 0.00 0.00 60.65 60.31 3k0f h LYS 96 Cb 1.85 0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 33.78 3k0f h LYS 96 CO -0.68 -0.25 0.33 -0.07 -2.27 0.00 0.00 179.45 176.51 3k0f h LEU 97 N -0.88 0.00 -0.30 5.20 3.38 -0.61 0.38 115.31 122.48 3k0f h LEU 97 Ca -0.06 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.71 3k0f h LEU 97 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3k0f h LEU 97 CO 0.10 0.00 -0.75 0.58 0.09 0.00 0.00 178.44 178.46 3k0f h VAL 98 N 0.00 1.33 -0.35 1.22 2.07 -0.71 0.21 116.25 120.03 3k0f h VAL 98 Ca 0.21 -2.06 -0.13 0.00 0.82 0.00 0.00 66.70 65.55 3k0f h VAL 98 Cb 0.86 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 32.66 3k0f h VAL 98 CO -0.00 0.63 -0.29 -0.78 0.02 0.00 0.00 177.57 177.15 3k0f h ASP 99 N 0.40 0.76 -0.17 0.57 3.58 0.38 -2.66 116.42 119.28 3k0f h ASP 99 Ca -0.04 -0.30 0.00 0.00 0.42 0.00 0.00 57.03 57.11 3k0f h ASP 99 Cb 1.35 -0.21 0.00 0.00 1.72 0.00 0.00 39.33 42.18 3k0f h ASP 99 CO 0.14 1.01 0.00 -0.62 -2.88 0.00 0.00 179.24 176.89 3k0f n GLU 100 N -4.08 1.47 -1.67 0.28 1.02 0.27 -4.88 120.64 113.04 3k0f n GLU 100 Ca -0.01 -0.64 -0.18 0.00 -0.02 0.00 0.00 57.16 56.31 3k0f n GLU 100 Cb 0.47 -1.20 -0.07 0.00 -0.02 0.00 0.00 31.44 30.62 3k0f n GLU 100 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k0f n GLY 101 N 0.70 1.42 0.09 0.62 0.00 -1.00 -4.86 105.19 102.15 3k0f n GLY 101 Ca 0.06 -0.14 0.03 0.00 0.00 0.00 0.00 46.02 45.97 3k0f n GLY 101 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3k0f n LYS 102 N -2.52 0.63 -4.18 1.61 4.76 0.56 -4.91 118.16 114.11 3k0f n LYS 102 Ca -0.19 0.11 -0.17 0.00 -2.87 0.00 0.00 58.31 55.20 3k0f n LYS 102 Cb 0.61 -1.73 -0.12 0.00 -1.84 0.00 0.00 35.03 31.94 3k0f n LYS 102 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3k0f s LEU 103 N -5.46 2.20 -0.05 -0.35 2.96 -0.10 -2.46 118.68 115.42 3k0f s LEU 103 Ca -0.04 -0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 53.37 3k0f s LEU 103 Cb 0.09 -0.38 0.03 0.00 0.50 0.00 0.00 46.19 46.44 3k0f s LEU 103 CO 0.83 -0.07 0.09 0.12 -1.32 0.00 0.00 176.35 175.99 3k0f s PHE 104 N -1.04 -0.01 -0.55 5.38 5.36 -1.01 -4.00 117.98 122.11 3k0f s PHE 104 Ca -0.03 0.35 -0.17 0.00 -0.96 0.00 0.00 56.93 56.12 3k0f s PHE 104 Cb -0.08 -0.41 0.11 0.00 -0.34 0.00 0.00 43.02 42.30 3k0f s PHE 104 CO 0.01 -0.21 0.59 0.42 -1.46 0.00 0.00 175.22 174.57 3k0f s ILE 105 N 2.15 5.01 -0.51 3.12 1.01 -1.26 -1.31 121.20 129.41 3k0f s ILE 105 Ca 0.04 -1.14 -0.23 0.00 0.00 0.00 0.00 60.65 59.31 3k0f s ILE 105 Cb -0.12 -4.38 0.04 0.00 0.01 0.00 0.00 42.46 38.01 3k0f s ILE 105 CO -0.04 -0.94 0.87 -0.22 0.00 0.00 0.00 174.94 174.60 3k0f s LEU 106 N 2.17 4.22 -0.26 2.97 2.96 0.00 -4.98 118.68 125.76 3k0f s LEU 106 Ca 0.08 -0.30 -0.29 0.00 -0.22 0.00 0.00 54.13 53.40 3k0f s LEU 106 Cb -0.26 -2.86 -0.02 0.00 0.50 0.00 0.00 46.19 43.55 3k0f s LEU 106 CO 0.06 -1.09 1.52 -0.62 -1.32 0.00 0.00 176.35 174.90 3k0f s ASP 107 N 2.58 6.43 -0.00 3.68 -1.08 -1.26 -2.64 116.67 124.38 3k0f s ASP 107 Ca 0.29 1.43 0.00 0.00 -0.52 0.00 0.00 52.55 53.76 3k0f s ASP 107 Cb -0.13 -2.53 0.01 0.00 -1.46 0.00 0.00 42.92 38.80 3k0f s ASP 107 CO 0.20 -1.24 0.95 0.00 0.52 0.00 0.00 175.17 175.59 3k0f n ALA 108 N 8.34 1.89 -1.78 3.66 0.00 -0.23 -4.97 120.51 127.42 3k0f n ALA 108 Ca 0.18 -0.98 -0.36 0.00 0.00 0.00 0.00 53.44 52.27 3k0f n ALA 108 Cb 0.46 -0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.88 3k0f n ALA 108 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3k0f s SER 109 N -0.93 6.27 0.53 0.00 1.04 -0.91 -4.71 113.70 115.00 3k0f s SER 109 Ca 0.01 2.18 -0.21 0.00 0.48 0.00 0.00 55.95 58.40 3k0f s SER 109 Cb 0.01 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.48 3k0f s SER 109 CO 0.00 -0.84 1.26 -2.84 0.98 0.00 0.00 173.24 171.80 3k0f s PRO 110 N -2.79 3.27 0.07 4.02 0.02 -1.25 -4.99 135.00 133.34 3k0f s PRO 110 Ca 0.64 1.98 -0.26 0.00 0.02 0.00 0.00 61.00 63.38 3k0f s PRO 110 Cb -0.25 -2.21 -0.06 0.00 0.02 0.00 0.00 34.50 32.01 3k0f s PRO 110 CO 0.30 -1.01 0.80 -0.51 -0.33 0.00 0.00 177.00 176.26 3k0f s ASP 111 N -1.26 7.28 0.00 2.53 1.01 -1.26 -4.91 116.67 120.07 3k0f s ASP 111 Ca 0.71 1.53 0.00 0.00 0.71 0.00 0.00 52.55 55.50 3k0f s ASP 111 Cb -0.34 -2.49 0.00 0.00 1.01 0.00 0.00 42.92 41.10 3k0f s ASP 111 CO 0.40 0.02 0.34 -2.65 0.21 0.00 0.00 175.17 173.48 3k0f n PRO 112 N 2.68 0.00 0.00 8.23 -0.02 -1.26 -3.97 135.00 140.65 3k0f n PRO 112 Ca -0.02 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 3k0f n PRO 112 Cb 0.50 -1.57 0.00 0.00 -0.02 0.00 0.00 33.50 32.41 3k0f n PRO 112 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3k0f n GLU 113 N -0.84 0.00 0.00 -0.52 0.00 -1.26 -5.14 120.64 112.89 3k0f n GLU 113 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 3k0f n GLU 113 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.51 3k0f n GLU 113 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3k0f n GLY 114 N 5.00 2.87 3.32 8.31 0.00 -1.25 -5.16 105.19 118.27 3k0f n GLY 114 Ca 0.00 -0.09 -0.13 0.00 0.00 0.00 0.00 46.02 45.79 3k0f n GLY 114 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k0f s GLN 115 N -0.96 0.87 0.38 1.61 0.74 -1.26 -5.16 119.66 115.87 3k0f s GLN 115 Ca 0.00 -0.26 0.06 0.00 0.05 0.00 0.00 55.36 55.21 3k0f s GLN 115 Cb 0.00 0.39 0.06 0.00 1.10 0.00 0.00 33.01 34.56 3k0f s GLN 115 CO 0.00 -0.28 0.49 0.39 -0.55 0.00 0.00 175.29 175.34 3k0f n GLU 116 N 0.74 0.77 -3.49 1.67 1.02 -1.26 -4.80 120.64 115.29 3k0f n GLU 116 Ca -0.19 -2.08 -0.20 0.00 -0.02 0.00 0.00 57.16 54.67 3k0f n GLU 116 Cb 0.59 -0.10 0.00 0.00 -0.02 0.00 0.00 31.44 31.90 3k0f n GLU 116 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3k0f n VAL 117 N -1.76 -2.50 -1.99 2.62 0.31 -1.26 -4.89 118.33 108.86 3k0f n VAL 117 Ca 0.09 -0.01 -0.27 0.00 -0.01 0.00 0.00 64.34 64.15 3k0f n VAL 117 Cb 0.40 -2.23 0.03 0.00 -0.91 0.00 0.00 33.84 31.12 3k0f n VAL 117 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3k0f n VAL 118 N -2.09 2.72 -0.05 2.52 0.31 -1.26 -4.63 118.33 115.85 3k0f n VAL 118 Ca -0.25 -4.14 -0.05 0.00 -0.01 0.00 0.00 64.34 59.88 3k0f n VAL 118 Cb 0.54 -1.17 -0.07 0.00 -0.91 0.00 0.00 33.84 32.23 3k0f n VAL 118 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3k0f n GLY 119 N -0.70 -0.39 0.00 2.92 0.00 -1.26 -4.51 105.19 101.25 3k0f n GLY 119 Ca 0.47 -0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.35 3k0f n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k0f n GLY 120 N 2.54 -1.15 0.45 -0.02 0.00 -1.26 -3.99 105.19 101.76 3k0f n GLY 120 Ca -0.16 0.00 0.33 0.00 0.00 0.00 0.00 46.02 46.18 3k0f n GLY 120 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3k0f h PHE 121 N 0.00 0.55 0.00 1.61 -1.00 -1.90 -3.27 116.94 112.93 3k0f h PHE 121 Ca 0.00 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.80 3k0f h PHE 121 Cb 0.00 -0.14 0.00 0.00 3.61 0.00 0.00 35.95 39.42 3k0f h PHE 121 CO 0.00 -0.12 0.00 -3.47 -1.61 0.00 0.00 178.31 173.11 3k0f n ASP 122 N -4.66 0.00 -0.00 2.17 -0.08 -1.26 0.75 116.55 113.47 3k0f n ASP 122 Ca 0.33 0.18 -0.10 0.00 -1.51 0.00 0.00 54.79 53.69 3k0f n ASP 122 Cb 1.26 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 44.68 3k0f n ASP 122 CO 0.00 0.00 0.00 0.25 0.12 0.00 0.00 177.20 177.57 3k0f h LEU 123 N 0.00 -0.95 0.16 -2.67 6.46 -1.74 0.16 115.31 116.73 3k0f h LEU 123 Ca 0.00 0.14 0.01 0.00 -0.12 0.00 0.00 57.88 57.91 3k0f h LEU 123 Cb 0.00 0.41 -0.02 0.00 -0.73 0.00 0.00 40.66 40.32 3k0f h LEU 123 CO 0.00 -0.35 -0.22 0.28 -0.62 0.00 0.00 178.44 177.54 3k0f h SER 124 N -0.37 -0.60 0.27 1.25 0.02 -1.63 0.63 113.55 113.11 3k0f h SER 124 Ca 0.10 0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.12 3k0f h SER 124 Cb 0.53 0.22 -0.03 0.00 0.14 0.00 0.00 62.40 63.27 3k0f h SER 124 CO -0.35 -0.31 -0.32 0.00 -1.14 0.00 0.00 176.83 174.71 3k0f h ALA 125 N 0.32 -0.64 -0.74 3.77 0.00 0.49 -2.19 119.26 120.27 3k0f h ALA 125 Ca 0.02 -0.09 0.13 0.00 0.00 0.00 0.00 54.91 54.97 3k0f h ALA 125 Cb 0.44 0.47 -0.09 0.00 0.00 0.00 0.00 17.79 18.61 3k0f h ALA 125 CO -0.09 -0.90 0.30 1.25 0.00 0.00 0.00 179.25 179.81 3k0f h LEU 126 N -0.63 0.30 -0.31 0.00 5.85 -0.49 0.69 115.31 120.72 3k0f h LEU 126 Ca -0.00 0.10 0.07 0.00 0.84 0.00 0.00 57.88 58.88 3k0f h LEU 126 Cb 0.59 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.62 3k0f h LEU 126 CO -0.09 0.13 -0.16 0.40 -0.34 0.00 0.00 178.44 178.37 3k0f h ILE 127 N 0.46 0.51 -0.26 4.05 1.08 0.86 1.00 117.51 125.21 3k0f h ILE 127 Ca 0.40 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.78 3k0f h ILE 127 Cb 0.57 0.51 -0.01 0.00 -3.07 0.00 0.00 36.82 34.83 3k0f h ILE 127 CO -0.38 0.00 -0.18 -0.33 -0.69 0.00 0.00 178.15 176.57 3k0f h GLU 128 N -0.12 0.58 -0.43 2.37 5.08 -0.79 0.42 114.58 121.70 3k0f h GLU 128 Ca 0.16 -0.28 0.09 0.00 -1.00 0.00 0.00 59.36 58.33 3k0f h GLU 128 Cb 0.37 -0.00 -0.09 0.00 0.50 0.00 0.00 28.75 29.52 3k0f h GLU 128 CO -0.38 0.86 -0.25 0.00 -1.00 0.00 0.00 179.01 178.23 3k0f h ARG 129 N 0.30 -0.17 -0.77 2.33 3.08 -0.37 1.17 114.38 119.96 3k0f h ARG 129 Ca 0.05 0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.15 3k0f h ARG 129 Cb 0.71 0.04 -0.05 0.00 0.08 0.00 0.00 29.97 30.75 3k0f h ARG 129 CO 0.05 -0.11 0.48 0.82 -1.07 0.00 0.00 179.97 180.14 3k0f h ILE 130 N -0.17 1.10 -0.05 2.04 2.04 -0.63 0.07 117.51 121.91 3k0f h ILE 130 Ca 0.20 -0.32 -0.08 0.00 1.00 0.00 0.00 64.86 65.66 3k0f h ILE 130 Cb 0.49 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3k0f h ILE 130 CO -0.53 0.17 -0.32 -1.13 0.00 0.00 0.00 178.15 176.34 3k0f h ASN 131 N 0.93 0.09 0.05 1.72 -1.24 0.16 0.27 115.58 117.56 3k0f h ASN 131 Ca 0.31 -0.03 -0.00 0.00 0.71 0.00 0.00 56.30 57.29 3k0f h ASN 131 Cb 0.04 -0.02 0.00 0.00 0.73 0.00 0.00 38.32 39.07 3k0f h ASN 131 CO -0.12 0.41 -0.02 0.22 -1.29 0.00 0.00 177.43 176.62 3k0f h TYR 132 N 0.08 -0.06 -0.12 0.67 3.20 0.26 -1.97 116.97 119.04 3k0f h TYR 132 Ca 0.01 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.88 3k0f h TYR 132 Cb 0.61 0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 3k0f h TYR 132 CO 0.00 0.24 0.08 0.00 -1.64 0.00 0.00 178.16 176.85 3k0f h ALA 133 N 0.57 0.15 -0.40 1.82 0.00 -0.70 0.47 119.26 121.19 3k0f h ALA 133 Ca -0.01 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 54.96 3k0f h ALA 133 Cb 0.33 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 3k0f h ALA 133 CO 0.01 -0.36 0.04 0.82 0.00 0.00 0.00 179.25 179.76 3k0f h ILE 134 N 0.16 0.75 0.24 0.00 2.04 -0.94 -0.99 117.51 118.76 3k0f h ILE 134 Ca 0.04 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 3k0f h ILE 134 Cb -0.01 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.65 3k0f h ILE 134 CO -0.01 0.03 -0.11 1.56 0.00 0.00 0.00 178.15 179.61 3k0f h GLN 135 N 0.15 -0.31 -0.35 2.37 4.20 -1.13 0.10 115.11 120.15 3k0f h GLN 135 Ca 0.19 0.02 0.08 0.00 0.06 0.00 0.00 58.65 59.00 3k0f h GLN 135 Cb 0.25 0.07 -0.08 0.00 0.30 0.00 0.00 27.48 28.02 3k0f h GLN 135 CO -0.29 0.01 -0.20 -0.22 -0.67 0.00 0.00 178.83 177.46 3k0f h LYS 136 N -0.65 -0.15 -0.01 1.46 3.64 -0.69 -1.40 116.57 118.77 3k0f h LYS 136 Ca -0.03 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3k0f h LYS 136 Cb 0.46 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 3k0f h LYS 136 CO 0.05 -0.10 -0.07 0.66 -2.27 0.00 0.00 179.45 177.73 3k0f n TYR 137 N -5.37 0.00 -3.31 1.91 4.02 -0.39 -4.95 117.16 109.07 3k0f n TYR 137 Ca 0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.78 3k0f n TYR 137 Cb 0.28 -0.05 0.03 0.00 -0.02 0.00 0.00 39.34 39.58 3k0f n TYR 137 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 3k0f n ARG 138 N -0.24 -1.56 -3.39 -0.72 1.74 0.15 -4.84 116.66 107.80 3k0f n ARG 138 Ca 0.17 1.07 -0.38 0.00 -0.77 0.00 0.00 57.85 57.94 3k0f n ARG 138 Cb 0.32 -5.08 -0.06 0.00 -1.02 0.00 0.00 32.46 26.62 3k0f n ARG 138 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3k0f s ALA 139 N -3.18 3.61 -0.12 7.54 0.00 0.01 -4.29 121.76 125.34 3k0f s ALA 139 Ca 0.20 -0.15 0.17 0.00 0.00 0.00 0.00 51.96 52.19 3k0f s ALA 139 Cb -0.05 -2.52 -0.25 0.00 0.00 0.00 0.00 23.12 20.30 3k0f s ALA 139 CO 0.78 0.32 0.21 0.54 0.00 0.00 0.00 175.76 177.61 3k0f n ARG 140 N 2.33 0.89 -4.55 0.00 5.12 -0.17 -4.92 116.66 115.36 3k0f n ARG 140 Ca -0.11 -0.08 -0.29 0.00 -1.93 0.00 0.00 57.85 55.44 3k0f n ARG 140 Cb 0.52 -1.46 -0.13 0.00 -1.16 0.00 0.00 32.46 30.23 3k0f n ARG 140 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 3k0f s ARG 141 N -2.79 1.59 -0.03 5.56 0.52 -0.91 -3.03 118.95 119.86 3k0f s ARG 141 Ca -0.08 -1.25 -0.02 0.00 -0.52 0.00 0.00 55.73 53.86 3k0f s ARG 141 Cb 0.08 -1.96 0.01 0.00 0.52 0.00 0.00 34.95 33.60 3k0f s ARG 141 CO 0.76 0.48 0.07 0.08 0.02 0.00 0.00 175.30 176.70 3k0f s VAL 142 N -0.99 -0.01 -0.03 3.52 1.01 -0.87 -0.51 120.40 122.53 3k0f s VAL 142 Ca 0.14 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.18 3k0f s VAL 142 Cb -0.10 -0.11 0.00 0.00 0.00 0.00 0.00 36.38 36.17 3k0f s VAL 142 CO 0.05 0.01 -0.10 -0.44 0.00 0.00 0.00 175.10 174.62 3k0f s SER 143 N 0.20 1.38 -0.24 3.32 0.01 0.10 -0.74 113.70 117.73 3k0f s SER 143 Ca -0.01 -0.22 0.01 0.00 1.31 0.00 0.00 55.95 57.04 3k0f s SER 143 Cb -0.02 -0.38 0.06 0.00 0.21 0.00 0.00 66.02 65.88 3k0f s SER 143 CO -0.01 0.08 -0.08 -0.63 0.41 0.00 0.00 173.24 173.02 3k0f s ILE 144 N 0.19 1.72 -0.35 1.44 1.01 -0.05 -0.21 121.20 124.94 3k0f s ILE 144 Ca -0.04 -1.31 -0.24 0.00 0.00 0.00 0.00 60.65 59.07 3k0f s ILE 144 Cb -0.09 -1.92 0.01 0.00 0.01 0.00 0.00 42.46 40.47 3k0f s ILE 144 CO 0.01 -0.05 0.81 -0.62 0.00 0.00 0.00 174.94 175.09 3k0f s ASP 145 N 1.31 6.60 -0.68 3.58 3.68 0.09 -1.45 116.67 129.81 3k0f s ASP 145 Ca -0.06 0.46 -0.04 0.00 2.13 0.00 0.00 52.55 55.03 3k0f s ASP 145 Cb -0.19 -2.41 0.01 0.00 -1.45 0.00 0.00 42.92 38.87 3k0f s ASP 145 CO -0.06 -0.74 0.67 -1.54 0.13 0.00 0.00 175.17 173.63 3k0f n SER 146 N 6.45 -7.34 0.24 -0.34 3.41 -1.13 -3.38 113.62 111.53 3k0f n SER 146 Ca 0.04 -0.09 0.11 0.00 -0.26 0.00 0.00 58.87 58.67 3k0f n SER 146 Cb 0.48 -4.69 0.57 0.00 -0.26 0.00 0.00 64.21 60.31 3k0f n SER 146 CO 0.00 0.00 0.00 -0.37 -0.16 0.00 0.00 175.04 174.51 3k0f h VAL 147 N 0.70 0.59 -0.84 -3.33 -1.51 -1.65 -2.14 116.25 108.07 3k0f h VAL 147 Ca -0.11 -0.89 0.19 0.00 -1.23 0.00 0.00 66.70 64.67 3k0f h VAL 147 Cb 1.07 1.59 -0.12 0.00 -2.13 0.00 0.00 31.29 31.70 3k0f h VAL 147 CO 0.29 0.19 0.32 0.74 -1.23 0.00 0.00 177.57 177.87 3k0f h THR 148 N 0.00 0.50 0.00 7.19 2.02 -1.91 0.47 112.91 121.18 3k0f h THR 148 Ca -0.00 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.05 3k0f h THR 148 Cb 0.57 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3k0f h THR 148 CO 0.02 0.07 0.00 0.77 0.37 0.00 0.00 175.52 176.75 3k0f h SER 149 N 0.37 0.00 0.09 4.18 4.64 -1.73 -2.99 113.55 118.11 3k0f h SER 149 Ca 0.50 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.82 3k0f h SER 149 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3k0f h SER 149 CO -0.51 0.00 -0.04 1.62 -0.87 0.00 0.00 176.83 177.02 3k0f h VAL 150 N 0.00 1.13 -0.01 0.95 3.04 -0.20 -3.25 116.25 117.90 3k0f h VAL 150 Ca 0.00 -1.30 0.00 0.00 -1.01 0.00 0.00 66.70 64.39 3k0f h VAL 150 Cb 0.17 1.91 0.00 0.00 -2.01 0.00 0.00 31.29 31.36 3k0f h VAL 150 CO 0.00 0.30 0.00 2.22 -1.01 0.00 0.00 177.57 179.08 3k0f n PHE 151 N -4.86 0.01 0.29 3.17 1.16 -1.22 -3.97 117.46 112.04 3k0f n PHE 151 Ca -0.08 -0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.49 3k0f n PHE 151 Cb 0.29 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.16 3k0f n PHE 151 CO 0.00 0.00 0.00 1.04 -1.87 0.00 0.00 176.76 175.93 3k0f n GLN 152 N -0.23 0.58 -0.09 3.97 1.13 -1.13 -3.06 117.38 118.54 3k0f n GLN 152 Ca 0.20 0.00 -0.10 0.00 -1.94 0.00 0.00 57.00 55.16 3k0f n GLN 152 Cb 0.27 -1.21 -0.16 0.00 0.11 0.00 0.00 30.24 29.25 3k0f n GLN 152 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3k0f n GLN 153 N 1.04 0.68 0.00 -1.09 6.02 -1.25 -4.93 117.38 117.85 3k0f n GLN 153 Ca 0.00 0.02 0.00 0.00 -0.01 0.00 0.00 57.00 57.01 3k0f n GLN 153 Cb 0.29 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.01 3k0f n GLN 153 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 3k0f n TYR 154 N -2.80 0.00 -3.95 1.08 0.18 -1.17 -5.19 117.16 105.31 3k0f n TYR 154 Ca -0.32 0.00 -0.24 0.00 1.88 0.00 0.00 57.90 59.22 3k0f n TYR 154 Cb 1.14 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 40.05 3k0f n TYR 154 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3k0f s ASP 155 N 0.00 4.62 0.02 9.48 1.01 -1.21 -5.15 116.67 125.45 3k0f s ASP 155 Ca 0.00 -1.03 0.03 0.00 0.71 0.00 0.00 52.55 52.26 3k0f s ASP 155 Cb 0.00 -0.35 -0.02 0.00 1.01 0.00 0.00 42.92 43.57 3k0f s ASP 155 CO 0.00 -0.67 -0.09 0.00 0.21 0.00 0.00 175.17 174.62 3k0f s ALA 156 N -2.60 0.76 0.00 5.23 0.00 -1.26 -5.05 121.76 118.84 3k0f s ALA 156 Ca 0.41 -0.59 0.00 0.00 0.00 0.00 0.00 51.96 51.78 3k0f s ALA 156 Cb 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.02 3k0f s ALA 156 CO 0.23 0.12 0.00 -1.13 0.00 0.00 0.00 175.76 174.98 3k0f n SER 157 N 2.20 0.00 -0.12 0.00 3.41 -1.26 -0.36 113.62 117.49 3k0f n SER 157 Ca -0.17 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.37 3k0f n SER 157 Cb 0.56 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.60 3k0f n SER 157 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3k0f h SER 158 N 0.00 0.84 -0.05 4.04 4.64 -1.98 -2.08 113.55 118.97 3k0f h SER 158 Ca 0.00 -0.26 -0.07 0.00 -0.47 0.00 0.00 61.79 60.99 3k0f h SER 158 Cb 0.00 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 3k0f h SER 158 CO 0.00 0.97 -0.15 0.58 -0.87 0.00 0.00 176.83 177.36 3k0f h VAL 159 N 0.76 1.22 -0.13 0.95 2.07 -1.12 -2.65 116.25 117.35 3k0f h VAL 159 Ca 0.13 -0.97 -0.10 0.00 0.82 0.00 0.00 66.70 66.58 3k0f h VAL 159 Cb 0.62 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 3k0f h VAL 159 CO 0.04 0.31 -0.31 0.58 0.02 0.00 0.00 177.57 178.21 3k0f h VAL 160 N 0.35 1.37 -0.52 2.57 2.07 -1.50 -2.91 116.25 117.69 3k0f h VAL 160 Ca 0.07 -1.60 0.07 0.00 0.82 0.00 0.00 66.70 66.06 3k0f h VAL 160 Cb 0.47 2.07 -0.06 0.00 -1.52 0.00 0.00 31.29 32.25 3k0f h VAL 160 CO 0.03 0.47 0.18 -0.09 0.02 0.00 0.00 177.57 178.18 3k0f h ARG 161 N 0.03 0.34 -0.57 1.57 2.43 -1.13 0.26 114.38 117.32 3k0f h ARG 161 Ca -0.00 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.04 3k0f h ARG 161 Cb 0.91 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.37 3k0f h ARG 161 CO 0.07 0.22 -0.08 0.00 -1.51 0.00 0.00 179.97 178.67 3k0f h ARG 162 N 0.35 1.05 -0.17 0.20 3.08 -1.54 -0.86 114.38 116.48 3k0f h ARG 162 Ca 0.25 -0.37 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 3k0f h ARG 162 Cb 0.29 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 3k0f h ARG 162 CO -0.27 1.07 0.06 0.93 -1.07 0.00 0.00 179.97 180.69 3k0f h GLU 163 N 0.94 0.27 -0.10 0.04 4.39 -1.19 -0.50 114.58 118.43 3k0f h GLU 163 Ca 0.15 -0.05 0.02 0.00 0.34 0.00 0.00 59.36 59.82 3k0f h GLU 163 Cb 0.65 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.24 3k0f h GLU 163 CO 0.04 0.37 -0.03 -0.07 -1.16 0.00 0.00 179.01 178.17 3k0f h LEU 164 N 0.11 -0.10 -1.36 1.33 3.38 -0.41 -0.24 115.31 118.02 3k0f h LEU 164 Ca 0.06 0.03 0.08 0.00 0.09 0.00 0.00 57.88 58.14 3k0f h LEU 164 Cb 0.21 0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 3k0f h LEU 164 CO -0.00 -0.04 0.50 0.15 0.09 0.00 0.00 178.44 179.14 3k0f h PHE 165 N -0.00 0.77 -0.02 1.13 3.57 -1.00 -0.76 116.94 120.62 3k0f h PHE 165 Ca 0.05 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 3k0f h PHE 165 Cb 0.08 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.57 3k0f h PHE 165 CO -0.15 0.38 -0.03 -0.09 -2.23 0.00 0.00 178.31 176.19 3k0f h ARG 166 N 0.74 0.06 -0.07 1.11 2.43 -0.40 -2.52 114.38 115.73 3k0f h ARG 166 Ca 0.34 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.49 3k0f h ARG 166 Cb 0.37 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.91 3k0f h ARG 166 CO -0.12 0.56 -0.01 1.25 -1.51 0.00 0.00 179.97 180.14 3k0f h LEU 167 N -0.43 -0.05 0.75 3.80 5.85 -0.50 -1.13 115.31 123.61 3k0f h LEU 167 Ca 0.00 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.71 3k0f h LEU 167 Cb 0.55 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.61 3k0f h LEU 167 CO 0.01 -0.01 -0.45 0.58 -0.34 0.00 0.00 178.44 178.23 3k0f h VAL 168 N 0.01 0.10 -0.62 1.05 2.07 -1.26 -1.96 116.25 115.64 3k0f h VAL 168 Ca 0.03 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.68 3k0f h VAL 168 Cb 0.04 0.10 -0.12 0.00 -1.52 0.00 0.00 31.29 29.79 3k0f h VAL 168 CO -0.06 0.00 -0.15 0.00 0.02 0.00 0.00 177.57 177.37 3k0f h ALA 169 N -0.97 0.41 -0.16 1.67 0.00 -1.37 0.25 119.26 119.09 3k0f h ALA 169 Ca -0.10 0.24 0.01 0.00 0.00 0.00 0.00 54.91 55.07 3k0f h ALA 169 Cb 0.90 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 3k0f h ALA 169 CO 0.11 -0.43 0.05 0.00 0.00 0.00 0.00 179.25 178.99 3k0f h ARG 170 N 0.00 0.13 -0.61 0.00 2.47 -1.16 -1.32 114.38 113.89 3k0f h ARG 170 Ca 0.30 -0.01 0.08 0.00 -1.26 0.00 0.00 59.98 59.09 3k0f h ARG 170 Cb 0.45 -0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.68 3k0f h ARG 170 CO -0.64 0.08 0.26 -0.07 0.56 0.00 0.00 179.97 180.17 3k0f h LEU 171 N 0.13 0.30 -1.32 3.04 3.38 -0.41 -0.13 115.31 120.31 3k0f h LEU 171 Ca 0.07 0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.16 3k0f h LEU 171 Cb 0.04 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 3k0f h LEU 171 CO -0.07 0.18 0.51 0.50 0.09 0.00 0.00 178.44 179.65 3k0f h LYS 172 N 0.46 0.80 -0.15 1.13 3.64 0.14 0.20 116.57 122.81 3k0f h LYS 172 Ca 0.30 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.53 3k0f h LYS 172 Cb 0.33 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3k0f h LYS 172 CO -0.27 0.53 -0.38 1.96 -2.27 0.00 0.00 179.45 179.02 3k0f h GLN 173 N 0.83 0.32 0.00 1.90 4.20 0.04 -2.00 115.11 120.39 3k0f h GLN 173 Ca 0.33 -0.15 -0.05 0.00 0.06 0.00 0.00 58.65 58.85 3k0f h GLN 173 Cb 0.24 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 3k0f h GLN 173 CO -0.11 0.66 -0.24 0.82 -0.67 0.00 0.00 178.83 179.29 3k0f h ILE 174 N 0.27 0.63 0.00 2.54 1.08 0.44 -3.47 117.51 119.00 3k0f h ILE 174 Ca 0.03 -1.09 0.00 0.00 -0.39 0.00 0.00 64.86 63.41 3k0f h ILE 174 Cb 0.79 1.71 0.00 0.00 -3.07 0.00 0.00 36.82 36.26 3k0f h ILE 174 CO 0.06 0.23 0.00 0.61 -0.69 0.00 0.00 178.15 178.36 3k0f n GLY 175 N -0.00 0.41 3.84 5.37 0.00 -0.30 -5.05 105.19 109.46 3k0f n GLY 175 Ca -0.00 -1.01 -0.37 0.00 0.00 0.00 0.00 46.02 44.64 3k0f n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k0f s ALA 176 N -2.00 3.66 -0.53 4.61 0.00 -1.23 -4.35 121.76 121.93 3k0f s ALA 176 Ca 0.00 -0.19 -0.23 0.00 0.00 0.00 0.00 51.96 51.54 3k0f s ALA 176 Cb 0.00 -2.43 0.04 0.00 0.00 0.00 0.00 23.12 20.73 3k0f s ALA 176 CO 0.00 0.48 0.87 0.99 0.00 0.00 0.00 175.76 178.09 3k0f s THR 177 N -1.22 4.51 0.14 0.00 2.01 -1.17 -3.81 115.64 116.10 3k0f s THR 177 Ca 0.29 0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.48 3k0f s THR 177 Cb -0.16 -4.47 -0.04 0.00 0.01 0.00 0.00 72.50 67.84 3k0f s THR 177 CO 0.16 -1.01 0.11 -0.89 -0.69 0.00 0.00 174.62 172.29 3k0f s THR 178 N 3.63 4.42 -0.20 -0.82 2.01 -0.84 -2.06 115.64 121.79 3k0f s THR 178 Ca 0.27 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 61.26 3k0f s THR 178 Cb -0.14 -3.22 0.05 0.00 0.01 0.00 0.00 72.50 69.21 3k0f s THR 178 CO 0.18 -0.04 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.32 3k0f s VAL 179 N -1.63 1.40 -0.02 3.82 1.01 0.08 -0.05 120.40 125.00 3k0f s VAL 179 Ca 0.30 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.32 3k0f s VAL 179 Cb -0.11 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 3k0f s VAL 179 CO 0.22 0.05 0.06 -0.04 0.00 0.00 0.00 175.10 175.40 3k0f s MET 180 N 1.48 3.05 -0.14 2.72 -1.94 0.10 -0.87 119.30 123.71 3k0f s MET 180 Ca -0.02 -0.46 -0.02 0.00 -1.71 0.00 0.00 55.69 53.48 3k0f s MET 180 Cb -0.17 -2.85 -0.02 0.00 2.01 0.00 0.00 34.83 33.80 3k0f s MET 180 CO -0.07 0.66 -0.08 0.99 -0.01 0.00 0.00 175.02 176.51 3k0f s THR 181 N -1.12 3.51 0.23 2.05 2.01 -0.53 0.67 115.64 122.45 3k0f s THR 181 Ca 0.20 -0.50 0.07 0.00 0.31 0.00 0.00 61.69 61.77 3k0f s THR 181 Cb -0.12 -2.51 -0.05 0.00 0.01 0.00 0.00 72.50 69.84 3k0f s THR 181 CO 0.11 0.51 -0.10 -0.89 -0.69 0.00 0.00 174.62 173.56 3k0f s THR 182 N 0.28 1.62 0.14 -0.82 2.01 -0.70 -2.15 115.64 116.01 3k0f s THR 182 Ca -0.06 -2.16 0.11 0.00 0.31 0.00 0.00 61.69 59.89 3k0f s THR 182 Cb -0.15 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.15 3k0f s THR 182 CO 0.04 -0.50 -0.26 -1.83 -0.69 0.00 0.00 174.62 171.38 3k0f s GLU 183 N -3.69 1.42 0.46 4.92 -1.05 -1.26 -2.47 118.70 117.03 3k0f s GLU 183 Ca 0.25 -1.38 0.02 0.00 -0.15 0.00 0.00 54.97 53.71 3k0f s GLU 183 Cb 0.01 -1.89 -0.01 0.00 -0.44 0.00 0.00 34.13 31.80 3k0f s GLU 183 CO 0.08 0.44 0.08 0.54 0.95 0.00 0.00 175.26 177.36 3k0f n ARG 184 N 0.80 0.65 0.00 -4.83 1.74 -1.04 -3.02 116.66 110.97 3k0f n ARG 184 Ca -0.17 -3.63 0.00 0.00 -0.77 0.00 0.00 57.85 53.28 3k0f n ARG 184 Cb 0.53 1.51 0.00 0.00 -1.02 0.00 0.00 32.46 33.48 3k0f n ARG 184 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 3k0f n ILE 185 N -1.09 0.24 -3.72 0.55 -0.00 -1.26 -4.40 119.36 109.68 3k0f n ILE 185 Ca -0.13 -0.27 -0.12 0.00 -0.00 0.00 0.00 62.75 62.24 3k0f n ILE 185 Cb 0.64 1.02 -0.12 0.00 -0.00 0.00 0.00 39.64 41.17 3k0f n ILE 185 CO 0.00 0.00 0.00 -0.70 -0.00 0.00 0.00 176.55 175.85 3k0f s GLU 186 N -0.24 0.29 0.15 6.28 -6.30 -1.26 -5.02 118.70 112.60 3k0f s GLU 186 Ca 0.00 0.64 -0.18 0.00 -2.50 0.00 0.00 54.97 52.93 3k0f s GLU 186 Cb 0.00 -0.07 0.05 0.00 0.00 0.00 0.00 34.13 34.11 3k0f s GLU 186 CO 0.00 -0.16 1.69 1.49 0.02 0.00 0.00 175.26 178.30 3k0f h GLU 187 N 7.10 0.02 -0.38 4.30 4.57 -1.95 -2.66 114.58 125.59 3k0f h GLU 187 Ca -0.38 -0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 57.62 3k0f h GLU 187 Cb 1.17 -0.01 -0.11 0.00 -0.16 0.00 0.00 28.75 29.65 3k0f h GLU 187 CO 0.34 0.02 -0.02 0.66 -1.18 0.00 0.00 179.01 178.82 3k0f n TYR 188 N -5.24 1.19 -0.55 0.92 4.02 -1.26 -4.97 117.16 111.28 3k0f n TYR 188 Ca 0.00 -1.51 0.00 0.00 -0.01 0.00 0.00 57.90 56.38 3k0f n TYR 188 Cb 0.18 -0.50 0.00 0.00 -0.02 0.00 0.00 39.34 39.00 3k0f n TYR 188 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3k0f n GLY 189 N -1.04 1.30 3.69 2.72 0.00 -1.00 -5.01 105.19 105.85 3k0f n GLY 189 Ca 0.33 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 44.29 3k0f n GLY 189 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3k0f n PRO 190 N 0.00 0.56 0.39 1.61 -0.04 -1.26 -4.93 135.00 131.33 3k0f n PRO 190 Ca 0.00 0.26 -0.19 0.00 -0.04 0.00 0.00 63.50 63.53 3k0f n PRO 190 Cb 0.00 -2.43 -0.09 0.00 -0.04 0.00 0.00 33.50 30.94 3k0f n PRO 190 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3k0f h ILE 191 N -0.31 0.11 -2.80 0.52 5.03 -1.95 -3.45 117.51 114.66 3k0f h ILE 191 Ca -0.48 0.00 -0.46 0.00 -0.12 0.00 0.00 64.86 63.79 3k0f h ILE 191 Cb 1.32 0.11 -0.14 0.00 -3.03 0.00 0.00 36.82 35.07 3k0f h ILE 191 CO 0.48 0.00 -0.70 0.00 -0.68 0.00 0.00 178.15 177.26 3k0f s ALA 192 N -5.97 2.16 0.17 1.87 0.00 -1.26 -4.71 121.76 114.02 3k0f s ALA 192 Ca -0.18 -1.79 -0.21 0.00 0.00 0.00 0.00 51.96 49.78 3k0f s ALA 192 Cb 0.04 0.11 0.08 0.00 0.00 0.00 0.00 23.12 23.34 3k0f s ALA 192 CO 0.61 -0.03 1.34 0.54 0.00 0.00 0.00 175.76 178.22 3k0f n ARG 193 N -0.49 -0.29 0.00 0.00 1.74 -1.17 -2.16 116.66 114.30 3k0f n ARG 193 Ca -0.06 1.32 0.15 0.00 -0.77 0.00 0.00 57.85 58.49 3k0f n ARG 193 Cb 0.62 -1.95 0.76 0.00 -1.02 0.00 0.00 32.46 30.87 3k0f n ARG 193 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3k0f n TYR 194 N -5.18 0.00 -2.52 -1.55 4.02 -1.26 -4.90 117.16 105.76 3k0f n TYR 194 Ca 0.05 0.00 -0.20 0.00 -0.01 0.00 0.00 57.90 57.75 3k0f n TYR 194 Cb 0.29 -0.01 -0.00 0.00 -0.02 0.00 0.00 39.34 39.59 3k0f n TYR 194 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3k0f n GLY 195 N 1.09 -0.50 0.00 2.72 0.00 -0.92 -4.77 105.19 102.81 3k0f n GLY 195 Ca 0.21 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3k0f n GLY 195 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3k0f n VAL 196 N -3.97 0.00 0.08 1.61 0.31 -1.26 -4.85 118.33 110.25 3k0f n VAL 196 Ca -0.20 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.15 3k0f n VAL 196 Cb 0.66 -0.33 0.39 0.00 -0.91 0.00 0.00 33.84 33.65 3k0f n VAL 196 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 3k0f h GLU 197 N 0.00 0.34 -0.65 5.55 3.07 -1.90 -3.05 114.58 117.95 3k0f h GLU 197 Ca 0.00 -0.06 0.12 0.00 -0.50 0.00 0.00 59.36 58.91 3k0f h GLU 197 Cb 0.45 -0.06 -0.08 0.00 -0.84 0.00 0.00 28.75 28.22 3k0f h GLU 197 CO 0.00 0.40 0.21 0.93 -1.40 0.00 0.00 179.01 179.14 3k0f h GLU 198 N 0.34 0.34 0.01 2.33 3.07 -1.94 -2.78 114.58 115.95 3k0f h GLU 198 Ca 0.08 -0.02 -0.27 0.00 -0.50 0.00 0.00 59.36 58.65 3k0f h GLU 198 Cb 0.27 -0.08 0.02 0.00 -0.84 0.00 0.00 28.75 28.12 3k0f h GLU 198 CO 0.01 0.23 -1.05 0.74 -1.40 0.00 0.00 179.01 177.53 3k0f h PHE 199 N 0.35 1.01 0.00 4.33 0.04 -1.90 -3.30 116.94 117.47 3k0f h PHE 199 Ca 0.34 -0.56 0.00 0.00 2.80 0.00 0.00 57.97 60.56 3k0f h PHE 199 Cb 0.49 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.53 3k0f h PHE 199 CO -0.20 1.39 0.00 0.28 -0.60 0.00 0.00 178.31 179.18 3k0f n VAL 200 N -3.84 0.43 -4.03 -0.55 0.31 -1.10 -4.76 118.33 104.79 3k0f n VAL 200 Ca -0.11 0.11 -0.34 0.00 -0.01 0.00 0.00 64.34 63.99 3k0f n VAL 200 Cb 0.89 -0.75 -0.06 0.00 -0.91 0.00 0.00 33.84 33.00 3k0f n VAL 200 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 3k0f s SER 201 N -2.74 5.96 0.14 4.52 0.01 -1.07 -4.83 113.70 115.68 3k0f s SER 201 Ca 0.16 0.26 -0.02 0.00 1.31 0.00 0.00 55.95 57.66 3k0f s SER 201 Cb 0.14 -1.79 -0.09 0.00 0.21 0.00 0.00 66.02 64.49 3k0f s SER 201 CO 0.35 0.30 1.31 0.44 0.41 0.00 0.00 173.24 176.05 3k0f h ASP 202 N 4.24 0.41 -4.21 2.44 3.32 -1.86 -3.45 116.42 117.31 3k0f h ASP 202 Ca -0.50 -0.35 -0.64 0.00 0.02 0.00 0.00 57.03 55.57 3k0f h ASP 202 Cb 1.19 -0.13 -0.25 0.00 0.22 0.00 0.00 39.33 40.37 3k0f h ASP 202 CO 0.63 1.16 -0.86 0.20 -1.72 0.00 0.00 179.24 178.65 3k0f s ASN 203 N -7.03 2.87 -0.11 6.45 0.01 -1.24 -1.77 114.94 114.12 3k0f s ASN 203 Ca -0.04 -0.61 -0.04 0.00 -0.71 0.00 0.00 52.86 51.46 3k0f s ASN 203 Cb 0.09 -0.23 0.06 0.00 0.41 0.00 0.00 41.25 41.58 3k0f s ASN 203 CO 0.85 0.19 0.20 -0.69 -1.51 0.00 0.00 177.10 176.14 3k0f s VAL 204 N -0.89 -0.32 -0.08 1.60 1.01 -0.41 -1.15 120.40 120.16 3k0f s VAL 204 Ca 0.10 0.29 0.04 0.00 0.00 0.00 0.00 61.98 62.41 3k0f s VAL 204 Cb -0.10 -0.38 -0.01 0.00 0.00 0.00 0.00 36.38 35.89 3k0f s VAL 204 CO 0.03 0.11 -0.19 -0.69 0.00 0.00 0.00 175.10 174.35 3k0f s VAL 205 N 2.34 2.53 -0.13 2.92 1.01 0.20 -0.89 120.40 128.37 3k0f s VAL 205 Ca 0.03 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.13 3k0f s VAL 205 Cb -0.12 -1.98 -0.01 0.00 0.00 0.00 0.00 36.38 34.26 3k0f s VAL 205 CO -0.07 0.56 -0.14 -0.63 0.00 0.00 0.00 175.10 174.82 3k0f s ILE 206 N -0.07 2.92 -0.23 2.22 1.01 0.62 -1.82 121.20 125.86 3k0f s ILE 206 Ca -0.05 -0.70 -0.06 0.00 0.00 0.00 0.00 60.65 59.84 3k0f s ILE 206 Cb -0.14 -2.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.08 3k0f s ILE 206 CO 0.04 0.52 0.02 -0.76 0.00 0.00 0.00 174.94 174.77 3k0f s LEU 207 N 0.44 3.24 0.24 2.97 1.43 -0.43 -0.81 118.68 125.76 3k0f s LEU 207 Ca -0.10 -0.26 0.08 0.00 -1.03 0.00 0.00 54.13 52.82 3k0f s LEU 207 Cb -0.16 -1.85 -0.04 0.00 0.03 0.00 0.00 46.19 44.17 3k0f s LEU 207 CO 0.05 -0.01 0.04 -0.13 0.23 0.00 0.00 176.35 176.53 3k0f s ARG 208 N 1.43 2.46 -0.40 1.70 0.52 0.07 -4.15 118.95 120.57 3k0f s ARG 208 Ca 0.05 -1.25 0.10 0.00 -0.52 0.00 0.00 55.73 54.11 3k0f s ARG 208 Cb -0.15 -2.30 0.31 0.00 0.52 0.00 0.00 34.95 33.34 3k0f s ARG 208 CO 0.01 0.40 0.68 -1.71 0.02 0.00 0.00 175.30 174.70 3k0f n ASN 209 N -0.75 1.04 -4.75 0.23 4.05 -1.26 -2.03 115.26 111.79 3k0f n ASN 209 Ca -0.08 -2.98 -0.41 0.00 0.45 0.00 0.00 54.58 51.56 3k0f n ASN 209 Cb 0.58 -0.62 -0.02 0.00 1.23 0.00 0.00 39.78 40.95 3k0f n ASN 209 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 3k0f s VAL 210 N -2.20 2.31 0.00 3.44 1.01 -1.01 -4.72 120.40 119.23 3k0f s VAL 210 Ca 0.39 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.64 3k0f s VAL 210 Cb 0.28 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.49 3k0f s VAL 210 CO -0.09 0.04 0.00 -0.11 0.00 0.00 0.00 175.10 174.94 3k0f n LEU 211 N 2.07 0.00 -1.44 3.92 7.94 -1.26 -0.83 117.00 127.41 3k0f n LEU 211 Ca 0.07 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.97 3k0f n LEU 211 Cb 0.39 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.34 3k0f n LEU 211 CO 0.62 0.00 -0.17 1.21 -1.11 0.00 0.00 177.39 177.94 3k0f n GLU 212 N 0.00 -1.81 0.00 1.96 2.13 -1.25 -4.18 120.64 117.49 3k0f n GLU 212 Ca 0.00 1.64 0.00 0.00 0.66 0.00 0.00 57.16 59.46 3k0f n GLU 212 Cb 0.00 -1.93 0.00 0.00 0.27 0.00 0.00 31.44 29.78 3k0f n GLU 212 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3k0f n GLY 213 N 0.63 0.91 0.03 8.31 0.00 -1.26 -2.77 105.19 111.04 3k0f n GLY 213 Ca 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 46.02 45.24 3k0f n GLY 213 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k0f n GLU 214 N 12.43 2.18 -3.82 1.61 1.02 -1.26 -5.01 120.64 127.78 3k0f n GLU 214 Ca 0.00 -1.56 -0.25 0.00 -0.02 0.00 0.00 57.16 55.33 3k0f n GLU 214 Cb 0.00 -1.01 -0.03 0.00 -0.02 0.00 0.00 31.44 30.38 3k0f n GLU 214 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 3k0f s ARG 215 N -1.19 3.47 0.01 3.49 1.81 -1.12 -5.11 118.95 120.30 3k0f s ARG 215 Ca 0.06 -0.54 0.06 0.00 -1.72 0.00 0.00 55.73 53.59 3k0f s ARG 215 Cb 0.05 -2.87 -0.03 0.00 -0.45 0.00 0.00 34.95 31.65 3k0f s ARG 215 CO 0.01 0.42 -0.18 1.03 -0.68 0.00 0.00 175.30 175.89 3k0f s ARG 216 N -3.60 2.19 -0.19 3.54 1.81 -1.26 -3.84 118.95 117.60 3k0f s ARG 216 Ca 0.36 -0.89 -0.01 0.00 -1.72 0.00 0.00 55.73 53.47 3k0f s ARG 216 Cb -0.10 -2.21 0.05 0.00 -0.45 0.00 0.00 34.95 32.24 3k0f s ARG 216 CO 0.30 0.57 -0.03 0.50 -0.68 0.00 0.00 175.30 175.96 3k0f s ARG 217 N -1.10 1.26 0.30 3.54 3.52 -0.01 -4.97 118.95 121.49 3k0f s ARG 217 Ca 0.13 -0.63 -0.27 0.00 -0.13 0.00 0.00 55.73 54.83 3k0f s ARG 217 Cb -0.10 -2.20 -0.10 0.00 -1.56 0.00 0.00 34.95 30.99 3k0f s ARG 217 CO 0.03 -0.54 0.94 1.03 -0.81 0.00 0.00 175.30 175.95 3k0f s ARG 218 N 1.63 4.66 0.04 5.12 0.52 -1.26 -2.40 118.95 127.26 3k0f s ARG 218 Ca -0.02 1.37 -0.09 0.00 -0.52 0.00 0.00 55.73 56.47 3k0f s ARG 218 Cb -0.17 -2.93 0.00 0.00 0.52 0.00 0.00 34.95 32.37 3k0f s ARG 218 CO -0.07 0.35 0.19 0.95 0.02 0.00 0.00 175.30 176.74 3k0f s THR 219 N -1.50 0.11 0.00 0.02 -4.23 -0.86 -2.48 115.64 106.71 3k0f s THR 219 Ca 0.48 -0.91 0.05 0.00 -1.18 0.00 0.00 61.69 60.12 3k0f s THR 219 Cb -0.21 -0.93 -0.01 0.00 1.34 0.00 0.00 72.50 72.69 3k0f s THR 219 CO 0.26 -0.50 -0.14 -0.22 -0.54 0.00 0.00 174.62 173.47 3k0f s LEU 220 N -2.13 2.06 0.00 4.79 0.20 0.21 -0.75 118.68 123.07 3k0f s LEU 220 Ca -0.05 -0.31 0.00 0.00 0.69 0.00 0.00 54.13 54.47 3k0f s LEU 220 Cb -0.01 -0.70 -0.01 0.00 -0.43 0.00 0.00 46.19 45.05 3k0f s LEU 220 CO -0.04 0.14 -0.02 -0.70 -0.29 0.00 0.00 176.35 175.44 3k0f s GLU 221 N -0.54 0.16 -0.64 1.98 2.12 0.01 -1.01 118.70 120.79 3k0f s GLU 221 Ca 0.05 -0.18 -0.06 0.00 0.36 0.00 0.00 54.97 55.14 3k0f s GLU 221 Cb -0.06 -0.08 0.17 0.00 0.26 0.00 0.00 34.13 34.41 3k0f s GLU 221 CO -0.00 0.02 0.49 0.42 -0.54 0.00 0.00 175.26 175.65 3k0f s ILE 222 N -0.33 4.21 0.11 -3.70 1.01 -1.26 -0.28 121.20 120.97 3k0f s ILE 222 Ca -0.03 -2.64 -0.18 0.00 0.00 0.00 0.00 60.65 57.80 3k0f s ILE 222 Cb -0.03 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 3k0f s ILE 222 CO -0.00 -0.89 1.66 0.25 0.00 0.00 0.00 174.94 175.96 3k0f h LEU 223 N 7.45 0.42 -7.13 2.97 6.46 -1.37 -3.44 115.31 120.67 3k0f h LEU 223 Ca -0.02 -0.16 -0.07 0.00 -0.12 0.00 0.00 57.88 57.51 3k0f h LEU 223 Cb 0.99 -0.11 -0.21 0.00 -0.73 0.00 0.00 40.66 40.61 3k0f h LEU 223 CO 0.74 0.47 0.02 -1.59 -0.62 0.00 0.00 178.44 177.46 3k0f s LYS 224 N -5.57 0.82 -0.23 1.25 -2.85 -1.21 -5.00 119.74 106.94 3k0f s LYS 224 Ca -0.13 0.51 -0.03 0.00 -1.00 0.00 0.00 55.97 55.32 3k0f s LYS 224 Cb 0.09 0.39 0.07 0.00 -2.06 0.00 0.00 37.83 36.32 3k0f s LYS 224 CO 0.73 -0.18 0.08 -0.51 0.10 0.00 0.00 175.35 175.57 3k0f s LEU 225 N -0.39 1.04 0.16 2.77 1.43 -1.26 -1.29 118.68 121.15 3k0f s LEU 225 Ca -0.05 -1.01 -0.31 0.00 -1.03 0.00 0.00 54.13 51.73 3k0f s LEU 225 Cb -0.03 -0.51 -0.09 0.00 0.03 0.00 0.00 46.19 45.59 3k0f s LEU 225 CO 0.04 -0.36 1.46 -0.13 0.23 0.00 0.00 176.35 177.59 3k0f s ARG 226 N 1.93 4.27 0.00 1.70 0.52 -0.73 -2.94 118.95 123.71 3k0f s ARG 226 Ca 0.04 2.23 0.00 0.00 -0.52 0.00 0.00 55.73 57.47 3k0f s ARG 226 Cb -0.17 -3.18 0.00 0.00 0.52 0.00 0.00 34.95 32.12 3k0f s ARG 226 CO -0.17 -0.49 0.00 0.41 0.02 0.00 0.00 175.30 175.07 3k0f n GLY 227 N 3.30 3.05 2.40 -3.53 0.00 -1.26 -4.99 105.19 104.16 3k0f n GLY 227 Ca 0.11 -0.57 -0.19 0.00 0.00 0.00 0.00 46.02 45.37 3k0f n GLY 227 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k0f n THR 228 N 0.00 0.00 -3.48 2.61 -2.24 -1.15 -4.67 114.28 105.34 3k0f n THR 228 Ca 0.00 -1.66 -0.19 0.00 -2.27 0.00 0.00 64.05 59.92 3k0f n THR 228 Cb 0.00 0.51 -0.01 0.00 -2.10 0.00 0.00 70.33 68.73 3k0f n THR 228 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3k0f s SER 229 N -2.81 5.77 0.01 3.42 1.04 -1.26 -4.67 113.70 115.19 3k0f s SER 229 Ca 0.10 -0.30 -0.29 0.00 0.48 0.00 0.00 55.95 55.94 3k0f s SER 229 Cb 0.00 -1.09 0.10 0.00 0.10 0.00 0.00 66.02 65.14 3k0f s SER 229 CO 0.07 -0.46 1.03 -1.38 0.98 0.00 0.00 173.24 173.48 3k0f s HIS 230 N -2.23 -0.19 0.36 5.02 -3.43 -1.26 -4.51 115.29 109.05 3k0f s HIS 230 Ca 0.45 0.02 -0.26 0.00 -0.80 0.00 0.00 55.06 54.48 3k0f s HIS 230 Cb -0.09 0.57 -0.09 0.00 -1.43 0.00 0.00 32.58 31.54 3k0f s HIS 230 CO 0.30 -0.53 1.10 -1.64 -2.00 0.00 0.00 174.74 171.98 3k0f s MET 231 N -2.93 4.31 0.18 -0.38 -1.94 0.11 -5.01 119.30 113.64 3k0f s MET 231 Ca 0.10 1.70 -0.01 0.00 -1.71 0.00 0.00 55.69 55.77 3k0f s MET 231 Cb -0.00 -2.81 -0.04 0.00 2.01 0.00 0.00 34.83 33.98 3k0f s MET 231 CO -0.04 -0.06 0.38 0.15 -0.01 0.00 0.00 175.02 175.44 3k0f s LYS 232 N -2.06 3.53 0.03 2.03 3.01 -1.26 -4.56 119.74 120.45 3k0f s LYS 232 Ca 0.53 -0.31 0.00 0.00 -1.01 0.00 0.00 55.97 55.17 3k0f s LYS 232 Cb -0.28 -2.86 0.00 0.00 -1.01 0.00 0.00 37.83 33.69 3k0f s LYS 232 CO 0.35 0.43 0.00 0.41 0.51 0.00 0.00 175.35 177.05 3k0f n GLY 233 N -0.49 -3.63 3.86 -3.33 0.00 -1.26 -5.00 105.19 95.34 3k0f n GLY 233 Ca -0.04 -1.98 -0.33 0.00 0.00 0.00 0.00 46.02 43.67 3k0f n GLY 233 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k0f s GLU 234 N -0.86 3.94 -0.00 1.61 2.02 -1.26 -4.21 118.70 119.93 3k0f s GLU 234 Ca 0.00 0.51 0.00 0.00 0.02 0.00 0.00 54.97 55.50 3k0f s GLU 234 Cb 0.00 -2.59 0.00 0.00 0.10 0.00 0.00 34.13 31.64 3k0f s GLU 234 CO 0.00 0.26 -0.00 0.71 0.02 0.00 0.00 175.26 176.25 3k0f s TYR 235 N -1.85 0.04 0.50 1.61 1.51 -0.18 -4.93 117.35 114.06 3k0f s TYR 235 Ca 0.49 -0.01 -0.17 0.00 -1.01 0.00 0.00 57.07 56.38 3k0f s TYR 235 Cb -0.11 -0.03 -0.08 0.00 -0.11 0.00 0.00 41.96 41.63 3k0f s TYR 235 CO 0.19 -0.00 0.97 -1.25 -1.11 0.00 0.00 175.55 174.35 3k0f s PRO 236 N 0.00 3.97 0.20 -1.71 0.04 -1.26 0.68 135.00 136.92 3k0f s PRO 236 Ca 0.00 0.95 -0.10 0.00 0.04 0.00 0.00 61.00 61.89 3k0f s PRO 236 Cb -0.00 -2.15 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 3k0f s PRO 236 CO -0.00 -0.24 0.36 -0.59 0.04 0.00 0.00 177.00 176.57 3k0f s PHE 237 N -2.57 0.43 0.08 0.56 -0.12 -1.03 -2.59 117.98 112.73 3k0f s PHE 237 Ca 0.59 -0.78 0.01 0.00 -0.05 0.00 0.00 56.93 56.71 3k0f s PHE 237 Cb -0.10 0.01 -0.04 0.00 -0.63 0.00 0.00 43.02 42.27 3k0f s PHE 237 CO 0.29 -0.83 -0.06 0.99 -0.05 0.00 0.00 175.22 175.57 3k0f s THR 238 N -4.00 0.59 -0.23 -4.49 2.01 -0.71 -4.39 115.64 104.42 3k0f s THR 238 Ca 0.21 -1.78 -0.03 0.00 0.31 0.00 0.00 61.69 60.40 3k0f s THR 238 Cb 0.02 -1.48 0.00 0.00 0.01 0.00 0.00 72.50 71.05 3k0f s THR 238 CO 0.04 -0.82 -0.05 -0.63 -0.69 0.00 0.00 174.62 172.48 3k0f s ILE 239 N -3.31 3.17 0.26 1.82 1.01 -1.26 -1.73 121.20 121.17 3k0f s ILE 239 Ca 0.08 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 60.06 3k0f s ILE 239 Cb 0.03 -2.49 0.01 0.00 0.01 0.00 0.00 42.46 40.02 3k0f s ILE 239 CO -0.05 0.35 0.08 0.35 0.00 0.00 0.00 174.94 175.68 3k0f n THR 240 N 4.76 0.00 1.20 2.92 -2.24 -0.22 -4.95 114.28 115.75 3k0f n THR 240 Ca -0.18 -1.16 0.10 0.00 -2.27 0.00 0.00 64.05 60.54 3k0f n THR 240 Cb 0.50 0.04 0.57 0.00 -2.10 0.00 0.00 70.33 69.34 3k0f n THR 240 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3k0f n ASP 241 N -1.45 0.00 -1.06 3.42 8.00 -1.26 -1.43 116.55 122.77 3k0f n ASP 241 Ca -0.07 -0.54 0.01 0.00 0.71 0.00 0.00 54.79 54.90 3k0f n ASP 241 Cb 0.32 -0.03 0.23 0.00 -0.02 0.00 0.00 41.12 41.61 3k0f n ASP 241 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3k0f n HIS 242 N -1.03 1.08 -4.17 1.24 8.25 -1.26 -4.27 115.22 115.06 3k0f n HIS 242 Ca 0.14 -1.26 0.00 0.00 -0.26 0.00 0.00 57.72 56.34 3k0f n HIS 242 Cb 0.08 -0.42 0.00 0.00 1.12 0.00 0.00 29.99 30.77 3k0f n HIS 242 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k0f n GLY 243 N -0.85 -0.10 3.72 -1.41 0.00 -0.51 -4.82 105.19 101.22 3k0f n GLY 243 Ca 0.28 -1.02 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 3k0f n GLY 243 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k0f s ILE 244 N 0.00 4.27 -0.23 -0.61 1.01 -1.26 -1.05 121.20 123.33 3k0f s ILE 244 Ca 0.00 1.77 -0.01 0.00 0.00 0.00 0.00 60.65 62.41 3k0f s ILE 244 Cb 0.00 -4.13 0.07 0.00 0.01 0.00 0.00 42.46 38.40 3k0f s ILE 244 CO 0.00 0.22 0.02 0.21 0.00 0.00 0.00 174.94 175.39 3k0f s ASN 245 N 0.47 3.43 0.09 3.58 2.47 -0.70 -4.05 114.94 120.23 3k0f s ASN 245 Ca 0.52 -1.10 0.01 0.00 0.42 0.00 0.00 52.86 52.71 3k0f s ASN 245 Cb -0.26 -0.84 -0.04 0.00 -1.45 0.00 0.00 41.25 38.66 3k0f s ASN 245 CO 0.31 -0.31 0.22 -0.63 -3.72 0.00 0.00 177.10 172.98 3k0f s ILE 246 N 1.66 5.29 -0.37 -5.21 1.01 -0.01 -1.74 121.20 121.83 3k0f s ILE 246 Ca -0.00 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 60.14 3k0f s ILE 246 Cb -0.18 -3.63 0.11 0.00 0.01 0.00 0.00 42.46 38.77 3k0f s ILE 246 CO -0.11 0.06 0.12 -0.36 0.00 0.00 0.00 174.94 174.65 3k0f s PHE 247 N -1.59 2.70 -1.30 3.97 0.40 -1.07 -3.95 117.98 117.15 3k0f s PHE 247 Ca 0.34 -2.49 -0.17 0.00 -0.60 0.00 0.00 56.93 54.00 3k0f s PHE 247 Cb -0.12 -2.33 0.03 0.00 0.51 0.00 0.00 43.02 41.10 3k0f s PHE 247 CO 0.28 -0.87 1.94 -2.30 0.70 0.00 0.00 175.22 174.96 3k0f n PRO 248 N 4.21 2.80 0.03 0.24 -0.02 -1.26 -4.44 135.00 136.55 3k0f n PRO 248 Ca 0.03 -2.86 0.21 0.00 -2.02 0.00 0.00 63.50 58.85 3k0f n PRO 248 Cb 0.40 -3.41 0.72 0.00 -0.02 0.00 0.00 33.50 31.19 3k0f n PRO 248 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 3k0f h LEU 249 N 12.32 0.00 -1.00 2.45 3.38 -1.95 0.18 115.31 130.68 3k0f h LEU 249 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 3k0f h LEU 249 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 3k0f h LEU 249 CO 1.62 0.00 0.00 0.61 0.09 0.00 0.00 178.44 180.76 3k0f n GLY 250 N -1.59 0.17 0.84 0.83 0.00 -1.26 -3.43 105.19 100.75 3k0f n GLY 250 Ca 0.09 -0.38 0.10 0.00 0.00 0.00 0.00 46.02 45.82 3k0f n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k0f n ALA 251 N 0.22 2.44 -2.03 4.61 0.00 0.65 -4.95 120.51 121.45 3k0f n ALA 251 Ca 0.16 -0.77 -0.41 0.00 0.00 0.00 0.00 53.44 52.41 3k0f n ALA 251 Cb 0.30 -0.67 -0.03 0.00 0.00 0.00 0.00 19.45 19.05 3k0f n ALA 251 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 3k0f s MET 252 N -1.48 4.46 -0.14 0.00 0.00 -1.22 -5.02 119.30 115.90 3k0f s MET 252 Ca 0.26 1.93 -0.07 0.00 0.00 0.00 0.00 55.69 57.82 3k0f s MET 252 Cb 0.17 -3.22 -0.04 0.00 0.00 0.00 0.00 34.83 31.74 3k0f s MET 252 CO 0.25 -0.14 0.11 1.03 0.00 0.00 0.00 175.02 176.27 3k0f s ARG 253 N -0.25 3.56 -1.40 4.11 0.52 -1.26 -5.01 118.95 119.22 3k0f s ARG 253 Ca 0.54 -0.20 -0.15 0.00 -0.52 0.00 0.00 55.73 55.40 3k0f s ARG 253 Cb -0.34 -3.18 0.06 0.00 0.52 0.00 0.00 34.95 32.01 3k0f s ARG 253 CO 0.38 0.64 2.05 -0.11 0.02 0.00 0.00 175.30 178.28 3k0f n LEU 254 N 2.42 6.28 0.00 2.53 7.94 -1.26 -4.34 117.00 130.56 3k0f n LEU 254 Ca -0.19 -4.12 0.00 0.00 -1.11 0.00 0.00 56.01 50.59 3k0f n LEU 254 Cb 0.54 -1.67 0.00 0.00 0.53 0.00 0.00 43.42 42.82 3k0f n LEU 254 CO 0.32 0.85 0.11 0.41 -1.11 0.00 0.00 177.39 177.97 3k0f n THR 255 N 5.34 0.00 -0.66 1.96 -1.04 -1.26 -5.11 114.28 113.51 3k0f n THR 255 Ca 0.50 -0.32 -0.22 0.00 -2.04 0.00 0.00 64.05 61.96 3k0f n THR 255 Cb 0.41 1.24 -0.01 0.00 -1.82 0.00 0.00 70.33 70.14 3k0f n THR 255 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3k0f n GLN 256 N -0.21 0.00 -1.68 -2.82 0.00 -1.26 -4.91 117.38 106.50 3k0f n GLN 256 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 57.00 56.69 3k0f n GLN 256 Cb 0.06 -0.48 0.04 0.00 0.00 0.00 0.00 30.24 29.86 3k0f n GLN 256 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 3k0f s ARG 257 N -0.48 3.09 -0.26 2.61 0.52 -1.26 -5.05 118.95 118.12 3k0f s ARG 257 Ca 0.30 0.85 -0.04 0.00 -0.52 0.00 0.00 55.73 56.32 3k0f s ARG 257 Cb -0.42 -2.01 0.14 0.00 0.52 0.00 0.00 34.95 33.18 3k0f s ARG 257 CO 0.27 -0.96 0.49 0.45 0.02 0.00 0.00 175.30 175.57 3k0f s SER 258 N -3.95 -0.56 0.02 0.23 0.15 -1.26 -4.93 113.70 103.40 3k0f s SER 258 Ca 0.57 0.78 0.00 0.00 0.70 0.00 0.00 55.95 58.00 3k0f s SER 258 Cb -0.13 1.65 0.00 0.00 -1.71 0.00 0.00 66.02 65.84 3k0f s SER 258 CO 0.54 -0.26 0.00 -1.54 1.20 0.00 0.00 173.24 173.18 3k0f n SER 259 N 5.40 0.00 -0.01 5.45 3.41 -1.26 -5.04 113.62 121.57 3k0f n SER 259 Ca -0.05 -0.54 0.01 0.00 -0.26 0.00 0.00 58.87 58.02 3k0f n SER 259 Cb 0.50 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.46 3k0f n SER 259 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3k0f n ASN 260 N -1.63 1.69 -4.76 4.04 3.02 -1.26 -4.82 115.26 111.55 3k0f n ASN 260 Ca 0.00 -1.92 -0.40 0.00 -0.03 0.00 0.00 54.58 52.23 3k0f n ASN 260 Cb 0.00 -0.03 0.02 0.00 -0.61 0.00 0.00 39.78 39.16 3k0f n ASN 260 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3k0f s VAL 261 N -0.96 2.02 0.15 2.41 1.01 -1.26 -4.90 120.40 118.86 3k0f s VAL 261 Ca 0.02 0.01 0.08 0.00 0.00 0.00 0.00 61.98 62.10 3k0f s VAL 261 Cb 0.02 -3.01 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 3k0f s VAL 261 CO 0.00 0.00 -0.11 -0.13 0.00 0.00 0.00 175.10 174.86 3k0f s ARG 262 N -2.56 2.03 0.03 2.72 1.81 -1.26 -0.90 118.95 120.82 3k0f s ARG 262 Ca 0.63 -1.18 -0.07 0.00 -1.72 0.00 0.00 55.73 53.40 3k0f s ARG 262 Cb -0.44 -2.20 -0.01 0.00 -0.45 0.00 0.00 34.95 31.86 3k0f s ARG 262 CO 0.55 0.47 0.12 0.08 -0.68 0.00 0.00 175.30 175.84 3k0f s VAL 263 N -1.45 0.12 0.59 3.52 1.01 -1.05 -4.80 120.40 118.34 3k0f s VAL 263 Ca 0.22 -0.95 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 3k0f s VAL 263 Cb -0.10 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 3k0f s VAL 263 CO 0.14 -0.53 0.93 -0.55 0.00 0.00 0.00 175.10 175.10 3k0f s SER 264 N -1.92 5.80 0.00 3.32 0.15 -1.26 -2.06 113.70 117.72 3k0f s SER 264 Ca -0.08 0.95 0.21 0.00 0.70 0.00 0.00 55.95 57.73 3k0f s SER 264 Cb -0.03 -1.98 0.28 0.00 -1.71 0.00 0.00 66.02 62.58 3k0f s SER 264 CO -0.03 -0.99 1.25 -1.54 1.20 0.00 0.00 173.24 173.13 3k0f n SER 265 N -2.62 3.02 0.00 5.45 3.41 -1.26 -4.85 113.62 116.76 3k0f n SER 265 Ca 0.04 -1.90 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 3k0f n SER 265 Cb 0.56 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 3k0f n SER 265 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k0f n GLY 266 N 1.23 1.37 2.78 5.00 0.00 -1.25 -3.00 105.19 111.32 3k0f n GLY 266 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 3k0f n GLY 266 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k0f s VAL 267 N -2.57 1.11 0.21 1.61 1.01 -1.26 -4.92 120.40 115.59 3k0f s VAL 267 Ca 0.00 -1.58 -0.15 0.00 0.00 0.00 0.00 61.98 60.24 3k0f s VAL 267 Cb 0.00 -1.84 0.22 0.00 0.00 0.00 0.00 36.38 34.77 3k0f s VAL 267 CO 0.00 -0.67 1.60 0.58 0.00 0.00 0.00 175.10 176.61 3k0f h VAL 268 N 6.47 0.26 -0.74 2.92 2.07 -1.97 0.73 116.25 125.98 3k0f h VAL 268 Ca -0.12 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.55 3k0f h VAL 268 Cb 1.01 0.26 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 3k0f h VAL 268 CO 0.48 0.00 0.50 -0.09 0.02 0.00 0.00 177.57 178.48 3k0f h ARG 269 N -0.06 0.42 -0.01 1.57 9.65 -1.96 0.27 114.38 124.27 3k0f h ARG 269 Ca 0.30 -0.03 -0.15 0.00 -1.10 0.00 0.00 59.98 59.00 3k0f h ARG 269 Cb 0.52 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.99 3k0f h ARG 269 CO -0.70 0.28 -0.71 1.25 2.80 0.00 0.00 179.97 182.88 3k0f h LEU 270 N 0.43 0.07 -1.07 3.80 6.46 -1.31 -2.06 115.31 121.64 3k0f h LEU 270 Ca 0.36 -0.05 -0.06 0.00 -0.12 0.00 0.00 57.88 58.01 3k0f h LEU 270 Cb 0.80 -0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.69 3k0f h LEU 270 CO -0.12 0.76 0.02 0.44 -0.62 0.00 0.00 178.44 178.92 3k0f h ASP 271 N 0.04 0.64 0.32 1.25 3.32 0.30 -1.21 116.42 121.07 3k0f h ASP 271 Ca -0.01 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 56.89 3k0f h ASP 271 Cb 1.26 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.65 3k0f h ASP 271 CO 0.10 0.70 -0.16 -0.33 -1.72 0.00 0.00 179.24 177.83 3k0f h GLU 272 N 0.64 -0.42 0.00 3.56 5.08 -1.08 0.75 114.58 123.10 3k0f h GLU 272 Ca 0.13 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3k0f h GLU 272 Cb 0.38 0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.72 3k0f h GLU 272 CO 0.01 -0.09 0.44 0.52 -1.00 0.00 0.00 179.01 178.89 3k0f h MET 273 N -0.82 0.00 -0.53 2.33 2.86 -1.08 0.84 114.93 118.53 3k0f h MET 273 Ca -0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3k0f h MET 273 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 3k0f h MET 273 CO 0.07 0.00 0.00 0.00 1.06 0.00 0.00 176.91 178.04 3k0f n GLY 275 N 0.83 0.46 0.00 0.00 0.00 0.29 -4.26 105.19 102.52 3k0f n GLY 275 Ca 0.21 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.47 3k0f n GLY 275 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k0f n GLY 276 N -2.86 0.69 0.11 -0.02 0.00 0.22 -4.91 105.19 98.41 3k0f n GLY 276 Ca -0.01 -0.33 0.01 0.00 0.00 0.00 0.00 46.02 45.69 3k0f n GLY 276 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k0f n GLY 277 N 0.00 -2.66 3.06 -0.02 0.00 0.11 -4.68 105.19 101.00 3k0f n GLY 277 Ca 0.00 -1.42 -0.28 0.00 0.00 0.00 0.00 46.02 44.32 3k0f n GLY 277 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3k0f n PHE 278 N -2.19 -3.74 -3.95 1.61 0.99 -0.88 -4.72 117.46 104.59 3k0f n PHE 278 Ca -0.01 -0.81 -0.29 0.00 -0.00 0.00 0.00 57.45 56.34 3k0f n PHE 278 Cb 0.05 -1.14 -0.04 0.00 -1.00 0.00 0.00 39.48 37.35 3k0f n PHE 278 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.76 176.70 3k0f s PHE 279 N -2.25 3.45 0.29 1.38 0.40 -1.26 -2.53 117.98 117.46 3k0f s PHE 279 Ca 0.64 0.17 0.08 0.00 -0.60 0.00 0.00 56.93 57.22 3k0f s PHE 279 Cb -0.10 -1.70 0.43 0.00 0.51 0.00 0.00 43.02 42.17 3k0f s PHE 279 CO 0.52 0.55 1.67 -0.22 0.70 0.00 0.00 175.22 178.44 3k0f h LYS 280 N 2.75 0.12 -3.77 0.44 3.64 -1.33 -3.34 116.57 115.08 3k0f h LYS 280 Ca -0.46 -0.07 -0.77 0.00 -1.27 0.00 0.00 60.65 58.07 3k0f h LYS 280 Cb 1.17 0.00 -0.28 0.00 -0.41 0.00 0.00 32.23 32.72 3k0f h LYS 280 CO 0.72 0.60 0.03 -0.51 -2.27 0.00 0.00 179.45 178.02 3k0f s ASP 281 N -6.88 6.51 0.00 4.20 1.01 -1.26 -2.86 116.67 117.38 3k0f s ASP 281 Ca -0.03 -2.77 0.00 0.00 0.71 0.00 0.00 52.55 50.46 3k0f s ASP 281 Cb 0.13 -2.14 0.00 0.00 1.01 0.00 0.00 42.92 41.92 3k0f s ASP 281 CO 0.77 -0.52 0.00 -1.54 0.21 0.00 0.00 175.17 174.09 3k0f n SER 282 N 3.81 0.00 -4.80 0.27 3.41 -1.25 -4.84 113.62 110.22 3k0f n SER 282 Ca 0.13 0.00 -0.37 0.00 -0.26 0.00 0.00 58.87 58.38 3k0f n SER 282 Cb 0.45 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.33 3k0f n SER 282 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3k0f s ILE 283 N -1.64 5.32 -0.08 -1.33 -1.09 -1.26 -2.61 121.20 118.51 3k0f s ILE 283 Ca 0.00 0.46 0.03 0.00 -2.23 0.00 0.00 60.65 58.91 3k0f s ILE 283 Cb 0.00 -3.56 -0.02 0.00 -1.58 0.00 0.00 42.46 37.30 3k0f s ILE 283 CO 0.00 0.51 -0.16 -0.63 -1.23 0.00 0.00 174.94 173.43 3k0f s ILE 284 N -0.36 2.84 -0.07 2.92 -1.09 0.26 -2.29 121.20 123.41 3k0f s ILE 284 Ca 0.17 -0.78 0.06 0.00 -2.23 0.00 0.00 60.65 57.86 3k0f s ILE 284 Cb -0.13 -2.12 -0.01 0.00 -1.58 0.00 0.00 42.46 38.62 3k0f s ILE 284 CO 0.05 0.56 -0.25 -0.22 -1.23 0.00 0.00 174.94 173.86 3k0f s LEU 285 N -0.25 2.07 -0.16 2.97 2.96 -0.65 0.25 118.68 125.88 3k0f s LEU 285 Ca 0.01 -0.52 0.02 0.00 -0.22 0.00 0.00 54.13 53.41 3k0f s LEU 285 Cb -0.13 -1.38 0.01 0.00 0.50 0.00 0.00 46.19 45.19 3k0f s LEU 285 CO 0.03 0.22 -0.21 0.00 -1.32 0.00 0.00 176.35 175.08 3k0f s ALA 286 N -0.03 2.30 0.09 5.97 0.00 0.80 -1.36 121.76 129.53 3k0f s ALA 286 Ca -0.08 -1.13 0.09 0.00 0.00 0.00 0.00 51.96 50.85 3k0f s ALA 286 Cb -0.15 -1.08 -0.03 0.00 0.00 0.00 0.00 23.12 21.85 3k0f s ALA 286 CO 0.05 -0.14 -0.25 0.95 0.00 0.00 0.00 175.76 176.38 3k0f s THR 287 N 0.97 2.02 0.00 0.00 -4.23 -0.30 0.21 115.64 114.31 3k0f s THR 287 Ca -0.03 -1.52 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 3k0f s THR 287 Cb -0.15 -1.78 0.00 0.00 1.34 0.00 0.00 72.50 71.92 3k0f s THR 287 CO -0.05 0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.80 3k0f n GLY 288 N 1.35 1.10 3.79 3.99 0.00 -1.10 0.55 105.19 114.87 3k0f n GLY 288 Ca -0.18 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 44.78 3k0f n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k0f s ALA 289 N -2.00 2.47 -0.19 4.61 0.00 -1.25 -1.58 121.76 123.82 3k0f s ALA 289 Ca 0.00 0.22 -0.38 0.00 0.00 0.00 0.00 51.96 51.80 3k0f s ALA 289 Cb 0.00 -3.23 -0.14 0.00 0.00 0.00 0.00 23.12 19.74 3k0f s ALA 289 CO 0.00 -1.46 1.79 -2.37 0.00 0.00 0.00 175.76 173.71 3k0f n THR 290 N -3.21 0.40 0.00 0.00 5.66 -1.26 -0.34 114.28 115.53 3k0f n THR 290 Ca 0.08 -0.07 0.00 0.00 -3.05 0.00 0.00 64.05 61.01 3k0f n THR 290 Cb 0.53 -1.47 0.00 0.00 -1.55 0.00 0.00 70.33 67.84 3k0f n THR 290 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3k0f n GLY 291 N 4.23 0.20 0.30 1.09 0.00 -1.26 -4.96 105.19 104.79 3k0f n GLY 291 Ca 0.25 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.42 3k0f n GLY 291 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3k0f h THR 292 N 0.00 0.48 0.00 2.61 1.35 -1.00 -3.46 112.91 112.88 3k0f h THR 292 Ca 0.00 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.76 3k0f h THR 292 Cb 0.00 1.06 0.00 0.00 -1.73 0.00 0.00 68.15 67.48 3k0f h THR 292 CO 0.00 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 175.90 3k0f n GLY 293 N -1.18 1.48 0.13 5.82 0.00 -1.26 -4.93 105.19 105.25 3k0f n GLY 293 Ca -0.03 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.83 3k0f n GLY 293 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k0f h LYS 294 N 0.00 0.34 -0.24 1.61 6.56 -1.93 -2.86 116.57 120.06 3k0f h LYS 294 Ca 0.00 -0.32 0.07 0.00 -1.06 0.00 0.00 60.65 59.34 3k0f h LYS 294 Cb 0.00 0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 31.73 3k0f h LYS 294 CO 0.00 0.99 0.28 1.15 -2.06 0.00 0.00 179.45 179.81 3k0f h THR 295 N -0.19 0.40 0.03 -0.16 2.02 -1.99 0.14 112.91 113.15 3k0f h THR 295 Ca -0.04 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.06 3k0f h THR 295 Cb 1.11 0.77 0.01 0.00 -1.74 0.00 0.00 68.15 68.30 3k0f h THR 295 CO 0.08 0.00 -0.32 0.25 0.37 0.00 0.00 175.52 175.90 3k0f h LEU 296 N 0.00 0.23 -1.92 2.58 5.85 -1.96 -2.08 115.31 118.01 3k0f h LEU 296 Ca 0.11 -0.87 0.10 0.00 0.84 0.00 0.00 57.88 58.06 3k0f h LEU 296 Cb 0.67 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 3k0f h LEU 296 CO -0.00 1.08 0.28 -0.07 -0.34 0.00 0.00 178.44 179.38 3k0f h LEU 297 N -0.58 0.08 0.73 2.25 3.38 -0.61 -0.94 115.31 119.62 3k0f h LEU 297 Ca -0.05 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 3k0f h LEU 297 Cb 1.15 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 41.89 3k0f h LEU 297 CO 0.06 0.05 -0.35 0.58 0.09 0.00 0.00 178.44 178.87 3k0f h VAL 298 N 0.09 0.01 -0.69 1.22 2.07 -0.84 -2.10 116.25 116.01 3k0f h VAL 298 Ca 0.18 -0.28 0.12 0.00 0.82 0.00 0.00 66.70 67.55 3k0f h VAL 298 Cb 0.62 0.02 -0.13 0.00 -1.52 0.00 0.00 31.29 30.28 3k0f h VAL 298 CO -0.02 0.00 -0.32 0.28 0.02 0.00 0.00 177.57 177.53 3k0f h SER 299 N -1.26 -1.14 0.01 0.57 0.02 -0.58 0.33 113.55 111.50 3k0f h SER 299 Ca -0.10 0.24 -0.03 0.00 -0.84 0.00 0.00 61.79 61.06 3k0f h SER 299 Cb 0.76 0.59 -0.01 0.00 0.14 0.00 0.00 62.40 63.88 3k0f h SER 299 CO 0.17 -0.29 -0.08 -0.09 -1.14 0.00 0.00 176.83 175.39 3k0f h ARG 300 N -0.11 0.19 -0.00 3.45 9.65 -1.26 0.35 114.38 126.65 3k0f h ARG 300 Ca 0.27 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 59.12 3k0f h ARG 300 Cb 0.56 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.11 3k0f h ARG 300 CO -0.75 0.28 -0.00 0.35 2.80 0.00 0.00 179.97 182.65 3k0f h PHE 301 N 0.18 0.01 -0.63 2.20 3.57 0.25 -1.73 116.94 120.79 3k0f h PHE 301 Ca 0.04 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 3k0f h PHE 301 Cb 0.26 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.97 3k0f h PHE 301 CO 0.00 0.48 0.27 0.28 -2.23 0.00 0.00 178.31 177.12 3k0f h VAL 302 N -0.46 1.23 0.03 1.41 2.07 -0.57 -3.08 116.25 116.88 3k0f h VAL 302 Ca 0.00 -0.70 0.03 0.00 0.82 0.00 0.00 66.70 66.85 3k0f h VAL 302 Cb 0.48 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.72 3k0f h VAL 302 CO 0.00 0.28 -0.25 -0.08 0.02 0.00 0.00 177.57 177.54 3k0f h GLU 303 N 0.88 -0.40 -0.26 1.57 4.81 -0.23 -2.02 114.58 118.93 3k0f h GLU 303 Ca 0.21 0.03 0.08 0.00 -0.13 0.00 0.00 59.36 59.55 3k0f h GLU 303 Cb 0.18 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.64 3k0f h GLU 303 CO -0.02 -0.27 0.30 -0.97 -0.73 0.00 0.00 179.01 177.33 3k0f h ASN 304 N -0.41 0.00 0.33 1.04 -0.73 -1.23 -1.19 115.58 113.39 3k0f h ASN 304 Ca 0.05 0.00 -0.02 0.00 1.87 0.00 0.00 56.30 58.21 3k0f h ASN 304 Cb 0.48 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.07 3k0f h ASN 304 CO -0.20 0.00 -0.16 0.00 -0.37 0.00 0.00 177.43 176.70 3k0f h ALA 305 N 1.65 -0.79 -1.03 1.57 0.00 -1.33 -3.04 119.26 116.28 3k0f h ALA 305 Ca 0.13 -0.10 0.33 0.00 0.00 0.00 0.00 54.91 55.27 3k0f h ALA 305 Cb 0.73 0.17 -0.15 0.00 0.00 0.00 0.00 17.79 18.54 3k0f h ALA 305 CO -0.00 -0.76 0.60 0.00 0.00 0.00 0.00 179.25 179.09 3k0f n ALA 307 N -2.32 1.40 0.14 0.00 0.00 -0.52 -0.84 120.51 118.38 3k0f n ALA 307 Ca 0.32 0.13 0.06 0.00 0.00 0.00 0.00 53.44 53.96 3k0f n ALA 307 Cb 1.03 -1.35 0.12 0.00 0.00 0.00 0.00 19.45 19.24 3k0f n ALA 307 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3k0f n ASN 308 N -2.24 2.61 -2.28 0.00 3.02 0.21 -4.97 115.26 111.61 3k0f n ASN 308 Ca 0.01 -1.78 -0.11 0.00 -0.03 0.00 0.00 54.58 52.66 3k0f n ASN 308 Cb 0.15 -0.14 0.05 0.00 -0.61 0.00 0.00 39.78 39.22 3k0f n ASN 308 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3k0f n LYS 309 N 0.70 -3.97 -4.38 3.52 5.02 -0.02 -5.06 118.16 113.98 3k0f n LYS 309 Ca 0.11 0.46 -0.26 0.00 -2.02 0.00 0.00 58.31 56.60 3k0f n LYS 309 Cb 0.39 -4.36 -0.12 0.00 -0.02 0.00 0.00 35.03 30.93 3k0f n LYS 309 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 3k0f s GLU 310 N -5.16 1.39 0.35 1.97 2.02 -1.08 -5.00 118.70 113.19 3k0f s GLU 310 Ca 0.14 -1.41 -0.07 0.00 0.02 0.00 0.00 54.97 53.64 3k0f s GLU 310 Cb -0.06 -1.69 -0.05 0.00 0.10 0.00 0.00 34.13 32.43 3k0f s GLU 310 CO 0.40 0.37 0.66 1.03 0.02 0.00 0.00 175.26 177.74 3k0f s ARG 311 N -2.46 3.68 -0.16 1.61 0.52 -1.26 -3.20 118.95 117.68 3k0f s ARG 311 Ca 0.16 0.19 -0.21 0.00 -0.52 0.00 0.00 55.73 55.35 3k0f s ARG 311 Cb -0.08 -2.52 0.05 0.00 0.52 0.00 0.00 34.95 32.92 3k0f s ARG 311 CO 0.08 0.08 0.56 0.00 0.02 0.00 0.00 175.30 176.03 3k0f s ALA 312 N -2.26 -1.40 -0.05 2.13 0.00 -0.57 -1.16 121.76 118.45 3k0f s ALA 312 Ca 0.47 1.41 0.02 0.00 0.00 0.00 0.00 51.96 53.86 3k0f s ALA 312 Cb -0.10 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.33 3k0f s ALA 312 CO 0.32 -0.29 -0.09 0.42 0.00 0.00 0.00 175.76 176.12 3k0f s ILE 313 N -0.15 3.47 -0.21 0.00 1.01 -0.87 -1.98 121.20 122.47 3k0f s ILE 313 Ca -0.04 -0.62 0.02 0.00 0.00 0.00 0.00 60.65 60.01 3k0f s ILE 313 Cb -0.03 -2.42 0.04 0.00 0.01 0.00 0.00 42.46 40.06 3k0f s ILE 313 CO 0.03 0.56 -0.14 -0.22 0.00 0.00 0.00 174.94 175.16 3k0f s LEU 314 N -0.89 2.54 -0.30 2.97 2.96 0.16 -2.32 118.68 123.80 3k0f s LEU 314 Ca 0.13 -0.93 -0.11 0.00 -0.22 0.00 0.00 54.13 53.00 3k0f s LEU 314 Cb -0.11 -1.42 -0.03 0.00 0.50 0.00 0.00 46.19 45.13 3k0f s LEU 314 CO 0.02 -0.10 0.19 -0.36 -1.32 0.00 0.00 176.35 174.78 3k0f s PHE 315 N 1.27 3.20 0.06 5.38 0.40 -0.37 -1.44 117.98 126.49 3k0f s PHE 315 Ca -0.01 -0.10 0.05 0.00 -0.60 0.00 0.00 56.93 56.28 3k0f s PHE 315 Cb -0.16 -2.39 -0.04 0.00 0.51 0.00 0.00 43.02 40.94 3k0f s PHE 315 CO -0.09 -0.27 -0.08 0.00 0.70 0.00 0.00 175.22 175.48 3k0f s ALA 316 N 1.72 2.99 0.00 5.36 0.00 -1.26 -0.84 121.76 129.73 3k0f s ALA 316 Ca 0.06 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.88 3k0f s ALA 316 Cb -0.16 -1.01 0.00 0.00 0.00 0.00 0.00 23.12 21.95 3k0f s ALA 316 CO 0.10 0.63 0.30 0.66 0.00 0.00 0.00 175.76 177.45 3k0f n TYR 317 N 1.08 0.00 -0.01 0.00 4.02 -1.22 -2.00 117.16 119.03 3k0f n TYR 317 Ca -0.14 -0.04 -0.02 0.00 -0.01 0.00 0.00 57.90 57.69 3k0f n TYR 317 Cb 0.52 -0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.83 3k0f n TYR 317 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 3k0f n GLU 318 N -0.04 0.05 -4.05 -0.72 1.02 -1.26 -4.48 120.64 111.16 3k0f n GLU 318 Ca 0.00 0.01 -0.25 0.00 -0.02 0.00 0.00 57.16 56.91 3k0f n GLU 318 Cb 0.21 -0.92 -0.04 0.00 -0.02 0.00 0.00 31.44 30.67 3k0f n GLU 318 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 3k0f s GLU 319 N -2.04 3.08 0.52 3.49 2.02 -1.26 -5.11 118.70 119.40 3k0f s GLU 319 Ca -0.03 -0.84 -0.02 0.00 0.02 0.00 0.00 54.97 54.10 3k0f s GLU 319 Cb 0.01 -2.72 0.01 0.00 0.10 0.00 0.00 34.13 31.53 3k0f s GLU 319 CO 0.05 0.47 0.78 -1.54 0.02 0.00 0.00 175.26 175.03 3k0f s SER 320 N -3.41 5.59 0.48 -0.19 1.04 -1.26 -4.85 113.70 111.10 3k0f s SER 320 Ca 0.32 0.35 0.13 0.00 0.48 0.00 0.00 55.95 57.24 3k0f s SER 320 Cb -0.10 -1.42 1.12 0.00 0.10 0.00 0.00 66.02 65.73 3k0f s SER 320 CO 0.25 -0.95 2.10 0.08 0.98 0.00 0.00 173.24 175.71 3k0f h ARG 321 N 0.11 0.14 0.04 4.02 0.11 -1.97 0.89 114.38 117.73 3k0f h ARG 321 Ca -0.45 -0.01 -0.00 0.00 0.10 0.00 0.00 59.98 59.62 3k0f h ARG 321 Cb 1.27 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 32.32 3k0f h ARG 321 CO 0.57 0.12 -0.02 0.00 0.10 0.00 0.00 179.97 180.75 3k0f h ALA 322 N 1.90 -0.63 -0.89 0.08 0.00 -1.99 -2.73 119.26 115.00 3k0f h ALA 322 Ca 0.04 -0.01 0.24 0.00 0.00 0.00 0.00 54.91 55.18 3k0f h ALA 322 Cb 0.03 0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.69 3k0f h ALA 322 CO -0.00 -0.63 0.18 0.37 0.00 0.00 0.00 179.25 179.17 3k0f h GLN 323 N -0.08 0.14 -0.58 0.00 4.15 -1.91 0.80 115.11 117.64 3k0f h GLN 323 Ca -0.01 -0.01 0.05 0.00 0.77 0.00 0.00 58.65 59.46 3k0f h GLN 323 Cb 0.04 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.66 3k0f h GLN 323 CO 0.01 0.10 0.39 -0.07 -1.93 0.00 0.00 178.83 177.32 3k0f h LEU 324 N 0.15 0.51 -0.14 -2.39 3.38 -0.89 -0.51 115.31 115.42 3k0f h LEU 324 Ca 0.56 -0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.29 3k0f h LEU 324 Cb 1.13 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 41.78 3k0f h LEU 324 CO -0.71 0.34 -0.90 -0.07 0.09 0.00 0.00 178.44 177.18 3k0f h LEU 325 N 0.58 0.78 0.30 1.67 3.38 0.91 -1.57 115.31 121.35 3k0f h LEU 325 Ca 0.25 -0.57 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 3k0f h LEU 325 Cb 0.24 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3k0f h LEU 325 CO -0.07 1.37 -0.14 -0.09 0.09 0.00 0.00 178.44 179.59 3k0f h ARG 326 N 0.39 -0.38 -0.12 1.13 2.43 -0.28 -1.90 114.38 115.64 3k0f h ARG 326 Ca -0.08 0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.01 3k0f h ARG 326 Cb 1.53 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 31.16 3k0f h ARG 326 CO 0.17 -0.12 -0.37 -0.91 -1.51 0.00 0.00 179.97 177.24 3k0f h ASN 327 N -0.62 0.25 0.18 -3.80 2.35 -1.23 -2.54 115.58 110.17 3k0f h ASN 327 Ca -0.04 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.60 3k0f h ASN 327 Cb 0.44 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.75 3k0f h ASN 327 CO 0.07 0.60 -0.09 0.00 -1.65 0.00 0.00 177.43 176.36 3k0f h ALA 328 N 1.41 -0.24 -0.86 -0.83 0.00 -1.25 -3.00 119.26 114.49 3k0f h ALA 328 Ca 0.02 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 54.86 3k0f h ALA 328 Cb 0.75 0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.58 3k0f h ALA 328 CO 0.06 -0.55 0.54 -0.92 0.00 0.00 0.00 179.25 178.38 3k0f h TYR 329 N -0.43 1.00 0.00 0.00 3.20 -1.29 -1.27 116.97 118.18 3k0f h TYR 329 Ca -0.03 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.87 3k0f h TYR 329 Cb 0.33 -0.33 0.00 0.00 1.54 0.00 0.00 36.73 38.27 3k0f h TYR 329 CO -0.01 0.53 0.00 0.43 -1.64 0.00 0.00 178.16 177.47 3k0f n SER 330 N -4.60 0.00 -0.69 -2.11 7.64 -0.96 0.47 113.62 113.38 3k0f n SER 330 Ca 0.12 0.33 0.07 0.00 1.01 0.00 0.00 58.87 60.40 3k0f n SER 330 Cb 0.15 -0.38 0.19 0.00 -1.01 0.00 0.00 64.21 63.16 3k0f n SER 330 CO 0.00 0.00 0.00 0.79 -3.01 0.00 0.00 175.04 172.82 3k0f n TRP 331 N -1.38 0.62 -1.54 1.43 8.01 -0.48 -4.30 117.44 119.80 3k0f n TRP 331 Ca 0.02 -0.68 0.00 0.00 -1.31 0.00 0.00 57.50 55.53 3k0f n TRP 331 Cb 0.05 -0.16 0.00 0.00 -2.01 0.00 0.00 31.31 29.19 3k0f n TRP 331 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 3k0f n GLY 332 N -0.06 0.80 0.82 6.99 0.00 0.18 -4.13 105.19 109.79 3k0f n GLY 332 Ca 0.15 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.82 3k0f n GLY 332 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3k0f n MET 333 N 4.73 0.00 -3.41 1.61 0.00 -1.26 -3.35 117.12 115.44 3k0f n MET 333 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 57.70 57.31 3k0f n MET 333 Cb 0.00 -0.26 -0.09 0.00 0.00 0.00 0.00 33.22 32.87 3k0f n MET 333 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 3k0f s ASP 334 N 0.00 6.21 0.17 3.17 -1.08 -1.26 -3.35 116.67 120.53 3k0f s ASP 334 Ca 0.00 0.11 0.11 0.00 -0.52 0.00 0.00 52.55 52.26 3k0f s ASP 334 Cb 0.00 -2.20 -0.09 0.00 -1.46 0.00 0.00 42.92 39.17 3k0f s ASP 334 CO 0.00 -0.22 1.28 -0.26 0.52 0.00 0.00 175.17 176.49 3k0f h PHE 335 N 8.28 0.00 -0.56 -5.34 0.05 -1.90 -3.25 116.94 114.22 3k0f h PHE 335 Ca -0.31 0.00 0.07 0.00 3.82 0.00 0.00 57.97 61.55 3k0f h PHE 335 Cb 1.16 0.00 -0.06 0.00 2.00 0.00 0.00 35.95 39.05 3k0f h PHE 335 CO 0.74 0.75 0.23 0.93 -0.18 0.00 0.00 178.31 180.79 3k0f h GLU 336 N 0.00 0.43 -0.19 1.51 4.39 -1.94 -1.19 114.58 117.58 3k0f h GLU 336 Ca -0.03 -0.03 -0.17 0.00 0.34 0.00 0.00 59.36 59.47 3k0f h GLU 336 Cb 1.60 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 30.16 3k0f h GLU 336 CO 0.09 0.28 -0.59 1.49 -1.16 0.00 0.00 179.01 179.12 3k0f h GLU 337 N 0.44 0.63 0.24 2.33 4.57 -2.00 -2.56 114.58 118.23 3k0f h GLU 337 Ca 0.27 -0.42 0.01 0.00 -1.18 0.00 0.00 59.36 58.04 3k0f h GLU 337 Cb 0.27 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.88 3k0f h GLU 337 CO -0.24 1.03 -0.50 0.52 -1.18 0.00 0.00 179.01 178.64 3k0f h MET 338 N 0.47 -0.79 -0.11 1.92 2.86 -1.44 -0.58 114.93 117.25 3k0f h MET 338 Ca -0.00 0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.72 3k0f h MET 338 Cb 1.16 0.18 -0.05 0.00 0.06 0.00 0.00 31.60 32.95 3k0f h MET 338 CO 0.12 -0.53 -0.38 0.93 1.06 0.00 0.00 176.91 178.11 3k0f h GLU 339 N -0.82 -0.37 -0.57 1.72 5.08 -1.20 -2.62 114.58 115.80 3k0f h GLU 339 Ca -0.02 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.48 3k0f h GLU 339 Cb 0.78 0.08 -0.11 0.00 0.50 0.00 0.00 28.75 30.01 3k0f h GLU 339 CO -0.21 -0.25 -0.25 0.00 -1.00 0.00 0.00 179.01 177.30 3k0f h ARG 340 N -0.39 -0.10 0.00 2.33 3.08 -1.29 0.13 114.38 118.14 3k0f h ARG 340 Ca 0.02 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.08 3k0f h ARG 340 Cb 0.46 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.54 3k0f h ARG 340 CO -0.31 -0.07 0.02 1.04 -1.07 0.00 0.00 179.97 179.58 3k0f n GLN 341 N -5.43 0.00 -3.49 0.04 6.02 -0.24 -4.80 117.38 109.47 3k0f n GLN 341 Ca 0.05 0.19 -0.19 0.00 -0.01 0.00 0.00 57.00 57.03 3k0f n GLN 341 Cb 0.34 -1.52 0.09 0.00 1.02 0.00 0.00 30.24 30.17 3k0f n GLN 341 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3k0f n ASN 342 N -1.16 -3.46 0.00 1.08 4.13 0.45 -4.90 115.26 111.40 3k0f n ASN 342 Ca 0.00 -0.60 0.00 0.00 1.68 0.00 0.00 54.58 55.66 3k0f n ASN 342 Cb 0.02 -5.07 0.00 0.00 -1.54 0.00 0.00 39.78 33.19 3k0f n ASN 342 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 3k0f n LEU 343 N -4.43 0.68 -4.44 3.41 4.77 -1.17 -4.92 117.00 110.89 3k0f n LEU 343 Ca -0.19 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.46 3k0f n LEU 343 Cb 0.63 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.59 3k0f n LEU 343 CO 0.63 0.11 -0.43 -0.22 -1.33 0.00 0.00 177.39 176.15 3k0f s LEU 344 N -3.60 2.84 -0.10 2.23 1.98 -1.22 -1.51 118.68 119.29 3k0f s LEU 344 Ca 0.00 -0.23 0.01 0.00 -2.89 0.00 0.00 54.13 51.02 3k0f s LEU 344 Cb 0.00 -1.62 0.02 0.00 0.66 0.00 0.00 46.19 45.24 3k0f s LEU 344 CO 0.00 0.24 -0.12 -0.75 -1.89 0.00 0.00 176.35 173.83 3k0f s LYS 345 N -0.11 1.88 -0.05 1.98 2.20 -0.84 -4.11 119.74 120.69 3k0f s LYS 345 Ca -0.01 -0.43 -0.01 0.00 -0.36 0.00 0.00 55.97 55.16 3k0f s LYS 345 Cb -0.14 -1.69 -0.03 0.00 -1.51 0.00 0.00 37.83 34.46 3k0f s LYS 345 CO 0.03 -0.12 0.02 0.42 -0.36 0.00 0.00 175.35 175.35 3k0f s ILE 346 N 1.16 4.40 0.00 5.43 1.01 -1.26 -0.66 121.20 131.27 3k0f s ILE 346 Ca -0.04 -0.34 0.00 0.00 0.00 0.00 0.00 60.65 60.27 3k0f s ILE 346 Cb -0.14 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.42 3k0f s ILE 346 CO -0.03 0.51 0.00 0.52 0.00 0.00 0.00 174.94 175.94 3k0f n VAL 347 N 1.80 0.00 -0.29 2.92 0.31 -0.52 -4.95 118.33 117.60 3k0f n VAL 347 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 3k0f n VAL 347 Cb 0.53 -0.34 0.00 0.00 -0.91 0.00 0.00 33.84 33.12 3k0f n VAL 347 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3k0f s ALA 349 N -0.11 -2.28 0.36 0.00 0.00 -0.85 -4.95 121.76 113.92 3k0f s ALA 349 Ca 0.00 1.96 -0.28 0.00 0.00 0.00 0.00 51.96 53.64 3k0f s ALA 349 Cb 0.00 -1.73 -0.12 0.00 0.00 0.00 0.00 23.12 21.28 3k0f s ALA 349 CO 0.00 -0.26 1.29 0.66 0.00 0.00 0.00 175.76 177.45 3k0f n TYR 350 N 2.73 2.27 -0.32 0.00 4.02 -1.26 -4.53 117.16 120.06 3k0f n TYR 350 Ca -0.15 0.54 0.00 0.00 -0.01 0.00 0.00 57.90 58.28 3k0f n TYR 350 Cb 0.57 -2.41 0.14 0.00 -0.02 0.00 0.00 39.34 37.61 3k0f n TYR 350 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 3k0f h PRO 351 N 2.47 1.01 0.00 -0.72 0.11 -1.91 -1.43 132.00 131.53 3k0f h PRO 351 Ca -0.47 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.58 3k0f h PRO 351 Cb 1.28 -0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3k0f h PRO 351 CO 0.62 0.67 0.08 0.93 -0.21 0.00 0.00 178.00 180.09 3k0f h GLU 352 N 1.04 0.00 0.00 1.05 3.07 -1.93 -2.94 114.58 114.87 3k0f h GLU 352 Ca 0.37 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.23 3k0f h GLU 352 Cb 0.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.02 3k0f h GLU 352 CO -0.15 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.33 3k0f n SER 353 N -2.39 0.00 -0.35 1.42 3.41 -0.54 -4.89 113.62 110.28 3k0f n SER 353 Ca -0.02 -0.82 0.00 0.00 -0.26 0.00 0.00 58.87 57.78 3k0f n SER 353 Cb 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.07 3k0f n SER 353 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k0f n ALA 354 N -0.92 0.00 -2.46 7.33 0.00 -1.11 -5.05 120.51 118.29 3k0f n ALA 354 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.33 3k0f n ALA 354 Cb 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.41 3k0f n ALA 354 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3k0f s GLY 355 N -0.57 1.78 0.55 0.00 0.00 -1.26 -4.99 107.32 102.83 3k0f s GLY 355 Ca 0.00 -1.72 0.25 0.00 0.00 0.00 0.00 44.72 43.25 3k0f s GLY 355 CO 0.00 -1.77 2.09 1.41 0.00 0.00 0.00 173.10 174.82 3k0f h LEU 356 N 2.76 0.00 -0.30 0.66 4.07 -1.97 0.17 115.31 120.70 3k0f h LEU 356 Ca -0.44 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.43 3k0f h LEU 356 Cb 1.23 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.96 3k0f h LEU 356 CO 0.54 0.00 -0.17 1.05 -1.08 0.00 0.00 178.44 178.77 3k0f h GLU 357 N 0.00 0.65 0.41 1.13 4.11 -1.97 -2.73 114.58 116.18 3k0f h GLU 357 Ca 0.11 -0.30 -0.02 0.00 0.07 0.00 0.00 59.36 59.23 3k0f h GLU 357 Cb 0.51 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.76 3k0f h GLU 357 CO -0.00 0.89 -0.20 -0.44 0.07 0.00 0.00 179.01 179.33 3k0f h ASP 358 N 0.40 -0.47 -0.74 3.06 3.32 -1.15 -2.41 116.42 118.43 3k0f h ASP 358 Ca 0.06 -0.04 0.13 0.00 0.02 0.00 0.00 57.03 57.20 3k0f h ASP 358 Cb 0.71 0.12 -0.09 0.00 0.22 0.00 0.00 39.33 40.29 3k0f h ASP 358 CO 0.05 -0.25 0.31 0.45 -1.72 0.00 0.00 179.24 178.08 3k0f h HIS 359 N -0.67 0.53 -0.52 4.55 3.86 -1.01 0.61 115.15 122.50 3k0f h HIS 359 Ca -0.06 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 3k0f h HIS 359 Cb 0.49 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.81 3k0f h HIS 359 CO -0.02 0.10 0.34 1.25 0.86 0.00 0.00 177.93 180.45 3k0f h LEU 360 N 0.47 0.60 -0.41 2.43 6.46 -1.43 0.16 115.31 123.60 3k0f h LEU 360 Ca 0.40 -0.03 -0.13 0.00 -0.12 0.00 0.00 57.88 58.00 3k0f h LEU 360 Cb 0.57 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.34 3k0f h LEU 360 CO -0.37 0.45 -0.26 -0.61 -0.62 0.00 0.00 178.44 177.03 3k0f h GLN 361 N 0.70 0.89 -0.39 1.25 4.15 -0.71 -0.17 115.11 120.84 3k0f h GLN 361 Ca 0.19 -0.42 0.03 0.00 0.77 0.00 0.00 58.65 59.22 3k0f h GLN 361 Cb -0.07 -0.01 -0.03 0.00 0.21 0.00 0.00 27.48 27.58 3k0f h GLN 361 CO -0.04 1.07 0.20 0.82 -1.93 0.00 0.00 178.83 178.95 3k0f h ILE 362 N 0.71 0.98 0.10 2.39 1.08 0.57 0.86 117.51 124.20 3k0f h ILE 362 Ca 0.08 -0.14 -0.00 0.00 -0.39 0.00 0.00 64.86 64.41 3k0f h ILE 362 Cb 0.83 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 35.13 3k0f h ILE 362 CO 0.07 0.07 -0.05 0.40 -0.69 0.00 0.00 178.15 177.96 3k0f h ILE 363 N 0.41 0.92 -0.81 -0.67 2.04 -0.49 -2.19 117.51 116.72 3k0f h ILE 363 Ca 0.17 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 65.98 3k0f h ILE 363 Cb 0.07 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 3k0f h ILE 363 CO -0.11 0.02 0.53 0.11 0.00 0.00 0.00 178.15 178.70 3k0f h LYS 364 N -0.16 1.03 0.40 2.37 1.57 -0.69 -1.72 116.57 119.37 3k0f h LYS 364 Ca -0.01 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 3k0f h LYS 364 Cb 0.13 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3k0f h LYS 364 CO 0.02 0.68 -0.19 1.03 -0.57 0.00 0.00 179.45 180.42 3k0f h SER 365 N 1.07 -0.46 -0.77 0.86 0.87 -0.72 -1.95 113.55 112.45 3k0f h SER 365 Ca 0.31 -0.01 0.08 0.00 -1.23 0.00 0.00 61.79 60.93 3k0f h SER 365 Cb -0.07 0.12 -0.05 0.00 -0.44 0.00 0.00 62.40 61.96 3k0f h SER 365 CO -0.08 -0.29 0.50 -0.08 -0.53 0.00 0.00 176.83 176.34 3k0f h GLU 366 N -0.59 0.75 0.00 2.24 4.57 -1.30 0.36 114.58 120.60 3k0f h GLU 366 Ca -0.06 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.06 3k0f h GLU 366 Cb 0.44 -0.17 -0.00 0.00 -0.16 0.00 0.00 28.75 28.86 3k0f h GLU 366 CO 0.09 0.50 -0.10 0.82 -1.18 0.00 0.00 179.01 179.14 3k0f h ILE 367 N 0.77 0.34 0.04 2.32 2.04 -1.02 -1.91 117.51 120.09 3k0f h ILE 367 Ca 0.34 -0.62 -0.28 0.00 1.00 0.00 0.00 64.86 65.30 3k0f h ILE 367 Cb 0.32 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 3k0f h ILE 367 CO -0.12 0.10 -1.50 0.78 0.00 0.00 0.00 178.15 177.41 3k0f h ASN 368 N 0.00 0.13 0.21 1.72 2.35 0.45 -2.77 115.58 117.67 3k0f h ASN 368 Ca -0.00 -0.21 -0.34 0.00 -0.55 0.00 0.00 56.30 55.20 3k0f h ASN 368 Cb 0.45 -0.04 0.02 0.00 0.05 0.00 0.00 38.32 38.80 3k0f h ASN 368 CO 0.01 1.18 -1.62 0.44 -1.65 0.00 0.00 177.43 175.79 3k0f h ASP 369 N 0.02 0.69 0.95 5.81 3.32 -1.15 -3.37 116.42 122.68 3k0f h ASP 369 Ca -0.21 -0.93 0.00 0.00 0.02 0.00 0.00 57.03 55.91 3k0f h ASP 369 Cb 1.95 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 41.28 3k0f h ASP 369 CO 0.11 1.75 -0.83 0.15 -1.72 0.00 0.00 179.24 178.70 3k0f h PHE 370 N 0.09 0.00 -6.34 4.55 3.57 -1.53 -3.49 116.94 113.79 3k0f h PHE 370 Ca -0.31 0.00 -0.46 0.00 3.53 0.00 0.00 57.97 60.73 3k0f h PHE 370 Cb 2.10 0.00 0.04 0.00 2.79 0.00 0.00 35.95 40.88 3k0f h PHE 370 CO 0.12 0.00 -0.92 0.36 -2.23 0.00 0.00 178.31 175.63 3k0f n LYS 371 N -2.44 -2.01 -0.85 1.11 -0.00 -1.05 -4.96 118.16 107.97 3k0f n LYS 371 Ca 0.01 0.43 -0.33 0.00 -0.00 0.00 0.00 58.31 58.42 3k0f n LYS 371 Cb 0.50 -4.22 0.12 0.00 -0.00 0.00 0.00 35.03 31.43 3k0f n LYS 371 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.40 175.10 3k0f n PRO 372 N -4.30 -0.22 -0.00 -1.58 -0.02 -1.26 -4.84 135.00 122.78 3k0f n PRO 372 Ca -0.17 -0.02 0.01 0.00 -2.02 0.00 0.00 63.50 61.30 3k0f n PRO 372 Cb 0.62 -1.90 -0.02 0.00 -0.02 0.00 0.00 33.50 32.18 3k0f n PRO 372 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k0f n ALA 373 N -3.49 2.18 -2.96 3.55 0.00 -0.31 -4.91 120.51 114.58 3k0f n ALA 373 Ca 0.08 -0.07 -0.11 0.00 0.00 0.00 0.00 53.44 53.34 3k0f n ALA 373 Cb 0.53 -0.09 -0.08 0.00 0.00 0.00 0.00 19.45 19.80 3k0f n ALA 373 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3k0f s ARG 374 N -1.87 0.71 -0.08 0.00 0.52 -1.14 -3.47 118.95 113.63 3k0f s ARG 374 Ca -0.00 -0.53 -0.21 0.00 -0.52 0.00 0.00 55.73 54.46 3k0f s ARG 374 Cb 0.02 0.30 0.05 0.00 0.52 0.00 0.00 34.95 35.84 3k0f s ARG 374 CO 0.11 -0.21 0.49 -1.50 0.02 0.00 0.00 175.30 174.21 3k0f s ILE 375 N -2.36 0.02 -0.03 1.52 2.07 -0.62 -2.06 121.20 119.74 3k0f s ILE 375 Ca -0.06 -0.19 -0.01 0.00 -1.41 0.00 0.00 60.65 58.98 3k0f s ILE 375 Cb -0.02 -0.77 0.02 0.00 0.13 0.00 0.00 42.46 41.83 3k0f s ILE 375 CO -0.03 -0.10 0.06 0.00 -1.91 0.00 0.00 174.94 172.96 3k0f s ALA 376 N -0.82 -0.06 -0.53 1.50 0.00 -0.98 -1.11 121.76 119.76 3k0f s ALA 376 Ca -0.09 0.34 -0.04 0.00 0.00 0.00 0.00 51.96 52.17 3k0f s ALA 376 Cb -0.03 -0.25 0.14 0.00 0.00 0.00 0.00 23.12 22.98 3k0f s ALA 376 CO 0.05 -0.09 0.36 0.42 0.00 0.00 0.00 175.76 176.49 3k0f s ILE 377 N 0.78 3.73 -0.36 0.00 1.01 -0.82 -1.23 121.20 124.31 3k0f s ILE 377 Ca -0.06 -2.43 -0.29 0.00 0.00 0.00 0.00 60.65 57.87 3k0f s ILE 377 Cb -0.09 -3.47 -0.01 0.00 0.01 0.00 0.00 42.46 38.90 3k0f s ILE 377 CO -0.03 -0.80 1.66 -0.62 0.00 0.00 0.00 174.94 175.15 3k0f s ASP 378 N 1.48 6.05 0.00 3.58 -1.08 -0.02 -2.85 116.67 123.83 3k0f s ASP 378 Ca 0.12 1.13 0.00 0.00 -0.52 0.00 0.00 52.55 53.28 3k0f s ASP 378 Cb -0.22 -2.53 0.00 0.00 -1.46 0.00 0.00 42.92 38.71 3k0f s ASP 378 CO -0.04 -1.61 0.00 -0.24 0.52 0.00 0.00 175.17 173.80 3k0f n SER 379 N 9.76 -1.60 0.07 -0.34 2.88 -1.23 -3.41 113.62 119.75 3k0f n SER 379 Ca 0.21 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 3k0f n SER 379 Cb 0.47 -0.80 0.32 0.00 -0.75 0.00 0.00 64.21 63.45 3k0f n SER 379 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 3k0f h LEU 380 N 0.00 0.32 -2.80 2.46 3.38 0.20 0.66 115.31 119.53 3k0f h LEU 380 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3k0f h LEU 380 Cb 0.19 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3k0f h LEU 380 CO 0.00 0.51 0.01 0.77 0.09 0.00 0.00 178.44 179.82 3k0f h SER 381 N 0.31 0.00 0.24 -0.43 4.64 -1.92 -1.90 113.55 114.49 3k0f h SER 381 Ca 0.06 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 3k0f h SER 381 Cb 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3k0f h SER 381 CO 0.03 0.00 -0.11 0.00 -0.87 0.00 0.00 176.83 175.88 3k0f h ALA 382 N 1.98 -0.32 -0.21 5.18 0.00 -1.20 -3.13 119.26 121.56 3k0f h ALA 382 Ca 0.00 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.79 3k0f h ALA 382 Cb 0.03 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3k0f h ALA 382 CO -0.00 -0.35 0.30 -0.07 0.00 0.00 0.00 179.25 179.12 3k0f h LEU 383 N -0.96 0.00 -2.05 0.00 3.38 -1.31 0.16 115.31 114.52 3k0f h LEU 383 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3k0f h LEU 383 Cb 0.47 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 3k0f h LEU 383 CO 0.05 0.00 -0.08 0.00 0.09 0.00 0.00 178.44 178.50 3k0f h ALA 384 N 1.60 1.26 -0.80 1.53 0.00 -1.31 -3.42 119.26 118.12 3k0f h ALA 384 Ca 0.10 -0.08 -0.71 0.00 0.00 0.00 0.00 54.91 54.23 3k0f h ALA 384 Cb 0.70 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 3k0f h ALA 384 CO -0.00 0.10 1.34 0.54 0.00 0.00 0.00 179.25 181.23 3k0f n ARG 385 N -3.56 0.75 0.00 0.00 1.74 0.56 -2.82 116.66 113.33 3k0f n ARG 385 Ca -0.02 0.21 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 3k0f n ARG 385 Cb 0.21 -2.14 0.00 0.00 -1.02 0.00 0.00 32.46 29.51 3k0f n ARG 385 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k0f n GLY 386 N 6.61 2.15 3.79 -0.13 0.00 -1.26 -4.97 105.19 111.37 3k0f n GLY 386 Ca 0.44 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 46.11 3k0f n GLY 386 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k0f s VAL 387 N -0.06 3.53 0.56 1.61 1.01 -1.13 -5.00 120.40 120.93 3k0f s VAL 387 Ca 0.00 0.87 -0.20 0.00 0.00 0.00 0.00 61.98 62.66 3k0f s VAL 387 Cb 0.00 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 3k0f s VAL 387 CO 0.00 -0.29 1.20 -0.94 0.00 0.00 0.00 175.10 175.08 3k0f s SER 388 N -2.17 5.43 0.34 3.32 1.04 -1.26 -4.79 113.70 115.62 3k0f s SER 388 Ca 0.68 2.38 0.07 0.00 0.48 0.00 0.00 55.95 59.56 3k0f s SER 388 Cb -0.19 -2.60 0.76 0.00 0.10 0.00 0.00 66.02 64.09 3k0f s SER 388 CO 0.28 -1.43 1.88 -1.13 0.98 0.00 0.00 173.24 173.82 3k0f h ASN 389 N 1.17 0.70 -0.00 7.02 -0.73 -1.94 0.61 115.58 122.40 3k0f h ASN 389 Ca -0.50 0.03 -0.00 0.00 1.87 0.00 0.00 56.30 57.70 3k0f h ASN 389 Cb 1.29 -0.11 0.00 0.00 0.27 0.00 0.00 38.32 39.77 3k0f h ASN 389 CO 0.56 0.38 -0.00 0.78 -0.37 0.00 0.00 177.43 178.78 3k0f h ASN 390 N 0.75 0.00 -0.76 1.15 2.35 -1.98 -1.76 115.58 115.33 3k0f h ASN 390 Ca 0.43 -0.63 0.16 0.00 -0.55 0.00 0.00 56.30 55.72 3k0f h ASN 390 Cb 0.61 -0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.84 3k0f h ASN 390 CO -0.20 0.63 -0.10 0.00 -1.65 0.00 0.00 177.43 176.12 3k0f h ALA 391 N 0.37 0.65 -0.58 -0.83 0.00 -1.65 0.35 119.26 117.57 3k0f h ALA 391 Ca -0.00 0.27 -0.02 0.00 0.00 0.00 0.00 54.91 55.16 3k0f h ALA 391 Cb 0.63 0.51 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 3k0f h ALA 391 CO 0.00 -0.42 0.26 0.35 0.00 0.00 0.00 179.25 179.44 3k0f h PHE 392 N 0.04 0.85 -0.14 0.00 3.57 -0.91 -2.49 116.94 117.86 3k0f h PHE 392 Ca 0.39 -0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.87 3k0f h PHE 392 Cb 0.66 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.11 3k0f h PHE 392 CO -0.52 0.66 -0.01 -0.09 -2.23 0.00 0.00 178.31 176.12 3k0f h ARG 393 N 0.79 0.03 -0.47 1.11 2.43 0.46 -1.14 114.38 117.59 3k0f h ARG 393 Ca 0.20 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.46 3k0f h ARG 393 Cb 0.14 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.60 3k0f h ARG 393 CO -0.02 0.02 -0.07 0.37 -1.51 0.00 0.00 179.97 178.76 3k0f h GLN 394 N 0.03 0.04 -0.80 0.20 4.15 -0.53 -0.60 115.11 117.60 3k0f h GLN 394 Ca 0.06 -0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.55 3k0f h GLN 394 Cb 0.09 -0.01 -0.06 0.00 0.21 0.00 0.00 27.48 27.70 3k0f h GLN 394 CO -0.12 0.03 0.47 0.35 -1.93 0.00 0.00 178.83 177.63 3k0f h PHE 395 N 0.05 0.86 -0.47 3.99 3.57 -0.93 -1.41 116.94 122.61 3k0f h PHE 395 Ca 0.23 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.66 3k0f h PHE 395 Cb 0.35 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.80 3k0f h PHE 395 CO -0.36 0.41 -0.10 0.28 -2.23 0.00 0.00 178.31 176.31 3k0f h VAL 396 N 0.84 1.26 -0.10 1.41 2.07 0.06 -1.18 116.25 120.61 3k0f h VAL 396 Ca 0.36 -1.19 -0.10 0.00 0.82 0.00 0.00 66.70 66.59 3k0f h VAL 396 Cb 0.23 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.00 3k0f h VAL 396 CO -0.20 0.41 -0.38 0.40 0.02 0.00 0.00 177.57 177.83 3k0f h ILE 397 N 0.77 1.29 0.62 4.57 1.08 -0.75 -0.27 117.51 124.81 3k0f h ILE 397 Ca 0.13 -1.41 -0.03 0.00 -0.39 0.00 0.00 64.86 63.15 3k0f h ILE 397 Cb 0.61 1.64 0.01 0.00 -3.07 0.00 0.00 36.82 36.00 3k0f h ILE 397 CO 0.04 0.42 -0.30 1.23 -0.69 0.00 0.00 178.15 178.86 3k0f h GLY 398 N 1.17 -0.86 1.01 5.37 0.00 -0.57 0.08 103.07 109.26 3k0f h GLY 398 Ca 0.02 0.32 -0.04 0.00 0.00 0.00 0.00 47.33 47.63 3k0f h GLY 398 CO 0.06 -0.31 0.26 -2.08 0.00 0.00 0.00 176.54 174.46 3k0f h VAL 399 N -1.12 1.24 0.39 4.60 2.07 -1.25 -0.27 116.25 121.91 3k0f h VAL 399 Ca -0.08 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 3k0f h VAL 399 Cb 0.68 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 3k0f h VAL 399 CO 0.14 0.29 -0.27 0.74 0.02 0.00 0.00 177.57 178.49 3k0f h THR 400 N 0.90 0.45 -0.06 2.57 2.02 -1.10 -2.21 112.91 115.46 3k0f h THR 400 Ca 0.21 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.39 3k0f h THR 400 Cb 0.21 0.45 -0.00 0.00 -1.74 0.00 0.00 68.15 67.06 3k0f h THR 400 CO -0.02 0.00 0.02 1.23 0.37 0.00 0.00 175.52 177.12 3k0f h GLY 401 N -0.64 0.11 0.41 2.16 0.00 -0.84 -0.10 103.07 104.16 3k0f h GLY 401 Ca -0.04 -0.06 0.10 0.00 0.00 0.00 0.00 47.33 47.33 3k0f h GLY 401 CO 0.02 0.06 0.36 -1.82 0.00 0.00 0.00 176.54 175.17 3k0f h TYR 402 N -0.09 0.65 -0.37 5.60 3.20 -1.08 0.19 116.97 125.07 3k0f h TYR 402 Ca 0.02 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.87 3k0f h TYR 402 Cb 0.21 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.29 3k0f h TYR 402 CO -0.00 0.21 0.03 0.00 -1.64 0.00 0.00 178.16 176.76 3k0f h ALA 403 N 1.46 0.50 -0.74 1.82 0.00 -1.30 -2.55 119.26 118.45 3k0f h ALA 403 Ca 0.37 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 3k0f h ALA 403 Cb 0.43 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 3k0f h ALA 403 CO -0.29 0.24 0.44 0.87 0.00 0.00 0.00 179.25 180.50 3k0f h LYS 404 N 0.47 1.01 -0.00 0.00 1.57 0.61 -1.54 116.57 118.68 3k0f h LYS 404 Ca 0.11 -0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 3k0f h LYS 404 Cb 0.41 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3k0f h LYS 404 CO 0.01 0.72 -0.15 0.00 -0.57 0.00 0.00 179.45 179.46 3k0f n GLN 405 N -4.38 0.58 -0.01 3.15 10.64 0.50 -3.32 117.38 124.54 3k0f n GLN 405 Ca 0.08 -0.22 0.09 0.00 -1.83 0.00 0.00 57.00 55.13 3k0f n GLN 405 Cb 0.07 -1.50 0.09 0.00 -0.86 0.00 0.00 30.24 28.05 3k0f n GLN 405 CO 0.00 0.00 0.00 -1.91 -1.83 0.00 0.00 177.06 173.32 3k0f n GLU 406 N -1.02 1.67 -1.20 2.61 4.07 -0.74 -4.87 120.64 121.15 3k0f n GLU 406 Ca 0.13 -1.66 -0.07 0.00 -0.06 0.00 0.00 57.16 55.50 3k0f n GLU 406 Cb 0.29 -1.37 -0.03 0.00 -0.06 0.00 0.00 31.44 30.28 3k0f n GLU 406 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 3k0f n GLU 407 N 1.07 -0.64 -3.31 5.31 -0.58 -0.91 -5.00 120.64 116.57 3k0f n GLU 407 Ca 0.11 0.68 -0.41 0.00 -0.42 0.00 0.00 57.16 57.13 3k0f n GLU 407 Cb 0.47 -4.49 -0.08 0.00 -0.57 0.00 0.00 31.44 26.77 3k0f n GLU 407 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3k0f s ILE 408 N -2.17 5.09 0.22 -3.67 1.01 -0.66 -4.73 121.20 116.29 3k0f s ILE 408 Ca 0.00 0.30 -0.32 0.00 0.00 0.00 0.00 60.65 60.63 3k0f s ILE 408 Cb 0.00 -3.88 -0.12 0.00 0.01 0.00 0.00 42.46 38.47 3k0f s ILE 408 CO 0.00 -0.11 1.68 0.41 0.00 0.00 0.00 174.94 176.92 3k0f n THR 409 N 5.31 0.21 -3.86 2.92 -1.04 -1.14 -4.55 114.28 112.13 3k0f n THR 409 Ca -0.07 -0.05 -0.28 0.00 -2.04 0.00 0.00 64.05 61.61 3k0f n THR 409 Cb 0.49 -1.92 -0.17 0.00 -1.82 0.00 0.00 70.33 66.92 3k0f n THR 409 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 3k0f s GLY 410 N 1.00 0.88 -0.22 3.41 0.00 -1.07 -1.59 107.32 109.72 3k0f s GLY 410 Ca 0.73 -0.75 -0.18 0.00 0.00 0.00 0.00 44.72 44.52 3k0f s GLY 410 CO 0.36 1.02 0.49 -2.27 0.00 0.00 0.00 173.10 172.70 3k0f s LEU 411 N 1.69 4.11 0.06 0.66 2.96 -0.26 0.89 118.68 128.79 3k0f s LEU 411 Ca 0.01 0.59 0.06 0.00 -0.22 0.00 0.00 54.13 54.57 3k0f s LEU 411 Cb -0.15 -2.65 -0.04 0.00 0.50 0.00 0.00 46.19 43.85 3k0f s LEU 411 CO -0.07 -0.20 -0.11 -0.36 -1.32 0.00 0.00 176.35 174.29 3k0f s PHE 412 N 1.81 2.75 -0.00 5.38 0.40 0.70 -1.95 117.98 127.07 3k0f s PHE 412 Ca 0.22 -0.14 0.05 0.00 -0.60 0.00 0.00 56.93 56.46 3k0f s PHE 412 Cb -0.15 -1.49 -0.03 0.00 0.51 0.00 0.00 43.02 41.86 3k0f s PHE 412 CO 0.09 0.38 -0.15 0.99 0.70 0.00 0.00 175.22 177.23 3k0f s THR 413 N -1.09 3.01 -0.01 0.64 2.01 -1.13 -0.14 115.64 118.91 3k0f s THR 413 Ca 0.19 -0.93 -0.01 0.00 0.31 0.00 0.00 61.69 61.24 3k0f s THR 413 Cb -0.11 -2.23 0.00 0.00 0.01 0.00 0.00 72.50 70.17 3k0f s THR 413 CO 0.10 0.46 0.04 0.21 -0.69 0.00 0.00 174.62 174.74 3k0f s ASN 414 N -1.12 -0.02 -0.33 3.53 2.47 0.13 0.75 114.94 120.35 3k0f s ASN 414 Ca 0.14 0.03 -0.06 0.00 0.42 0.00 0.00 52.86 53.38 3k0f s ASN 414 Cb -0.11 0.09 0.04 0.00 -1.45 0.00 0.00 41.25 39.82 3k0f s ASN 414 CO 0.04 -0.04 0.09 -0.89 -3.72 0.00 0.00 177.10 172.57 3k0f s THR 415 N -0.13 3.70 -0.07 -5.21 2.01 -1.26 -2.72 115.64 111.96 3k0f s THR 415 Ca -0.02 -1.12 -0.30 0.00 0.31 0.00 0.00 61.69 60.56 3k0f s THR 415 Cb -0.01 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.37 3k0f s THR 415 CO 0.00 -0.15 1.43 -0.94 -0.69 0.00 0.00 174.62 174.27 3k0f s SER 416 N 1.39 6.83 0.64 3.53 1.04 -0.61 -4.89 113.70 121.63 3k0f s SER 416 Ca -0.02 2.01 0.13 0.00 0.48 0.00 0.00 55.95 58.55 3k0f s SER 416 Cb -0.19 -2.55 0.68 0.00 0.10 0.00 0.00 66.02 64.07 3k0f s SER 416 CO 0.02 -0.79 1.37 0.44 0.98 0.00 0.00 173.24 175.27 3k0f h ASP 417 N 8.44 0.00 -3.32 7.02 3.32 -1.94 -3.39 116.42 126.54 3k0f h ASP 417 Ca -0.35 0.00 -0.40 0.00 0.02 0.00 0.00 57.03 56.30 3k0f h ASP 417 Cb 1.15 0.00 -0.37 0.00 0.22 0.00 0.00 39.33 40.33 3k0f h ASP 417 CO 0.94 0.00 -0.76 0.00 -1.72 0.00 0.00 179.24 177.70 3k0f s GLN 418 N -3.98 0.41 0.25 3.56 -2.07 -1.26 -5.03 119.66 111.53 3k0f s GLN 418 Ca -0.01 0.16 -0.30 0.00 -1.82 0.00 0.00 55.36 53.39 3k0f s GLN 418 Cb 0.04 -0.77 -0.09 0.00 -1.09 0.00 0.00 33.01 31.09 3k0f s GLN 418 CO 0.11 -0.27 1.21 -0.59 -1.32 0.00 0.00 175.29 174.44 3k0f s PHE 419 N 1.80 3.36 -0.12 9.60 -0.12 -1.26 -3.64 117.98 127.60 3k0f s PHE 419 Ca 0.02 1.46 -0.08 0.00 -0.05 0.00 0.00 56.93 58.28 3k0f s PHE 419 Cb -0.13 -3.48 0.03 0.00 -0.63 0.00 0.00 43.02 38.82 3k0f s PHE 419 CO -0.04 -1.28 0.17 -1.33 -0.05 0.00 0.00 175.22 172.69 3k0f n MET 420 N 1.76 -3.96 0.00 1.99 2.81 -1.26 -4.72 117.12 113.74 3k0f n MET 420 Ca 0.02 3.00 0.00 0.00 -1.81 0.00 0.00 57.70 58.91 3k0f n MET 420 Cb 0.44 -4.11 0.00 0.00 -0.71 0.00 0.00 33.22 28.83 3k0f n MET 420 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3k0f n GLY 421 N 1.91 1.96 3.51 3.03 0.00 -1.26 -4.94 105.19 109.41 3k0f n GLY 421 Ca -0.29 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.18 3k0f n GLY 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k0f n ALA 422 N -0.08 0.46 1.47 4.61 0.00 -1.24 -4.80 120.51 120.93 3k0f n ALA 422 Ca 0.00 0.15 0.15 0.00 0.00 0.00 0.00 53.44 53.74 3k0f n ALA 422 Cb 0.00 -2.35 0.71 0.00 0.00 0.00 0.00 19.45 17.81 3k0f n ALA 422 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3k0f n HIS 423 N 7.76 0.00 -3.96 0.00 8.25 -1.26 -4.87 115.22 121.14 3k0f n HIS 423 Ca 0.38 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.75 3k0f n HIS 423 Cb 0.15 -0.22 -0.11 0.00 1.12 0.00 0.00 29.99 30.93 3k0f n HIS 423 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3k0f s SER 424 N -2.48 0.20 0.00 0.41 1.04 -1.26 -5.10 113.70 106.51 3k0f s SER 424 Ca 0.30 -0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.27 3k0f s SER 424 Cb 0.20 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.46 3k0f s SER 424 CO 0.46 -0.34 0.20 -0.38 0.98 0.00 0.00 173.24 174.15 3k0f n ILE 425 N 1.45 0.00 -3.66 -1.02 -0.00 -1.26 -4.69 119.36 110.18 3k0f n ILE 425 Ca -0.23 0.70 -0.36 0.00 -0.00 0.00 0.00 62.75 62.86 3k0f n ILE 425 Cb 0.56 -1.62 -0.07 0.00 -0.00 0.00 0.00 39.64 38.51 3k0f n ILE 425 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 3k0f s ALA 426 N -2.16 3.67 0.28 -1.39 0.00 -1.26 -4.85 121.76 116.06 3k0f s ALA 426 Ca 0.00 -0.57 0.01 0.00 0.00 0.00 0.00 51.96 51.40 3k0f s ALA 426 Cb 0.00 -2.24 0.57 0.00 0.00 0.00 0.00 23.12 21.45 3k0f s ALA 426 CO 0.00 0.20 1.81 -0.44 0.00 0.00 0.00 175.76 177.33 3k0f h ASP 427 N 6.38 0.82 1.55 0.00 3.32 -1.94 -0.73 116.42 125.84 3k0f h ASP 427 Ca -0.43 0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.68 3k0f h ASP 427 Cb 1.17 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.62 3k0f h ASP 427 CO 0.73 0.40 -0.06 0.77 -1.72 0.00 0.00 179.24 179.36 3k0f h SER 428 N 0.88 0.00 -3.84 6.45 4.64 -1.99 -3.49 113.55 116.21 3k0f h SER 428 Ca 0.50 -0.01 -0.14 0.00 -0.47 0.00 0.00 61.79 61.66 3k0f h SER 428 Cb 0.58 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.75 3k0f h SER 428 CO -0.30 0.01 -0.37 1.41 -0.87 0.00 0.00 176.83 176.71 3k0f n HIS 429 N -2.47 -1.06 -2.09 4.77 8.25 -0.28 -5.03 115.22 117.31 3k0f n HIS 429 Ca 0.05 0.42 -0.41 0.00 -0.26 0.00 0.00 57.72 57.53 3k0f n HIS 429 Cb 0.46 -3.38 -0.00 0.00 1.12 0.00 0.00 29.99 28.19 3k0f n HIS 429 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 3k0f n ILE 430 N -2.41 5.12 0.00 1.59 2.08 -1.26 -4.90 119.36 119.59 3k0f n ILE 430 Ca -0.10 -4.42 0.00 0.00 0.56 0.00 0.00 62.75 58.78 3k0f n ILE 430 Cb 0.57 -2.11 0.00 0.00 -0.75 0.00 0.00 39.64 37.35 3k0f n ILE 430 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3k0f n ALA 432 N 2.03 0.00 0.01 -1.39 0.00 -1.26 -3.52 120.51 116.38 3k0f n ALA 432 Ca 0.57 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 54.01 3k0f n ALA 432 Cb 0.27 -0.01 -0.10 0.00 0.00 0.00 0.00 19.45 19.61 3k0f n ALA 432 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3k0f n ILE 433 N -0.11 1.12 -2.83 0.00 -0.00 -1.26 -4.94 119.36 111.33 3k0f n ILE 433 Ca 0.00 -0.70 -0.40 0.00 -0.00 0.00 0.00 62.75 61.65 3k0f n ILE 433 Cb 0.00 -0.64 -0.05 0.00 -0.00 0.00 0.00 39.64 38.95 3k0f n ILE 433 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 3k0f s THR 434 N -2.91 4.39 -0.36 1.39 -1.32 -1.23 -4.90 115.64 110.70 3k0f s THR 434 Ca -0.04 1.92 0.23 0.00 -1.21 0.00 0.00 61.69 62.58 3k0f s THR 434 Cb 0.09 -4.25 0.09 0.00 -1.51 0.00 0.00 72.50 66.92 3k0f s THR 434 CO 0.82 0.42 1.24 0.44 -2.21 0.00 0.00 174.62 175.33 3k0f h ASP 435 N 4.91 0.00 -3.59 8.08 3.32 -1.82 -3.47 116.42 123.85 3k0f h ASP 435 Ca -0.45 -0.03 -0.15 0.00 0.02 0.00 0.00 57.03 56.43 3k0f h ASP 435 Cb 1.21 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.49 3k0f h ASP 435 CO 0.69 0.02 -0.35 -0.89 -1.72 0.00 0.00 179.24 176.99 3k0f s THR 436 N -3.29 -0.01 -0.05 0.35 2.01 -1.07 -0.30 115.64 113.27 3k0f s THR 436 Ca 0.03 0.05 0.06 0.00 0.31 0.00 0.00 61.69 62.14 3k0f s THR 436 Cb 0.09 -0.49 -0.01 0.00 0.01 0.00 0.00 72.50 72.10 3k0f s THR 436 CO 0.75 0.02 -0.24 -0.63 -0.69 0.00 0.00 174.62 173.83 3k0f s ILE 437 N 0.72 1.97 -0.17 1.82 1.01 1.00 -1.64 121.20 125.89 3k0f s ILE 437 Ca -0.04 -1.03 0.01 0.00 0.00 0.00 0.00 60.65 59.58 3k0f s ILE 437 Cb -0.06 -1.66 0.03 0.00 0.01 0.00 0.00 42.46 40.79 3k0f s ILE 437 CO -0.05 0.55 -0.12 -0.63 0.00 0.00 0.00 174.94 174.69 3k0f s ILE 438 N -0.25 1.58 -0.10 2.92 -1.09 -0.46 -1.74 121.20 122.06 3k0f s ILE 438 Ca -0.00 -0.81 -0.04 0.00 -2.23 0.00 0.00 60.65 57.57 3k0f s ILE 438 Cb -0.12 -1.58 -0.04 0.00 -1.58 0.00 0.00 42.46 39.14 3k0f s ILE 438 CO 0.02 0.30 0.04 -0.22 -1.23 0.00 0.00 174.94 173.86 3k0f s LEU 439 N 1.45 3.82 -0.11 2.97 2.96 0.19 -1.16 118.68 128.81 3k0f s LEU 439 Ca 0.02 0.23 0.02 0.00 -0.22 0.00 0.00 54.13 54.18 3k0f s LEU 439 Cb -0.15 -1.90 0.01 0.00 0.50 0.00 0.00 46.19 44.66 3k0f s LEU 439 CO -0.09 0.38 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.39 3k0f s LEU 440 N -0.85 1.78 -0.03 -0.68 1.43 0.19 -1.30 118.68 119.22 3k0f s LEU 440 Ca 0.13 -0.46 -0.05 0.00 -1.03 0.00 0.00 54.13 52.73 3k0f s LEU 440 Cb -0.12 -1.15 0.01 0.00 0.03 0.00 0.00 46.19 44.96 3k0f s LEU 440 CO 0.03 0.02 0.12 0.00 0.23 0.00 0.00 176.35 176.75 3k0f s GLN 441 N 0.97 0.25 -0.01 1.70 -2.07 -0.79 -3.88 119.66 115.83 3k0f s GLN 441 Ca -0.06 -0.04 -0.30 0.00 -1.82 0.00 0.00 55.36 53.14 3k0f s GLN 441 Cb -0.15 0.11 -0.03 0.00 -1.09 0.00 0.00 33.01 31.85 3k0f s GLN 441 CO -0.02 -0.05 1.05 0.71 -1.32 0.00 0.00 175.29 175.66 3k0f s TYR 442 N -0.43 3.55 -0.17 9.60 4.12 -1.26 -1.81 117.35 130.94 3k0f s TYR 442 Ca -0.05 1.56 0.00 0.00 0.02 0.00 0.00 57.07 58.60 3k0f s TYR 442 Cb -0.03 -3.22 0.00 0.00 -1.52 0.00 0.00 41.96 37.19 3k0f s TYR 442 CO 0.00 -0.42 -0.15 0.08 0.02 0.00 0.00 175.55 175.08 3k0f s VAL 443 N 1.31 2.59 -0.52 0.71 1.01 -0.13 -4.45 120.40 120.91 3k0f s VAL 443 Ca 0.53 -0.79 -0.29 0.00 0.00 0.00 0.00 61.98 61.44 3k0f s VAL 443 Cb -0.23 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.09 3k0f s VAL 443 CO 0.26 0.51 1.17 -0.70 0.00 0.00 0.00 175.10 176.34 3k0f s GLU 444 N 0.97 3.63 -0.50 2.72 2.12 0.26 -1.25 118.70 126.65 3k0f s GLU 444 Ca -0.02 0.44 0.03 0.00 0.36 0.00 0.00 54.97 55.77 3k0f s GLU 444 Cb -0.15 -3.96 0.15 0.00 0.26 0.00 0.00 34.13 30.43 3k0f s GLU 444 CO -0.03 -1.52 0.31 0.42 -0.54 0.00 0.00 175.26 173.90 3k0f s ILE 445 N 4.70 1.65 -0.16 -3.70 -1.09 -0.01 -4.14 121.20 118.45 3k0f s ILE 445 Ca 0.46 -2.98 -0.01 0.00 -2.23 0.00 0.00 60.65 55.89 3k0f s ILE 445 Cb -0.07 -2.13 0.00 0.00 -1.58 0.00 0.00 42.46 38.67 3k0f s ILE 445 CO 0.29 -0.96 0.16 0.54 -1.23 0.00 0.00 174.94 173.75 3k0f n ARG 446 N 3.09 -0.39 -0.97 2.79 1.74 -1.26 -3.86 116.66 117.79 3k0f n ARG 446 Ca 0.14 0.79 -0.06 0.00 -0.77 0.00 0.00 57.85 57.94 3k0f n ARG 446 Cb 0.36 -2.54 -0.03 0.00 -1.02 0.00 0.00 32.46 29.24 3k0f n ARG 446 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k0f n GLY 447 N -0.99 0.58 3.00 -0.13 0.00 -1.26 -4.90 105.19 101.50 3k0f n GLY 447 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.84 3k0f n GLY 447 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k0f s GLU 448 N -2.11 0.77 -0.87 1.61 2.02 -1.25 -5.11 118.70 113.77 3k0f s GLU 448 Ca 0.00 -0.29 -0.19 0.00 0.02 0.00 0.00 54.97 54.51 3k0f s GLU 448 Cb 0.00 -0.74 0.13 0.00 0.10 0.00 0.00 34.13 33.62 3k0f s GLU 448 CO 0.00 0.15 1.04 -1.64 0.02 0.00 0.00 175.26 174.83 3k0f s MET 449 N -0.03 3.51 0.72 1.61 -1.94 -1.26 -0.83 119.30 121.08 3k0f s MET 449 Ca 0.01 -1.70 -0.02 0.00 -1.71 0.00 0.00 55.69 52.26 3k0f s MET 449 Cb -0.05 -4.75 0.12 0.00 2.01 0.00 0.00 34.83 32.16 3k0f s MET 449 CO -0.00 -1.71 1.00 -1.54 -0.01 0.00 0.00 175.02 172.76 3k0f s SER 450 N 3.49 4.36 0.08 3.03 1.04 -0.38 -4.83 113.70 120.50 3k0f s SER 450 Ca 0.29 -0.23 0.05 0.00 0.48 0.00 0.00 55.95 56.54 3k0f s SER 450 Cb -0.08 -0.19 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 3k0f s SER 450 CO -0.06 -1.85 -0.04 -0.13 0.98 0.00 0.00 173.24 172.14 3k0f s ARG 451 N -5.17 2.41 -0.05 4.02 3.00 -1.25 -0.96 118.95 120.95 3k0f s ARG 451 Ca 0.66 -0.88 0.01 0.00 0.00 0.00 0.00 55.73 55.52 3k0f s ARG 451 Cb -0.06 -2.46 0.02 0.00 0.00 0.00 0.00 34.95 32.45 3k0f s ARG 451 CO 0.44 0.54 -0.06 0.00 0.00 0.00 0.00 175.30 176.22 3k0f s ALA 452 N -1.23 0.82 -0.03 2.13 0.00 -0.75 -0.94 121.76 121.76 3k0f s ALA 452 Ca 0.23 -0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.10 3k0f s ALA 452 Cb -0.11 -0.48 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 3k0f s ALA 452 CO 0.15 -0.01 -0.20 -1.50 0.00 0.00 0.00 175.76 174.20 3k0f s ILE 453 N 0.92 2.61 -0.11 0.00 2.07 0.63 -1.88 121.20 125.43 3k0f s ILE 453 Ca -0.11 -0.92 -0.09 0.00 -1.41 0.00 0.00 60.65 58.12 3k0f s ILE 453 Cb -0.15 -1.99 0.03 0.00 0.13 0.00 0.00 42.46 40.49 3k0f s ILE 453 CO 0.00 0.57 0.29 0.21 -1.91 0.00 0.00 174.94 174.10 3k0f s ASN 454 N -0.74 -0.31 -1.12 4.50 2.47 -0.42 -2.00 114.94 117.32 3k0f s ASN 454 Ca 0.11 0.59 -0.14 0.00 0.42 0.00 0.00 52.86 53.85 3k0f s ASN 454 Cb -0.10 0.57 0.18 0.00 -1.45 0.00 0.00 41.25 40.45 3k0f s ASN 454 CO 0.00 -0.12 1.28 -0.69 -3.72 0.00 0.00 177.10 173.86 3k0f s VAL 455 N 0.45 5.18 0.21 -5.21 1.01 -1.26 0.55 120.40 121.32 3k0f s VAL 455 Ca -0.02 -2.57 -0.13 0.00 0.00 0.00 0.00 61.98 59.26 3k0f s VAL 455 Cb -0.04 -4.81 0.21 0.00 0.00 0.00 0.00 36.38 31.74 3k0f s VAL 455 CO -0.02 -1.49 1.64 0.15 0.00 0.00 0.00 175.10 175.37 3k0f h PHE 456 N 7.42 -0.25 -3.37 5.22 3.57 -1.66 -3.45 116.94 124.43 3k0f h PHE 456 Ca 0.25 0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.75 3k0f h PHE 456 Cb 0.91 0.20 -0.13 0.00 2.79 0.00 0.00 35.95 39.72 3k0f h PHE 456 CO 1.05 -0.24 -0.09 -1.59 -2.23 0.00 0.00 178.31 175.22 3k0f s LYS 457 N -6.21 1.05 -0.27 1.11 -2.85 -1.20 -4.96 119.74 106.41 3k0f s LYS 457 Ca -0.14 -0.68 -0.02 0.00 -1.00 0.00 0.00 55.97 54.13 3k0f s LYS 457 Cb 0.19 0.46 0.16 0.00 -2.06 0.00 0.00 37.83 36.58 3k0f s LYS 457 CO 0.73 -0.40 0.48 -1.64 0.10 0.00 0.00 175.35 174.63 3k0f s MET 458 N -3.68 0.45 0.38 1.78 -1.94 -1.26 -0.00 119.30 115.03 3k0f s MET 458 Ca 0.02 0.77 0.08 0.00 -1.71 0.00 0.00 55.69 54.86 3k0f s MET 458 Cb 0.02 0.03 0.82 0.00 2.01 0.00 0.00 34.83 37.71 3k0f s MET 458 CO -0.11 -0.62 1.94 0.00 -0.01 0.00 0.00 175.02 176.22 3k0f h ARG 459 N 8.10 0.64 0.01 2.03 3.08 -1.03 -3.30 114.38 123.91 3k0f h ARG 459 Ca -0.21 -0.04 -0.37 0.00 0.07 0.00 0.00 59.98 59.43 3k0f h ARG 459 Cb 1.16 -0.15 -0.07 0.00 0.08 0.00 0.00 29.97 31.00 3k0f h ARG 459 CO 0.26 0.43 -2.35 0.41 -1.07 0.00 0.00 179.97 177.65 3k0f n GLY 460 N -1.46 -0.79 0.00 0.04 0.00 -1.26 -5.04 105.19 96.67 3k0f n GLY 460 Ca 0.12 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3k0f n GLY 460 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3k0f n SER 461 N -2.95 0.00 -0.07 1.61 2.88 -1.25 -5.08 113.62 108.76 3k0f n SER 461 Ca -0.35 -0.89 -0.19 0.00 -1.33 0.00 0.00 58.87 56.11 3k0f n SER 461 Cb 1.10 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 64.43 3k0f n SER 461 CO 0.00 0.00 0.00 1.87 -1.23 0.00 0.00 175.04 175.68 3k0f n TRP 462 N -1.18 0.52 -1.00 0.66 -0.00 -1.26 -4.87 117.44 110.32 3k0f n TRP 462 Ca 0.00 0.11 0.03 0.00 -0.00 0.00 0.00 57.50 57.64 3k0f n TRP 462 Cb 0.00 -1.07 -0.02 0.00 -0.00 0.00 0.00 31.31 30.23 3k0f n TRP 462 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 177.69 175.30 3k0f n HIS 463 N -3.33 -1.30 -2.67 5.87 1.44 -1.26 -4.90 115.22 109.08 3k0f n HIS 463 Ca -0.39 0.71 -0.39 0.00 -2.01 0.00 0.00 57.72 55.64 3k0f n HIS 463 Cb 1.02 -1.13 -0.06 0.00 0.12 0.00 0.00 29.99 29.94 3k0f n HIS 463 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 3k0f s ASP 464 N -5.09 7.37 0.00 4.39 -1.08 0.12 -4.92 116.67 117.46 3k0f s ASP 464 Ca 0.00 2.00 0.23 0.00 -0.52 0.00 0.00 52.55 54.26 3k0f s ASP 464 Cb 0.00 -2.60 0.48 0.00 -1.46 0.00 0.00 42.92 39.33 3k0f s ASP 464 CO 0.00 -0.05 1.43 0.29 0.52 0.00 0.00 175.17 177.36 3k0f n LYS 465 N 0.96 2.52 -2.85 4.34 4.76 -1.26 -4.42 118.16 122.21 3k0f n LYS 465 Ca 0.00 -2.30 -0.39 0.00 -2.87 0.00 0.00 58.31 52.75 3k0f n LYS 465 Cb 0.48 -1.52 -0.06 0.00 -1.84 0.00 0.00 35.03 32.09 3k0f n LYS 465 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 3k0f s ALA 466 N -1.43 3.36 -1.10 7.82 0.00 -1.26 -4.97 121.76 124.18 3k0f s ALA 466 Ca 0.40 0.50 -0.06 0.00 0.00 0.00 0.00 51.96 52.80 3k0f s ALA 466 Cb 0.23 -3.10 0.30 0.00 0.00 0.00 0.00 23.12 20.55 3k0f s ALA 466 CO 0.32 0.24 1.38 -0.89 0.00 0.00 0.00 175.76 176.81 3k0f n ILE 467 N 1.36 5.08 -2.25 0.00 5.41 -1.26 -4.60 119.36 123.10 3k0f n ILE 467 Ca -0.03 -5.72 -0.39 0.00 1.00 0.00 0.00 62.75 57.61 3k0f n ILE 467 Cb 0.48 -2.25 -0.02 0.00 -0.71 0.00 0.00 39.64 37.14 3k0f n ILE 467 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 176.55 176.42 3k0f s ARG 468 N -2.21 4.22 0.62 0.38 0.52 -0.85 -4.08 118.95 117.55 3k0f s ARG 468 Ca 0.31 1.96 -0.06 0.00 -0.52 0.00 0.00 55.73 57.42 3k0f s ARG 468 Cb 0.00 -2.87 0.02 0.00 0.52 0.00 0.00 34.95 32.62 3k0f s ARG 468 CO 0.05 -0.21 0.93 -1.83 0.02 0.00 0.00 175.30 174.25 3k0f s GLU 469 N -2.01 2.78 0.00 3.54 -1.05 0.12 0.23 118.70 122.31 3k0f s GLU 469 Ca 0.53 -0.04 -0.29 0.00 -0.15 0.00 0.00 54.97 55.02 3k0f s GLU 469 Cb -0.34 -2.25 0.08 0.00 -0.44 0.00 0.00 34.13 31.18 3k0f s GLU 469 CO 0.44 -0.81 0.70 -0.59 0.95 0.00 0.00 175.26 175.94 3k0f s PHE 470 N -3.05 -0.58 0.33 4.83 -0.12 -0.11 -0.32 117.98 118.96 3k0f s PHE 470 Ca 0.55 0.81 0.10 0.00 -0.05 0.00 0.00 56.93 58.34 3k0f s PHE 470 Cb -0.11 0.46 -0.06 0.00 -0.63 0.00 0.00 43.02 42.69 3k0f s PHE 470 CO 0.45 -0.65 -0.07 0.00 -0.05 0.00 0.00 175.22 174.90 3k0f s MET 471 N -2.00 1.90 -0.12 1.99 0.23 -0.54 -3.75 119.30 117.02 3k0f s MET 471 Ca -0.06 -1.84 0.02 0.00 -1.03 0.00 0.00 55.69 52.78 3k0f s MET 471 Cb -0.00 -1.80 0.01 0.00 -1.53 0.00 0.00 34.83 31.51 3k0f s MET 471 CO 0.02 0.17 -0.18 0.42 -2.03 0.00 0.00 175.02 173.41 3k0f s ILE 472 N -2.56 1.76 0.00 3.16 1.01 -1.26 -1.43 121.20 121.88 3k0f s ILE 472 Ca 0.33 -0.80 0.00 0.00 0.00 0.00 0.00 60.65 60.18 3k0f s ILE 472 Cb 0.01 -1.58 0.00 0.00 0.01 0.00 0.00 42.46 40.90 3k0f s ILE 472 CO 0.17 0.49 0.00 -1.54 0.00 0.00 0.00 174.94 174.07 3k0f n SER 473 N 4.13 0.00 0.07 3.58 3.41 -1.06 -4.97 113.62 118.78 3k0f n SER 473 Ca -0.19 0.00 0.11 0.00 -0.26 0.00 0.00 58.87 58.52 3k0f n SER 473 Cb 0.51 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.41 3k0f n SER 473 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3k0f n ASP 474 N 0.00 0.60 0.12 4.04 8.00 -1.26 -3.76 116.55 124.28 3k0f n ASP 474 Ca 0.00 0.23 -0.03 0.00 0.71 0.00 0.00 54.79 55.70 3k0f n ASP 474 Cb 0.00 0.89 0.09 0.00 -0.02 0.00 0.00 41.12 42.08 3k0f n ASP 474 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 3k0f h LYS 475 N 0.00 0.00 0.00 -1.24 1.57 -1.83 -2.58 116.57 112.48 3k0f h LYS 475 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3k0f h LYS 475 Cb 1.03 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.34 3k0f h LYS 475 CO 0.00 0.72 0.00 0.41 -0.57 0.00 0.00 179.45 180.01 3k0f n GLY 476 N 0.54 0.39 3.69 3.86 0.00 -1.25 -4.76 105.19 107.66 3k0f n GLY 476 Ca -0.01 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 3k0f n GLY 476 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k0f s PRO 477 N -0.32 4.40 -0.31 1.61 0.04 -1.26 -2.56 135.00 136.61 3k0f s PRO 477 Ca 0.00 1.48 0.01 0.00 0.04 0.00 0.00 61.00 62.53 3k0f s PRO 477 Cb 0.00 -3.55 0.07 0.00 0.04 0.00 0.00 34.50 31.07 3k0f s PRO 477 CO 0.00 -0.36 -0.00 0.34 0.04 0.00 0.00 177.00 177.02 3k0f s ASP 478 N 1.21 4.75 -0.71 6.66 2.15 -0.51 -4.97 116.67 125.24 3k0f s ASP 478 Ca 0.51 -1.64 -0.22 0.00 0.43 0.00 0.00 52.55 51.62 3k0f s ASP 478 Cb -0.20 -1.65 0.08 0.00 -0.30 0.00 0.00 42.92 40.85 3k0f s ASP 478 CO 0.19 -0.30 1.01 -0.63 -0.17 0.00 0.00 175.17 175.27 3k0f s ILE 479 N 1.09 4.36 0.00 4.11 1.01 -1.26 -1.47 121.20 129.04 3k0f s ILE 479 Ca -0.01 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.10 3k0f s ILE 479 Cb -0.20 -4.72 0.00 0.00 0.01 0.00 0.00 42.46 37.55 3k0f s ILE 479 CO -0.05 -1.49 0.00 0.29 0.00 0.00 0.00 174.94 173.69 3k0f n LYS 480 N 7.60 1.07 -2.76 2.79 5.02 0.56 -4.96 118.16 127.49 3k0f n LYS 480 Ca 0.02 0.00 -0.16 0.00 -2.02 0.00 0.00 58.31 56.15 3k0f n LYS 480 Cb 0.46 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.50 3k0f n LYS 480 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 3k0f n ASP 481 N 0.00 1.86 -4.93 4.39 8.00 -1.26 -4.56 116.55 120.05 3k0f n ASP 481 Ca 0.00 -2.21 -0.25 0.00 0.71 0.00 0.00 54.79 53.04 3k0f n ASP 481 Cb 0.00 -0.16 0.01 0.00 -0.02 0.00 0.00 41.12 40.95 3k0f n ASP 481 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3k0f s SER 482 N -3.40 5.87 -0.40 -2.24 1.04 -1.26 0.13 113.70 113.44 3k0f s SER 482 Ca 0.32 0.59 -0.00 0.00 0.48 0.00 0.00 55.95 57.34 3k0f s SER 482 Cb -0.03 -1.79 0.33 0.00 0.10 0.00 0.00 66.02 64.63 3k0f s SER 482 CO 0.21 -0.78 1.92 0.49 0.98 0.00 0.00 173.24 176.06 3k0f n PHE 483 N -2.28 2.08 -0.03 5.02 3.01 -1.26 -4.82 117.46 119.18 3k0f n PHE 483 Ca 0.02 -2.09 0.01 0.00 1.01 0.00 0.00 57.45 56.39 3k0f n PHE 483 Cb 0.57 -1.02 0.02 0.00 -0.01 0.00 0.00 39.48 39.03 3k0f n PHE 483 CO 0.00 0.00 0.00 -2.13 1.01 0.00 0.00 176.76 175.64 3k0f n ARG 484 N -0.19 -0.01 -0.92 -1.08 0.63 -1.26 -0.52 116.66 113.31 3k0f n ARG 484 Ca 0.40 0.11 -0.14 0.00 -0.92 0.00 0.00 57.85 57.31 3k0f n ARG 484 Cb 0.77 -0.18 -0.01 0.00 0.45 0.00 0.00 32.46 33.49 3k0f n ARG 484 CO 0.00 0.00 0.00 0.27 -2.51 0.00 0.00 177.63 175.39 3k0f n ASN 485 N -3.96 6.08 -4.04 6.15 6.94 -1.26 -4.86 115.26 120.30 3k0f n ASN 485 Ca 0.01 -2.87 -0.08 0.00 -0.02 0.00 0.00 54.58 51.62 3k0f n ASN 485 Cb 0.05 -1.15 -0.10 0.00 -2.36 0.00 0.00 39.78 36.22 3k0f n ASN 485 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3k0f s PHE 486 N -1.06 0.41 0.06 -2.53 0.40 0.33 -2.71 117.98 112.87 3k0f s PHE 486 Ca 0.33 -0.84 0.06 0.00 -0.60 0.00 0.00 56.93 55.89 3k0f s PHE 486 Cb 0.22 -0.30 -0.03 0.00 0.51 0.00 0.00 43.02 43.42 3k0f s PHE 486 CO -0.04 -0.30 -0.17 -1.21 0.70 0.00 0.00 175.22 174.19 3k0f s GLU 487 N -2.87 1.07 -0.92 0.44 2.02 -0.68 -4.71 118.70 113.05 3k0f s GLU 487 Ca -0.03 -0.94 0.00 0.00 0.02 0.00 0.00 54.97 54.02 3k0f s GLU 487 Cb 0.00 -1.17 0.00 0.00 0.10 0.00 0.00 34.13 33.06 3k0f s GLU 487 CO -0.06 0.28 0.00 0.54 0.02 0.00 0.00 175.26 176.04 3k0f n ARG 488 N 1.57 -0.85 -0.02 1.61 1.74 -1.26 -2.59 116.66 116.86 3k0f n ARG 488 Ca -0.19 0.53 -0.08 0.00 -0.77 0.00 0.00 57.85 57.34 3k0f n ARG 488 Cb 0.54 -4.61 -0.05 0.00 -1.02 0.00 0.00 32.46 27.31 3k0f n ARG 488 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 3k0f h ILE 489 N 0.00 0.00 -1.76 0.55 1.08 -1.91 -0.50 117.51 114.97 3k0f h ILE 489 Ca -0.25 0.00 0.52 0.00 -0.39 0.00 0.00 64.86 64.74 3k0f h ILE 489 Cb 1.17 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.84 3k0f h ILE 489 CO 0.30 0.00 1.25 -0.38 -0.69 0.00 0.00 178.15 178.63 3k0f n ILE 490 N -4.15 -0.04 0.45 -0.67 2.08 -1.26 0.63 119.36 116.40 3k0f n ILE 490 Ca -0.03 1.44 0.11 0.00 0.56 0.00 0.00 62.75 64.83 3k0f n ILE 490 Cb 0.20 -2.40 0.44 0.00 -0.75 0.00 0.00 39.64 37.14 3k0f n ILE 490 CO 0.00 0.00 0.00 -1.54 0.56 0.00 0.00 176.55 175.57 3k0f n SER 491 N -3.93 0.48 0.00 4.38 3.41 -0.20 -4.35 113.62 113.41 3k0f n SER 491 Ca 0.41 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.63 3k0f n SER 491 Cb 1.82 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 65.06 3k0f n SER 491 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k0f n GLY 492 N 0.12 3.12 2.67 5.00 0.00 0.20 -4.02 105.19 112.28 3k0f n GLY 492 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 3k0f n GLY 492 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k0f n SER 493 N 0.11 1.60 -3.64 1.61 7.64 -1.26 0.89 113.62 120.56 3k0f n SER 493 Ca 0.00 -2.88 0.00 0.00 1.01 0.00 0.00 58.87 57.00 3k0f n SER 493 Cb 0.00 -0.67 0.00 0.00 -1.01 0.00 0.00 64.21 62.53 3k0f n SER 493 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 3k0f n PRO 494 N 2.26 1.41 -3.56 1.43 -0.02 -1.25 -4.91 135.00 130.35 3k0f n PRO 494 Ca 0.24 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.71 3k0f n PRO 494 Cb 0.41 0.00 -0.06 0.00 -0.02 0.00 0.00 33.50 33.83 3k0f n PRO 494 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3k0f s THR 495 N 0.00 -0.18 0.32 3.45 2.01 -1.07 -4.91 115.64 115.26 3k0f s THR 495 Ca 0.00 0.00 -0.27 0.00 0.31 0.00 0.00 61.69 61.73 3k0f s THR 495 Cb 0.00 -1.00 -0.10 0.00 0.01 0.00 0.00 72.50 71.41 3k0f s THR 495 CO 0.00 0.00 0.98 -0.60 -0.69 0.00 0.00 174.62 174.31 3k0f s ARG 496 N 1.73 4.54 0.18 4.92 6.06 -1.26 -1.69 118.95 133.43 3k0f s ARG 496 Ca -0.07 1.45 0.00 0.00 -2.50 0.00 0.00 55.73 54.61 3k0f s ARG 496 Cb -0.05 -2.86 -0.00 0.00 0.06 0.00 0.00 34.95 32.10 3k0f s ARG 496 CO -0.16 0.22 0.02 -0.89 -2.50 0.00 0.00 175.30 171.99 3k0f n ILE 497 N 0.64 0.00 -0.52 4.11 2.08 -1.10 -4.97 119.36 119.60 3k0f n ILE 497 Ca 0.02 -0.91 0.00 0.00 0.56 0.00 0.00 62.75 62.42 3k0f n ILE 497 Cb 0.49 0.22 0.00 0.00 -0.75 0.00 0.00 39.64 39.60 3k0f n ILE 497 CO 0.00 0.00 0.00 0.35 0.56 0.00 0.00 176.55 177.46 3k0f n THR 498 N -0.44 -1.79 -2.41 1.39 -2.24 -1.26 -4.99 114.28 102.54 3k0f n THR 498 Ca -0.06 0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.56 3k0f n THR 498 Cb 0.24 -1.94 0.03 0.00 -2.10 0.00 0.00 70.33 66.56 3k0f n THR 498 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 3k0f n VAL 499 N 0.31 1.95 -3.25 2.28 0.31 -1.26 -4.94 118.33 113.73 3k0f n VAL 499 Ca 0.00 -3.80 -0.16 0.00 -0.01 0.00 0.00 64.34 60.37 3k0f n VAL 499 Cb 0.00 -0.21 -0.06 0.00 -0.91 0.00 0.00 33.84 32.66 3k0f n VAL 499 CO 0.00 0.00 0.00 1.51 -1.32 0.00 0.00 176.83 177.02 3k0f s ASP 500 N -3.61 0.61 0.03 4.52 3.84 -1.26 -5.07 116.67 115.73 3k0f s ASP 500 Ca 0.41 -1.95 -0.20 0.00 -0.00 0.00 0.00 52.55 50.81 3k0f s ASP 500 Cb 0.39 0.64 -0.11 0.00 -1.38 0.00 0.00 42.92 42.45 3k0f s ASP 500 CO -0.02 -0.19 1.20 -0.33 -0.00 0.00 0.00 175.17 175.83 3k0f h GLU 501 N 6.31 -0.71 0.00 2.11 3.07 -2.03 -3.48 114.58 119.85 3k0f h GLU 501 Ca 0.11 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 3k0f h GLU 501 Cb 1.04 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 29.11 3k0f h GLU 501 CO 0.20 -0.47 0.00 1.63 -1.40 0.00 0.00 179.01 178.97 3k0f n LYS 502 N -4.14 0.00 -3.50 2.33 5.02 -1.26 -5.18 118.16 111.43 3k0f n LYS 502 Ca -0.09 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.20 3k0f n LYS 502 Cb 0.29 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.26 3k0f n LYS 502 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 3k0f s SER 503 N 0.00 -0.92 0.19 4.39 0.01 -1.26 -5.17 113.70 110.94 3k0f s SER 503 Ca 0.00 1.17 0.00 0.00 1.31 0.00 0.00 55.95 58.43 3k0f s SER 503 Cb 0.00 2.01 0.00 0.00 0.21 0.00 0.00 66.02 68.24 3k0f s SER 503 CO 0.00 -0.18 0.00 1.21 0.41 0.00 0.00 173.24 174.68 3k0f n GLU 504 N 5.27 0.00 0.00 12.44 2.13 -1.26 -5.29 120.64 133.93 3k0f n GLU 504 Ca -0.10 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.74 3k0f n GLU 504 Cb 0.51 0.00 0.11 0.00 0.27 0.00 0.00 31.44 32.33 3k0f n GLU 504 CO 0.00 0.00 0.00 1.47 -0.41 0.00 0.00 177.13 178.19