#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 1.71 -4.38 4.31 -0.00 -1.26 -4.90 115.22 110.71 3k0f n HIS 15 Ca 0.00 -2.22 -0.29 0.00 -0.00 0.00 0.00 57.72 55.20 3k0f n HIS 15 Cb 0.00 -1.64 -0.13 0.00 -0.00 0.00 0.00 29.99 28.23 3k0f n HIS 15 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.34 175.69 3k0f s GLN 16 N -0.83 1.53 0.06 1.57 -0.21 -1.26 -5.05 119.66 115.48 3k0f s GLN 16 Ca 0.60 -1.29 0.26 0.00 0.02 0.00 0.00 55.36 54.95 3k0f s GLN 16 Cb 0.30 -1.97 0.69 0.00 1.00 0.00 0.00 33.01 33.03 3k0f s GLN 16 CO -0.14 0.46 1.57 0.00 -2.12 0.00 0.00 175.29 175.06 3k0f n ALA 17 N 0.90 2.89 -2.54 6.09 0.00 -1.26 -4.86 120.51 121.72 3k0f n ALA 17 Ca -0.17 -0.21 -0.32 0.00 0.00 0.00 0.00 53.44 52.74 3k0f n ALA 17 Cb 0.53 -1.27 -0.15 0.00 0.00 0.00 0.00 19.45 18.56 3k0f n ALA 17 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3k0f s ILE 18 N -3.06 2.59 0.17 0.00 -1.09 -1.26 -5.06 121.20 113.49 3k0f s ILE 18 Ca 0.10 -0.89 -0.30 0.00 -2.23 0.00 0.00 60.65 57.34 3k0f s ILE 18 Cb 0.16 -1.98 -0.07 0.00 -1.58 0.00 0.00 42.46 38.98 3k0f s ILE 18 CO 0.65 0.58 1.07 0.00 -1.23 0.00 0.00 174.94 176.01 3k0f s ALA 19 N -0.48 3.35 0.26 9.38 0.00 -1.26 -4.98 121.76 128.03 3k0f s ALA 19 Ca 0.06 0.77 0.12 0.00 0.00 0.00 0.00 51.96 52.91 3k0f s ALA 19 Cb -0.12 -3.34 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 3k0f s ALA 19 CO 0.01 -0.17 -0.19 0.15 0.00 0.00 0.00 175.76 175.56 3k0f s LYS 20 N -0.32 1.71 -0.05 0.00 1.02 -1.26 -0.94 119.74 119.90 3k0f s LYS 20 Ca 0.49 -1.69 0.06 0.00 0.02 0.00 0.00 55.97 54.85 3k0f s LYS 20 Cb -0.28 -1.82 -0.01 0.00 -0.52 0.00 0.00 37.83 35.19 3k0f s LYS 20 CO 0.34 0.35 -0.24 1.41 -0.92 0.00 0.00 175.35 176.28 3k0f s MET 21 N -3.38 2.45 0.16 1.68 -2.45 0.59 -4.78 119.30 113.58 3k0f s MET 21 Ca 0.29 -0.89 -0.28 0.00 -1.25 0.00 0.00 55.69 53.56 3k0f s MET 21 Cb -0.06 -2.16 -0.08 0.00 1.25 0.00 0.00 34.83 33.79 3k0f s MET 21 CO 0.15 0.44 0.86 1.03 1.05 0.00 0.00 175.02 178.55 3k0f s ARG 22 N -0.31 4.67 0.30 4.11 0.52 -1.26 -0.07 118.95 126.91 3k0f s ARG 22 Ca 0.01 1.30 0.19 0.00 -0.52 0.00 0.00 55.73 56.71 3k0f s ARG 22 Cb -0.13 -3.30 0.12 0.00 0.52 0.00 0.00 34.95 32.17 3k0f s ARG 22 CO 0.02 0.45 1.38 1.79 0.02 0.00 0.00 175.30 178.96 3k0f h THR 23 N 3.50 0.43 -0.46 0.02 1.35 -1.94 -3.46 112.91 112.36 3k0f h THR 23 Ca -0.45 -1.64 -0.20 0.00 -0.55 0.00 0.00 66.41 63.56 3k0f h THR 23 Cb 1.20 2.13 -0.08 0.00 -1.73 0.00 0.00 68.15 69.67 3k0f h THR 23 CO 0.68 0.25 -0.18 0.23 -0.25 0.00 0.00 175.52 176.25 3k0f n MET 24 N -3.08 -1.26 -2.98 4.72 2.81 -1.26 -4.71 117.12 111.36 3k0f n MET 24 Ca 0.01 0.80 -0.41 0.00 -1.81 0.00 0.00 57.70 56.29 3k0f n MET 24 Cb 0.66 -4.95 -0.05 0.00 -0.71 0.00 0.00 33.22 28.17 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 -2.07 4.94 -0.15 2.02 1.01 -1.26 -4.96 121.20 120.74 3k0f s ILE 25 Ca 0.00 1.47 -0.35 0.00 0.00 0.00 0.00 60.65 61.78 3k0f s ILE 25 Cb 0.00 -4.07 -0.12 0.00 0.01 0.00 0.00 42.46 38.28 3k0f s ILE 25 CO 0.00 0.08 1.91 1.21 0.00 0.00 0.00 174.94 178.14 3k0f n GLU 26 N 5.02 1.94 0.00 2.79 2.13 -1.26 -1.86 120.64 129.41 3k0f n GLU 26 Ca 0.02 0.69 0.00 0.00 0.66 0.00 0.00 57.16 58.53 3k0f n GLU 26 Cb 0.49 -2.59 0.00 0.00 0.27 0.00 0.00 31.44 29.61 3k0f n GLU 26 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3k0f n GLY 27 N 4.66 2.80 0.07 8.31 0.00 -1.26 -1.59 105.19 118.17 3k0f n GLY 27 Ca 0.25 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.13 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 0.02 -0.70 1.61 3.57 -1.70 -3.19 116.94 116.55 3k0f h PHE 28 Ca 0.00 -0.01 0.20 0.00 3.53 0.00 0.00 57.97 61.69 3k0f h PHE 28 Cb 0.00 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 3k0f h PHE 28 CO 0.00 0.91 0.55 -0.44 -2.23 0.00 0.00 178.31 177.10 3k0f h ASP 29 N -0.87 0.00 0.29 0.41 3.32 -1.91 -0.58 116.42 117.08 3k0f h ASP 29 Ca -0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.03 3k0f h ASP 29 Cb 0.92 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.47 3k0f h ASP 29 CO 0.00 0.00 -0.14 0.44 -1.72 0.00 0.00 179.24 177.82 3k0f h ASP 30 N 0.00 -0.33 -0.84 6.45 3.32 -1.91 1.95 116.42 125.05 3k0f h ASP 30 Ca 0.33 -0.20 0.20 0.00 0.02 0.00 0.00 57.03 57.38 3k0f h ASP 30 Cb 1.43 0.09 -0.05 0.00 0.22 0.00 0.00 39.33 41.01 3k0f h ASP 30 CO -0.00 0.13 0.56 0.40 -1.72 0.00 0.00 179.24 178.61 3k0f h ILE 31 N -0.92 0.69 -0.59 0.35 2.04 -1.22 0.19 117.51 118.05 3k0f h ILE 31 Ca -0.04 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 3k0f h ILE 31 Cb 0.51 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 3k0f h ILE 31 CO 0.07 0.06 0.06 -1.54 0.00 0.00 0.00 178.15 176.79 3k0f n SER 32 N -4.46 5.46 -4.06 1.72 3.41 -0.34 -0.03 113.62 115.32 3k0f n SER 32 Ca 0.17 -3.01 -0.28 0.00 -0.26 0.00 0.00 58.87 55.50 3k0f n SER 32 Cb 0.69 -0.69 -0.04 0.00 -0.26 0.00 0.00 64.21 63.91 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 0.39 -1.58 0.00 7.33 8.25 0.68 -3.80 115.22 126.49 3k0f n HIS 33 Ca 0.30 0.73 0.00 0.00 -0.26 0.00 0.00 57.72 58.49 3k0f n HIS 33 Cb 1.23 -3.46 0.00 0.00 1.12 0.00 0.00 29.99 28.88 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 -2.02 1.13 0.00 -1.41 0.00 0.66 -5.01 105.19 98.54 3k0f n GLY 34 Ca -0.27 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.38 3.74 -0.02 0.00 -1.22 -4.07 105.19 103.24 3k0f n GLY 35 Ca 0.00 -2.23 -0.39 0.00 0.00 0.00 0.00 46.02 43.40 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 4.38 0.09 0.99 1.43 0.90 -4.62 118.68 121.84 3k0f s LEU 36 Ca 0.00 1.16 -0.35 0.00 -1.03 0.00 0.00 54.13 53.90 3k0f s LEU 36 Cb 0.00 -2.97 -0.15 0.00 0.03 0.00 0.00 46.19 43.11 3k0f s LEU 36 CO 0.00 0.03 1.54 -2.65 0.23 0.00 0.00 176.35 175.50 3k0f n PRO 37 N 3.11 1.77 -1.56 1.29 -0.02 -1.26 -0.30 135.00 138.03 3k0f n PRO 37 Ca -0.05 0.64 -0.33 0.00 -2.02 0.00 0.00 63.50 61.74 3k0f n PRO 37 Cb 0.51 -2.37 0.07 0.00 -0.02 0.00 0.00 33.50 31.69 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 1.25 2.94 0.00 4.25 1.09 -0.12 -3.02 121.20 127.59 3k0f s ILE 38 Ca 0.83 0.42 0.00 0.00 -1.10 0.00 0.00 60.65 60.80 3k0f s ILE 38 Cb -0.79 -2.92 0.00 0.00 -1.06 0.00 0.00 42.46 37.69 3k0f s ILE 38 CO 0.44 -0.29 0.00 0.61 -0.10 0.00 0.00 174.94 175.60 3k0f n GLY 39 N -0.32 0.37 3.20 6.18 0.00 -1.25 -4.93 105.19 108.44 3k0f n GLY 39 Ca 0.11 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.88 3k0f n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k0f n ARG 40 N -2.00 0.87 -4.86 1.61 1.74 -1.17 -4.47 116.66 108.39 3k0f n ARG 40 Ca 0.00 -3.08 -0.25 0.00 -0.77 0.00 0.00 57.85 53.75 3k0f n ARG 40 Cb 0.00 0.59 -0.15 0.00 -1.02 0.00 0.00 32.46 31.88 3k0f n ARG 40 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3k0f s SER 41 N -3.58 2.17 -0.15 0.55 1.04 -1.26 -1.55 113.70 110.92 3k0f s SER 41 Ca 0.13 -0.35 0.01 0.00 0.48 0.00 0.00 55.95 56.22 3k0f s SER 41 Cb -0.01 -0.23 0.00 0.00 0.10 0.00 0.00 66.02 65.88 3k0f s SER 41 CO 0.08 0.22 -0.18 -0.89 0.98 0.00 0.00 173.24 173.45 3k0f s THR 42 N -0.47 2.40 -0.35 2.02 2.01 0.10 -2.40 115.64 118.96 3k0f s THR 42 Ca 0.07 -0.86 -0.22 0.00 0.31 0.00 0.00 61.69 60.99 3k0f s THR 42 Cb -0.07 -1.99 0.00 0.00 0.01 0.00 0.00 72.50 70.45 3k0f s THR 42 CO -0.00 0.53 0.73 -0.22 -0.69 0.00 0.00 174.62 174.96 3k0f s LEU 43 N 0.84 4.16 -0.43 4.42 2.96 -0.28 -0.11 118.68 130.24 3k0f s LEU 43 Ca -0.05 0.35 -0.11 0.00 -0.22 0.00 0.00 54.13 54.10 3k0f s LEU 43 Cb -0.15 -2.94 0.07 0.00 0.50 0.00 0.00 46.19 43.67 3k0f s LEU 43 CO -0.01 -0.65 0.28 -0.69 -1.32 0.00 0.00 176.35 173.96 3k0f s VAL 44 N 2.92 4.45 0.04 1.68 1.01 0.03 0.87 120.40 131.39 3k0f s VAL 44 Ca 0.29 -1.30 0.06 0.00 0.00 0.00 0.00 61.98 61.03 3k0f s VAL 44 Cb -0.14 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 3k0f s VAL 44 CO 0.15 -0.51 -0.14 -0.55 0.00 0.00 0.00 175.10 174.06 3k0f s SER 45 N 2.18 4.11 0.04 3.32 0.15 -0.08 -2.21 113.70 121.20 3k0f s SER 45 Ca 0.03 -0.34 -0.28 0.00 0.70 0.00 0.00 55.95 56.06 3k0f s SER 45 Cb -0.23 -0.77 0.09 0.00 -1.71 0.00 0.00 66.02 63.40 3k0f s SER 45 CO 0.03 0.25 0.99 -0.83 1.20 0.00 0.00 173.24 174.89 3k0f s GLY 46 N -1.52 -0.35 0.00 9.45 0.00 -0.86 -0.67 107.32 113.37 3k0f s GLY 46 Ca 0.16 0.69 0.00 0.00 0.00 0.00 0.00 44.72 45.57 3k0f s GLY 46 CO 0.07 0.20 0.00 -1.30 0.00 0.00 0.00 173.10 172.07 3k0f n THR 47 N -0.35 0.00 -2.28 0.90 -2.24 -1.25 -2.98 114.28 106.08 3k0f n THR 47 Ca -0.07 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.29 3k0f n THR 47 Cb 0.61 -1.28 -0.03 0.00 -2.10 0.00 0.00 70.33 67.53 3k0f n THR 47 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3k0f s SER 48 N -1.36 6.93 -0.50 3.42 0.15 -1.26 -3.56 113.70 117.52 3k0f s SER 48 Ca 0.00 2.18 0.00 0.00 0.70 0.00 0.00 55.95 58.83 3k0f s SER 48 Cb 0.00 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 3k0f s SER 48 CO 0.00 -0.59 0.00 0.61 1.20 0.00 0.00 173.24 174.46 3k0f n GLY 49 N 3.40 0.73 0.18 9.45 0.00 -1.26 -4.95 105.19 112.74 3k0f n GLY 49 Ca 0.11 -0.56 0.12 0.00 0.00 0.00 0.00 46.02 45.69 3k0f n GLY 49 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3k0f h THR 50 N 0.00 0.00 0.00 2.61 1.35 -1.92 -3.48 112.91 111.47 3k0f h THR 50 Ca -0.10 -0.83 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 3k0f h THR 50 Cb 0.39 1.79 0.00 0.00 -1.73 0.00 0.00 68.15 68.60 3k0f h THR 50 CO 0.14 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.02 3k0f n GLY 51 N 1.17 1.66 0.28 5.82 0.00 -1.26 -4.87 105.19 108.00 3k0f n GLY 51 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 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 0.23 -0.63 -0.07 1.61 1.57 -1.92 -0.09 116.57 117.28 3k0f h LYS 52 Ca 0.00 0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 3k0f h LYS 52 Cb 0.00 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 3k0f h LYS 52 CO 0.00 -0.42 0.00 1.15 -0.57 0.00 0.00 179.45 179.61 3k0f h THR 53 N -0.65 0.95 -0.27 -0.16 2.02 -1.97 -2.00 112.91 110.84 3k0f h THR 53 Ca -0.06 -0.01 0.06 0.00 0.77 0.00 0.00 66.41 67.17 3k0f h THR 53 Cb 0.50 0.92 -0.07 0.00 -1.74 0.00 0.00 68.15 67.77 3k0f h THR 53 CO 0.10 0.01 -0.16 0.25 0.37 0.00 0.00 175.52 176.08 3k0f h LEU 54 N 0.03 -0.54 -0.04 2.58 5.85 -1.96 0.63 115.31 121.86 3k0f h LEU 54 Ca 0.03 0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.91 3k0f h LEU 54 Cb 0.04 0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.29 3k0f h LEU 54 CO -0.05 -0.20 -0.35 0.15 -0.34 0.00 0.00 178.44 177.64 3k0f h PHE 55 N -0.14 -0.98 -0.45 1.25 3.57 -0.77 0.46 116.94 119.89 3k0f h PHE 55 Ca 0.15 0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 3k0f h PHE 55 Cb 0.36 0.44 -0.02 0.00 2.79 0.00 0.00 35.95 39.52 3k0f h PHE 55 CO -0.34 -0.44 0.20 0.66 -2.23 0.00 0.00 178.31 176.16 3k0f h SER 56 N -0.48 0.56 -0.17 0.41 4.64 -0.60 0.20 113.55 118.10 3k0f h SER 56 Ca 0.07 -0.05 -0.08 0.00 -0.47 0.00 0.00 61.79 61.26 3k0f h SER 56 Cb 0.59 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3k0f h SER 56 CO -0.31 0.49 -0.20 0.40 -0.87 0.00 0.00 176.83 176.35 3k0f h ILE 57 N 0.63 1.34 -0.48 0.95 1.08 0.11 -2.93 117.51 118.21 3k0f h ILE 57 Ca 0.16 -1.37 -0.03 0.00 -0.39 0.00 0.00 64.86 63.22 3k0f h ILE 57 Cb 0.09 1.84 -0.02 0.00 -3.07 0.00 0.00 36.82 35.66 3k0f h ILE 57 CO -0.02 0.41 0.18 -0.61 -0.69 0.00 0.00 178.15 177.43 3k0f h GLN 58 N 0.08 0.69 -0.85 2.37 4.15 0.31 -0.94 115.11 120.93 3k0f h GLN 58 Ca 0.02 -0.10 0.04 0.00 0.77 0.00 0.00 58.65 59.38 3k0f h GLN 58 Cb 0.74 -0.13 -0.05 0.00 0.21 0.00 0.00 27.48 28.26 3k0f h GLN 58 CO 0.05 0.58 0.56 0.35 -1.93 0.00 0.00 178.83 178.44 3k0f h PHE 59 N 0.69 1.01 0.22 3.99 3.57 -0.48 -0.80 116.94 125.14 3k0f h PHE 59 Ca 0.17 0.03 -0.35 0.00 3.53 0.00 0.00 57.97 61.34 3k0f h PHE 59 Cb 0.15 -0.34 0.02 0.00 2.79 0.00 0.00 35.95 38.58 3k0f h PHE 59 CO 0.01 0.58 -1.64 -0.07 -2.23 0.00 0.00 178.31 174.96 3k0f h LEU 60 N 1.04 0.72 0.75 0.59 3.38 -1.24 -3.18 115.31 117.38 3k0f h LEU 60 Ca 0.34 -0.93 -0.03 0.00 0.09 0.00 0.00 57.88 57.35 3k0f h LEU 60 Cb 0.06 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 3k0f h LEU 60 CO -0.11 1.76 -0.48 0.22 0.09 0.00 0.00 178.44 179.93 3k0f h TYR 61 N 0.12 -1.27 -0.92 1.13 3.20 -0.97 -1.67 116.97 116.58 3k0f h TYR 61 Ca -0.31 -0.01 0.18 0.00 3.14 0.00 0.00 58.73 61.73 3k0f h TYR 61 Cb 2.13 0.46 -0.08 0.00 1.54 0.00 0.00 36.73 40.78 3k0f h TYR 61 CO 0.11 -0.71 0.59 -0.91 -1.64 0.00 0.00 178.16 175.61 3k0f h ASN 62 N -1.16 0.59 0.65 -2.11 4.21 -1.32 0.52 115.58 116.96 3k0f h ASN 62 Ca -0.10 0.05 -0.04 0.00 1.21 0.00 0.00 56.30 57.43 3k0f h ASN 62 Cb 0.93 -0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 38.07 3k0f h ASN 62 CO 0.09 0.25 -0.17 1.23 -1.29 0.00 0.00 177.43 177.55 3k0f h GLY 63 N 0.59 0.00 0.11 2.83 0.00 -1.40 -0.84 103.07 104.36 3k0f h GLY 63 Ca 0.49 0.00 -0.24 0.00 0.00 0.00 0.00 47.33 47.58 3k0f h GLY 63 CO -0.23 0.00 -1.30 -2.22 0.00 0.00 0.00 176.54 172.79 3k0f h ILE 64 N 0.00 0.93 -0.19 2.60 2.04 0.80 0.13 117.51 123.83 3k0f h ILE 64 Ca -0.00 -2.22 -0.11 0.00 1.00 0.00 0.00 64.86 63.53 3k0f h ILE 64 Cb 0.54 2.34 -0.01 0.00 -0.74 0.00 0.00 36.82 38.95 3k0f h ILE 64 CO 0.02 0.42 -0.35 0.40 0.00 0.00 0.00 178.15 178.64 3k0f h ILE 65 N -0.83 1.29 0.00 -0.67 1.08 -0.75 -2.49 117.51 115.15 3k0f h ILE 65 Ca -0.34 -1.44 -0.37 0.00 -0.39 0.00 0.00 64.86 62.32 3k0f h ILE 65 Cb 1.41 1.54 -0.07 0.00 -3.07 0.00 0.00 36.82 36.63 3k0f h ILE 65 CO -0.15 0.45 -2.34 -0.62 -0.69 0.00 0.00 178.15 174.80 3k0f n GLU 66 N -4.06 0.68 0.00 2.37 -0.58 -0.32 -4.69 120.64 114.04 3k0f n GLU 66 Ca -0.01 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 3k0f n GLU 66 Cb 0.46 -1.55 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 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 -2.93 0.00 -3.82 -0.32 3.01 -1.16 -5.00 117.46 107.24 3k0f n PHE 67 Ca -0.35 -0.37 -0.27 0.00 1.01 0.00 0.00 57.45 57.47 3k0f n PHE 67 Cb 1.10 -0.04 0.04 0.00 -0.01 0.00 0.00 39.48 40.57 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 -0.37 -4.20 -4.40 4.37 4.64 -0.94 -4.94 116.55 110.72 3k0f n ASP 68 Ca 0.00 -0.75 -0.39 0.00 -1.38 0.00 0.00 54.79 52.26 3k0f n ASP 68 Cb 0.31 -4.10 -0.12 0.00 -1.04 0.00 0.00 41.12 36.17 3k0f n ASP 68 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 3k0f s GLU 69 N -6.42 3.06 0.69 -0.67 2.02 0.45 -4.96 118.70 112.86 3k0f s GLU 69 Ca 0.50 -0.91 -0.17 0.00 0.02 0.00 0.00 54.97 54.41 3k0f s GLU 69 Cb -0.25 -3.62 0.01 0.00 0.10 0.00 0.00 34.13 30.38 3k0f s GLU 69 CO 0.81 -0.56 1.27 -2.30 0.02 0.00 0.00 175.26 174.50 3k0f n PRO 70 N 4.97 0.86 -4.15 0.39 -0.02 -1.26 -3.67 135.00 132.12 3k0f n PRO 70 Ca -0.13 0.36 -0.16 0.00 -2.02 0.00 0.00 63.50 61.54 3k0f n PRO 70 Cb 0.47 -2.50 -0.12 0.00 -0.02 0.00 0.00 33.50 31.33 3k0f n PRO 70 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 3k0f s GLY 71 N -1.58 0.69 -0.11 -1.23 0.00 -0.29 -1.87 107.32 102.93 3k0f s GLY 71 Ca 0.80 -0.85 -0.01 0.00 0.00 0.00 0.00 44.72 44.67 3k0f s GLY 71 CO 0.43 -0.88 -0.09 0.14 0.00 0.00 0.00 173.10 172.70 3k0f s VAL 72 N -1.20 3.46 -0.24 1.40 1.01 -0.11 -1.93 120.40 122.78 3k0f s VAL 72 Ca -0.04 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.42 3k0f s VAL 72 Cb -0.09 -2.45 0.05 0.00 0.00 0.00 0.00 36.38 33.88 3k0f s VAL 72 CO 0.01 0.54 -0.12 0.12 0.00 0.00 0.00 175.10 175.66 3k0f s PHE 73 N -0.04 3.14 -0.27 5.22 5.36 -0.41 -1.08 117.98 129.89 3k0f s PHE 73 Ca -0.01 -2.08 -0.12 0.00 -0.96 0.00 0.00 56.93 53.76 3k0f s PHE 73 Cb -0.14 -1.95 -0.05 0.00 -0.34 0.00 0.00 43.02 40.55 3k0f s PHE 73 CO 0.03 -0.85 0.25 0.08 -1.46 0.00 0.00 175.22 173.28 3k0f s VAL 74 N 1.17 5.27 -0.11 3.12 1.01 -0.35 -0.14 120.40 130.36 3k0f s VAL 74 Ca -0.05 0.31 0.02 0.00 0.00 0.00 0.00 61.98 62.26 3k0f s VAL 74 Cb -0.18 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 3k0f s VAL 74 CO -0.06 0.22 -0.18 0.28 0.00 0.00 0.00 175.10 175.36 3k0f s THR 75 N 1.84 2.64 -0.15 3.92 -1.32 -1.10 -1.07 115.64 120.40 3k0f s THR 75 Ca 0.10 -0.81 0.17 0.00 -1.21 0.00 0.00 61.69 59.93 3k0f s THR 75 Cb -0.16 -2.07 -0.24 0.00 -1.51 0.00 0.00 72.50 68.52 3k0f s THR 75 CO 0.10 0.54 0.12 0.49 -2.21 0.00 0.00 174.62 173.67 3k0f n PHE 76 N 3.47 0.00 0.00 9.09 3.01 -1.15 -1.99 117.46 129.88 3k0f n PHE 76 Ca -0.18 0.00 -0.03 0.00 1.01 0.00 0.00 57.45 58.25 3k0f n PHE 76 Cb 0.53 -0.82 -0.01 0.00 -0.01 0.00 0.00 39.48 39.17 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 -2.59 0.15 -1.75 -1.08 2.13 -1.26 -3.82 120.64 112.42 3k0f n GLU 77 Ca -0.25 0.06 -0.42 0.00 0.66 0.00 0.00 57.16 57.21 3k0f n GLU 77 Cb 0.99 -0.70 -0.01 0.00 0.27 0.00 0.00 31.44 31.99 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 -3.58 2.60 -2.40 5.31 1.02 -1.26 -4.84 120.64 117.49 3k0f n GLU 78 Ca -0.04 0.92 -0.38 0.00 -0.02 0.00 0.00 57.16 57.64 3k0f n GLU 78 Cb 0.15 -2.66 -0.03 0.00 -0.02 0.00 0.00 31.44 28.88 3k0f n GLU 78 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3k0f s THR 79 N -0.47 3.38 0.57 2.62 2.01 -1.26 -4.85 115.64 117.63 3k0f s THR 79 Ca 0.60 1.14 0.27 0.00 0.31 0.00 0.00 61.69 64.01 3k0f s THR 79 Cb -0.51 -3.63 0.36 0.00 0.01 0.00 0.00 72.50 68.73 3k0f s THR 79 CO 0.55 0.09 2.07 -0.65 -0.69 0.00 0.00 174.62 175.99 3k0f h PRO 80 N 2.72 0.00 -0.12 4.92 0.11 -1.97 0.72 132.00 138.38 3k0f h PRO 80 Ca -0.48 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.43 3k0f h PRO 80 Cb 1.23 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.35 3k0f h PRO 80 CO 0.63 0.00 -0.69 1.96 -0.21 0.00 0.00 178.00 179.69 3k0f h GLN 81 N 0.00 0.67 -0.06 1.05 1.08 -1.99 -2.95 115.11 112.91 3k0f h GLN 81 Ca 0.13 -0.57 -0.01 0.00 -1.45 0.00 0.00 58.65 56.76 3k0f h GLN 81 Cb 0.61 0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 28.16 3k0f h GLN 81 CO -0.00 1.18 0.02 -0.44 -0.95 0.00 0.00 178.83 178.64 3k0f h ASP 82 N 0.34 0.10 -0.84 1.46 3.32 -1.31 0.35 116.42 119.84 3k0f h ASP 82 Ca -0.05 -0.21 0.21 0.00 0.02 0.00 0.00 57.03 56.99 3k0f h ASP 82 Cb 1.33 -0.03 -0.05 0.00 0.22 0.00 0.00 39.33 40.80 3k0f h ASP 82 CO 0.14 0.28 0.57 0.40 -1.72 0.00 0.00 179.24 178.92 3k0f h ILE 83 N -0.09 0.66 0.07 0.35 5.03 -1.11 0.27 117.51 122.68 3k0f h ILE 83 Ca 0.02 -0.08 -0.27 0.00 -0.12 0.00 0.00 64.86 64.41 3k0f h ILE 83 Cb 0.22 0.40 -0.02 0.00 -3.03 0.00 0.00 36.82 34.39 3k0f h ILE 83 CO -0.00 0.04 -1.35 0.40 -0.68 0.00 0.00 178.15 176.56 3k0f h ILE 84 N 0.24 1.34 -0.31 -0.67 2.04 -1.24 -3.00 117.51 115.90 3k0f h ILE 84 Ca 0.42 -3.02 -0.12 0.00 1.00 0.00 0.00 64.86 63.15 3k0f h ILE 84 Cb 1.28 2.77 -0.01 0.00 -0.74 0.00 0.00 36.82 40.12 3k0f h ILE 84 CO -0.10 0.83 -0.26 0.50 0.00 0.00 0.00 178.15 179.12 3k0f h LYS 85 N 0.04 0.72 -0.14 2.37 1.63 0.19 -3.28 116.57 118.10 3k0f h LYS 85 Ca -0.16 -0.36 -0.17 0.00 -0.85 0.00 0.00 60.65 59.11 3k0f h LYS 85 Cb 1.93 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 33.56 3k0f h LYS 85 CO 0.15 0.98 -0.63 -0.91 -3.45 0.00 0.00 179.45 175.59 3k0f h ASN 86 N 0.47 0.57 0.39 4.20 2.35 -0.71 -3.07 115.58 119.79 3k0f h ASN 86 Ca 0.05 -0.33 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 3k0f h ASN 86 Cb 0.83 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.03 3k0f h ASN 86 CO 0.07 1.05 0.00 0.00 -1.65 0.00 0.00 177.43 176.90 3k0f n ALA 87 N -2.52 1.38 0.87 -0.83 0.00 -1.13 -0.91 120.51 117.38 3k0f n ALA 87 Ca -0.04 0.12 0.11 0.00 0.00 0.00 0.00 53.44 53.63 3k0f n ALA 87 Cb 0.65 -1.34 0.50 0.00 0.00 0.00 0.00 19.45 19.27 3k0f n ALA 87 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3k0f n ARG 88 N -2.18 0.12 -0.18 0.00 1.74 -1.16 -2.14 116.66 112.86 3k0f n ARG 88 Ca 0.01 0.10 -0.02 0.00 -0.77 0.00 0.00 57.85 57.17 3k0f n ARG 88 Cb 0.14 -1.50 0.20 0.00 -1.02 0.00 0.00 32.46 30.27 3k0f n ARG 88 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3k0f h SER 89 N 0.00 0.85 -0.56 0.55 0.87 -1.21 -2.09 113.55 111.96 3k0f h SER 89 Ca 0.00 -0.10 -0.07 0.00 -1.23 0.00 0.00 61.79 60.39 3k0f h SER 89 Cb 0.32 -0.22 -0.04 0.00 -0.44 0.00 0.00 62.40 62.02 3k0f h SER 89 CO 0.00 0.74 0.08 0.49 -0.53 0.00 0.00 176.83 177.61 3k0f n PHE 90 N -4.33 1.97 -2.56 2.24 3.01 -1.02 -4.87 117.46 111.91 3k0f n PHE 90 Ca 0.06 -0.93 -0.13 0.00 1.01 0.00 0.00 57.45 57.46 3k0f n PHE 90 Cb 0.15 -0.53 0.01 0.00 -0.01 0.00 0.00 39.48 39.10 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 0.11 -0.04 3.48 1.37 0.00 -0.78 -4.79 105.19 104.53 3k0f n GLY 91 Ca 0.31 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.81 3.04 -1.15 1.61 0.51 -0.91 -5.00 118.94 114.24 3k0f s TRP 92 Ca 0.12 -0.36 -0.09 0.00 -2.12 0.00 0.00 56.10 53.65 3k0f s TRP 92 Cb -0.05 -2.03 0.25 0.00 -0.81 0.00 0.00 33.47 30.83 3k0f s TRP 92 CO 0.15 -0.13 1.35 -3.47 -0.51 0.00 0.00 176.95 174.35 3k0f n ASP 93 N 3.90 5.61 0.26 2.95 2.03 -1.26 -3.92 116.55 126.11 3k0f n ASP 93 Ca -0.17 -3.12 0.12 0.00 0.52 0.00 0.00 54.79 52.14 3k0f n ASP 93 Cb 0.52 -1.41 0.70 0.00 -0.72 0.00 0.00 41.12 40.21 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 7.21 0.00 -0.52 -2.67 3.38 -1.93 -2.45 115.31 118.32 3k0f h LEU 94 Ca 0.24 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.19 3k0f h LEU 94 Cb 0.79 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 3k0f h LEU 94 CO 1.21 0.13 0.24 0.00 0.09 0.00 0.00 178.44 180.10 3k0f h ALA 95 N 1.87 0.68 -0.28 1.53 0.00 -1.91 0.19 119.26 121.34 3k0f h ALA 95 Ca -0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3k0f h ALA 95 Cb 0.32 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3k0f h ALA 95 CO 0.02 0.26 0.05 -0.22 0.00 0.00 0.00 179.25 179.35 3k0f h LYS 96 N 0.70 0.40 0.03 0.00 3.64 -1.85 -0.60 116.57 118.89 3k0f h LYS 96 Ca 0.18 -0.06 -0.14 0.00 -1.27 0.00 0.00 60.65 59.36 3k0f h LYS 96 Cb 0.15 -0.07 0.01 0.00 -0.41 0.00 0.00 32.23 31.91 3k0f h LYS 96 CO -0.02 0.40 -0.57 -0.07 -2.27 0.00 0.00 179.45 176.92 3k0f h LEU 97 N 0.40 0.45 -1.33 5.20 3.38 -1.29 -0.70 115.31 121.42 3k0f h LEU 97 Ca 0.09 -0.81 0.12 0.00 0.09 0.00 0.00 57.88 57.38 3k0f h LEU 97 Cb 0.19 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.74 3k0f h LEU 97 CO -0.00 1.21 0.55 0.58 0.09 0.00 0.00 178.44 180.86 3k0f h VAL 98 N -0.26 0.88 0.08 1.22 2.07 -0.40 -0.75 116.25 119.09 3k0f h VAL 98 Ca -0.08 -0.24 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 3k0f h VAL 98 Cb 1.32 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 3k0f h VAL 98 CO 0.11 0.13 -0.04 -0.78 0.02 0.00 0.00 177.57 177.01 3k0f h ASP 99 N 0.69 -0.09 0.16 0.57 3.58 -1.05 -2.24 116.42 118.04 3k0f h ASP 99 Ca 0.41 -0.31 0.00 0.00 0.42 0.00 0.00 57.03 57.55 3k0f h ASP 99 Cb 0.62 0.02 0.00 0.00 1.72 0.00 0.00 39.33 41.69 3k0f h ASP 99 CO -0.17 0.27 0.00 -0.62 -2.88 0.00 0.00 179.24 175.84 3k0f n GLU 100 N -4.97 0.10 -1.76 0.28 1.02 -0.27 -4.80 120.64 110.23 3k0f n GLU 100 Ca -0.08 0.23 -0.06 0.00 -0.02 0.00 0.00 57.16 57.23 3k0f n GLU 100 Cb 0.21 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.12 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 -0.65 0.39 0.10 0.62 0.00 -0.40 -4.92 105.19 100.33 3k0f n GLY 101 Ca 0.03 -0.70 -0.12 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.02 0.67 -5.05 1.61 4.76 -0.56 -4.89 118.16 112.68 3k0f n LYS 102 Ca -0.06 0.18 -0.32 0.00 -2.87 0.00 0.00 58.31 55.23 3k0f n LYS 102 Cb 0.42 -1.67 -0.15 0.00 -1.84 0.00 0.00 35.03 31.79 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 -6.06 2.39 -0.13 -0.35 2.96 -1.17 -1.14 118.68 115.18 3k0f s LEU 103 Ca -0.12 -0.39 -0.01 0.00 -0.22 0.00 0.00 54.13 53.39 3k0f s LEU 103 Cb 0.07 -1.48 0.03 0.00 0.50 0.00 0.00 46.19 45.32 3k0f s LEU 103 CO 0.80 0.25 -0.05 0.12 -1.32 0.00 0.00 176.35 176.14 3k0f s PHE 104 N -0.15 1.42 -0.36 5.38 5.36 -0.81 -3.86 117.98 124.96 3k0f s PHE 104 Ca -0.03 -0.80 -0.18 0.00 -0.96 0.00 0.00 56.93 54.97 3k0f s PHE 104 Cb -0.14 -1.19 -0.00 0.00 -0.34 0.00 0.00 43.02 41.35 3k0f s PHE 104 CO 0.04 -0.53 0.48 0.42 -1.46 0.00 0.00 175.22 174.16 3k0f s ILE 105 N 1.73 5.04 -0.55 3.12 1.01 -1.26 -1.29 121.20 128.99 3k0f s ILE 105 Ca 0.03 0.18 -0.19 0.00 0.00 0.00 0.00 60.65 60.67 3k0f s ILE 105 Cb -0.14 -3.96 0.09 0.00 0.01 0.00 0.00 42.46 38.46 3k0f s ILE 105 CO -0.08 -0.24 0.65 -0.22 0.00 0.00 0.00 174.94 175.05 3k0f s LEU 106 N 2.31 5.28 -0.33 2.97 2.96 0.80 -4.96 118.68 127.72 3k0f s LEU 106 Ca 0.17 -1.25 -0.29 0.00 -0.22 0.00 0.00 54.13 52.53 3k0f s LEU 106 Cb -0.16 -2.34 0.01 0.00 0.50 0.00 0.00 46.19 44.20 3k0f s LEU 106 CO 0.13 -1.00 1.17 -0.62 -1.32 0.00 0.00 176.35 174.71 3k0f s ASP 107 N 3.23 6.80 -0.11 3.68 2.15 -1.26 -2.69 116.67 128.46 3k0f s ASP 107 Ca 0.12 1.04 0.15 0.00 0.43 0.00 0.00 52.55 54.29 3k0f s ASP 107 Cb -0.23 -2.54 0.25 0.00 -0.30 0.00 0.00 42.92 40.10 3k0f s ASP 107 CO 0.08 -1.00 1.13 0.00 -0.17 0.00 0.00 175.17 175.21 3k0f n ALA 108 N 7.27 2.29 -1.49 3.66 0.00 -0.84 -5.00 120.51 126.40 3k0f n ALA 108 Ca 0.13 -2.38 -0.32 0.00 0.00 0.00 0.00 53.44 50.87 3k0f n ALA 108 Cb 0.47 -0.40 0.05 0.00 0.00 0.00 0.00 19.45 19.57 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 -2.56 5.16 1.05 0.00 1.04 -1.19 -4.76 113.70 112.43 3k0f s SER 109 Ca 0.27 1.86 -0.15 0.00 0.48 0.00 0.00 55.95 58.41 3k0f s SER 109 Cb 0.24 -2.53 0.21 0.00 0.10 0.00 0.00 66.02 64.04 3k0f s SER 109 CO 0.02 -1.59 1.13 -2.84 0.98 0.00 0.00 173.24 170.93 3k0f s PRO 110 N -4.43 0.04 -0.12 4.02 0.02 -1.26 -5.04 135.00 128.23 3k0f s PRO 110 Ca 0.63 0.18 -0.07 0.00 0.02 0.00 0.00 61.00 61.77 3k0f s PRO 110 Cb -0.18 -1.72 -0.04 0.00 0.02 0.00 0.00 34.50 32.58 3k0f s PRO 110 CO 0.46 -2.92 0.13 0.34 -0.33 0.00 0.00 177.00 174.68 3k0f s ASP 111 N -3.85 6.30 0.00 2.53 2.15 -1.26 -4.95 116.67 117.58 3k0f s ASP 111 Ca 0.68 0.44 0.01 0.00 0.43 0.00 0.00 52.55 54.11 3k0f s ASP 111 Cb -0.14 -2.02 0.06 0.00 -0.30 0.00 0.00 42.92 40.52 3k0f s ASP 111 CO 0.56 0.40 0.42 -2.65 -0.17 0.00 0.00 175.17 173.73 3k0f n PRO 112 N 2.01 0.04 -1.13 4.34 -0.02 -1.26 -1.02 135.00 137.97 3k0f n PRO 112 Ca -0.20 0.00 0.02 0.00 -2.02 0.00 0.00 63.50 61.31 3k0f n PRO 112 Cb 0.55 -1.36 0.01 0.00 -0.02 0.00 0.00 33.50 32.68 3k0f n PRO 112 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3k0f n GLU 113 N -0.86 0.00 0.00 -0.52 1.02 -1.26 -5.14 120.64 113.88 3k0f n GLU 113 Ca 0.01 -1.62 0.00 0.00 -0.02 0.00 0.00 57.16 55.53 3k0f n GLU 113 Cb 0.00 -0.18 0.00 0.00 -0.02 0.00 0.00 31.44 31.25 3k0f n GLU 113 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3k0f n GLY 114 N 0.31 -2.23 0.00 0.62 0.00 -0.18 -5.12 105.19 98.58 3k0f n GLY 114 Ca 0.03 -1.47 0.00 0.00 0.00 0.00 0.00 46.02 44.59 3k0f n GLY 114 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k0f n GLN 115 N -1.24 0.00 -3.63 1.61 10.64 -1.26 -5.07 117.38 118.42 3k0f n GLN 115 Ca 0.00 0.00 -0.06 0.00 -1.83 0.00 0.00 57.00 55.11 3k0f n GLN 115 Cb 0.00 0.00 -0.06 0.00 -0.86 0.00 0.00 30.24 29.32 3k0f n GLN 115 CO 0.00 0.00 0.00 -2.00 -1.83 0.00 0.00 177.06 173.23 3k0f s GLU 116 N 3.18 0.32 0.00 2.61 -6.30 -1.26 -5.14 118.70 112.10 3k0f s GLU 116 Ca 0.00 0.25 0.00 0.00 -2.50 0.00 0.00 54.97 52.72 3k0f s GLU 116 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 34.13 34.28 3k0f s GLU 116 CO 0.00 -0.06 0.00 0.28 0.02 0.00 0.00 175.26 175.50 3k0f n VAL 117 N 1.44 -1.16 0.00 3.70 0.31 -1.26 -5.13 118.33 116.23 3k0f n VAL 117 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 3k0f n VAL 117 Cb 0.57 -1.54 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 3k0f n VAL 117 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 3k0f n VAL 118 N 1.26 0.00 -1.68 2.52 3.14 -1.26 -5.09 118.33 117.22 3k0f n VAL 118 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 3k0f n VAL 118 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 3k0f n VAL 118 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3k0f n GLY 119 N 0.00 -0.41 1.34 7.55 0.00 -1.26 -4.83 105.19 107.58 3k0f n GLY 119 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 -0.04 0.23 -0.02 0.00 -1.26 -4.42 105.19 99.67 3k0f n GLY 120 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 3k0f n GLY 120 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3k0f h PHE 121 N 0.00 0.00 0.00 1.61 -0.00 -1.98 0.25 116.94 116.82 3k0f h PHE 121 Ca 0.00 0.00 -0.07 0.00 -0.00 0.00 0.00 57.97 57.90 3k0f h PHE 121 Cb 0.45 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.39 3k0f h PHE 121 CO 0.00 0.00 -0.32 0.38 -0.00 0.00 0.00 178.31 178.37 3k0f h ASP 122 N 0.00 0.00 1.39 0.41 -0.00 -1.88 0.68 116.42 117.03 3k0f h ASP 122 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 57.03 3k0f h ASP 122 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.02 3k0f h ASP 122 CO 0.00 0.32 0.00 0.25 -0.00 0.00 0.00 179.24 179.81 3k0f h LEU 123 N 0.00 0.00 0.00 0.15 7.12 -1.17 2.04 115.31 123.45 3k0f h LEU 123 Ca -0.00 0.00 -0.37 0.00 0.13 0.00 0.00 57.88 57.64 3k0f h LEU 123 Cb 1.21 0.00 -0.07 0.00 -0.53 0.00 0.00 40.66 41.27 3k0f h LEU 123 CO 0.04 0.00 -2.38 -1.20 -0.13 0.00 0.00 178.44 174.77 3k0f n SER 124 N -2.72 0.13 0.09 1.25 7.64 -0.85 -3.28 113.62 115.88 3k0f n SER 124 Ca 0.03 0.00 -0.08 0.00 1.01 0.00 0.00 58.87 59.84 3k0f n SER 124 Cb 0.39 0.90 -0.03 0.00 -1.01 0.00 0.00 64.21 64.46 3k0f n SER 124 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k0f h ALA 125 N 0.95 0.50 0.33 -0.43 0.00 0.71 -2.58 119.26 118.74 3k0f h ALA 125 Ca -0.54 -0.77 -0.02 0.00 0.00 0.00 0.00 54.91 53.58 3k0f h ALA 125 Cb 2.23 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.92 3k0f h ALA 125 CO 0.03 1.00 -0.16 1.25 0.00 0.00 0.00 179.25 181.36 3k0f h LEU 126 N 0.06 -0.38 -0.82 0.00 5.85 0.31 0.18 115.31 120.51 3k0f h LEU 126 Ca -0.04 -0.17 0.15 0.00 0.84 0.00 0.00 57.88 58.66 3k0f h LEU 126 Cb 1.57 0.10 -0.15 0.00 0.37 0.00 0.00 40.66 42.55 3k0f h LEU 126 CO 0.13 0.04 -0.30 0.40 -0.34 0.00 0.00 178.44 178.37 3k0f h ILE 127 N -0.88 0.11 -0.26 4.05 1.08 -1.60 0.68 117.51 120.69 3k0f h ILE 127 Ca -0.05 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.33 3k0f h ILE 127 Cb 0.53 0.11 -0.01 0.00 -3.07 0.00 0.00 36.82 34.37 3k0f h ILE 127 CO 0.08 0.00 -0.25 -0.33 -0.69 0.00 0.00 178.15 176.96 3k0f h GLU 128 N -0.05 0.49 0.06 2.37 5.08 -1.39 0.46 114.58 121.60 3k0f h GLU 128 Ca 0.34 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3k0f h GLU 128 Cb 0.60 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.82 3k0f h GLU 128 CO -0.86 0.70 -0.03 0.00 -1.00 0.00 0.00 179.01 177.83 3k0f h ARG 129 N 0.44 -0.08 -0.44 2.33 3.08 0.29 -1.55 114.38 118.44 3k0f h ARG 129 Ca 0.06 0.01 0.04 0.00 0.07 0.00 0.00 59.98 60.16 3k0f h ARG 129 Cb 0.67 0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.69 3k0f h ARG 129 CO 0.05 0.13 0.21 0.82 -1.07 0.00 0.00 179.97 180.11 3k0f h ILE 130 N -0.28 0.96 -0.97 2.04 2.04 0.29 -1.01 117.51 120.58 3k0f h ILE 130 Ca -0.01 -0.15 0.04 0.00 1.00 0.00 0.00 64.86 65.75 3k0f h ILE 130 Cb 0.24 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 36.76 3k0f h ILE 130 CO 0.01 0.08 0.63 -1.13 0.00 0.00 0.00 178.15 177.74 3k0f h ASN 131 N 0.43 1.04 -0.01 1.72 -1.24 -0.80 0.10 115.58 116.83 3k0f h ASN 131 Ca 0.19 -0.01 -0.00 0.00 0.71 0.00 0.00 56.30 57.20 3k0f h ASN 131 Cb 0.11 -0.23 -0.00 0.00 0.73 0.00 0.00 38.32 38.92 3k0f h ASN 131 CO -0.14 0.70 0.01 0.22 -1.29 0.00 0.00 177.43 176.93 3k0f h TYR 132 N 1.21 0.01 -0.77 0.67 3.20 -0.52 -0.43 116.97 120.34 3k0f h TYR 132 Ca 0.39 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 62.24 3k0f h TYR 132 Cb 0.03 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.26 3k0f h TYR 132 CO -0.01 0.04 0.37 0.00 -1.64 0.00 0.00 178.16 176.93 3k0f h ALA 133 N 0.97 0.99 -0.24 1.82 0.00 -0.56 0.13 119.26 122.37 3k0f h ALA 133 Ca 0.00 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 3k0f h ALA 133 Cb 0.03 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3k0f h ALA 133 CO -0.00 0.55 0.09 0.82 0.00 0.00 0.00 179.25 180.70 3k0f h ILE 134 N 1.08 1.18 -0.67 0.00 2.04 -0.64 -0.67 117.51 119.83 3k0f h ILE 134 Ca 0.26 -0.56 -0.06 0.00 1.00 0.00 0.00 64.86 65.50 3k0f h ILE 134 Cb 0.11 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 3k0f h ILE 134 CO -0.03 0.18 0.17 1.56 0.00 0.00 0.00 178.15 180.03 3k0f h GLN 135 N 0.23 1.06 -0.01 2.37 4.20 -0.83 0.41 115.11 122.53 3k0f h GLN 135 Ca 0.08 -0.25 -0.00 0.00 0.06 0.00 0.00 58.65 58.54 3k0f h GLN 135 Cb 0.20 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 3k0f h GLN 135 CO -0.00 0.94 -0.00 -0.22 -0.67 0.00 0.00 178.83 178.88 3k0f h LYS 136 N 0.99 0.01 -0.19 1.46 3.64 -0.55 -3.08 116.57 118.85 3k0f h LYS 136 Ca 0.21 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.59 3k0f h LYS 136 Cb 0.35 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3k0f h LYS 136 CO 0.00 0.36 0.00 0.66 -2.27 0.00 0.00 179.45 178.20 3k0f n TYR 137 N -4.91 0.24 -3.77 1.91 4.02 -0.27 -4.94 117.16 109.44 3k0f n TYR 137 Ca -0.08 -0.12 -0.34 0.00 -0.01 0.00 0.00 57.90 57.35 3k0f n TYR 137 Cb 0.19 0.00 0.03 0.00 -0.02 0.00 0.00 39.34 39.55 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 0.28 -1.19 -3.00 -0.72 1.74 0.13 -4.69 116.66 109.20 3k0f n ARG 138 Ca 0.15 0.38 -0.39 0.00 -0.77 0.00 0.00 57.85 57.22 3k0f n ARG 138 Cb 0.30 -3.86 -0.06 0.00 -1.02 0.00 0.00 32.46 27.82 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 -3.51 3.43 -0.08 7.54 0.00 -0.18 -4.31 121.76 124.64 3k0f s ALA 139 Ca 0.44 0.33 0.10 0.00 0.00 0.00 0.00 51.96 52.83 3k0f s ALA 139 Cb -0.18 -2.94 -0.15 0.00 0.00 0.00 0.00 23.12 19.86 3k0f s ALA 139 CO 0.88 0.30 0.25 0.54 0.00 0.00 0.00 175.76 177.73 3k0f n ARG 140 N 1.36 0.80 -4.43 0.00 5.12 -0.78 -4.89 116.66 113.83 3k0f n ARG 140 Ca -0.05 -0.08 -0.20 0.00 -1.93 0.00 0.00 57.85 55.59 3k0f n ARG 140 Cb 0.49 -1.20 -0.15 0.00 -1.16 0.00 0.00 32.46 30.44 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 -2.58 0.95 -0.04 5.56 0.52 -1.20 -2.95 118.95 119.20 3k0f s ARG 141 Ca -0.03 -0.34 0.03 0.00 -0.52 0.00 0.00 55.73 54.87 3k0f s ARG 141 Cb 0.07 -0.89 0.00 0.00 0.52 0.00 0.00 34.95 34.64 3k0f s ARG 141 CO 0.41 0.16 -0.13 0.08 0.02 0.00 0.00 175.30 175.84 3k0f s VAL 142 N 0.03 1.11 -0.03 3.52 1.01 -0.77 -0.93 120.40 124.33 3k0f s VAL 142 Ca -0.01 -0.52 0.06 0.00 0.00 0.00 0.00 61.98 61.52 3k0f s VAL 142 Cb -0.07 -0.98 -0.02 0.00 0.00 0.00 0.00 36.38 35.31 3k0f s VAL 142 CO 0.00 0.33 -0.23 -0.44 0.00 0.00 0.00 175.10 174.77 3k0f s SER 143 N 0.27 3.32 -0.28 3.32 0.01 -0.24 -1.09 113.70 119.00 3k0f s SER 143 Ca -0.06 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 56.80 3k0f s SER 143 Cb -0.12 -0.56 0.08 0.00 0.21 0.00 0.00 66.02 65.63 3k0f s SER 143 CO 0.02 0.31 0.01 -0.63 0.41 0.00 0.00 173.24 173.36 3k0f s ILE 144 N -0.56 1.56 -0.32 1.44 1.01 0.15 -1.21 121.20 123.27 3k0f s ILE 144 Ca 0.08 -1.57 -0.18 0.00 0.00 0.00 0.00 60.65 58.98 3k0f s ILE 144 Cb -0.11 -2.00 -0.01 0.00 0.01 0.00 0.00 42.46 40.35 3k0f s ILE 144 CO 0.00 -0.38 0.54 -0.62 0.00 0.00 0.00 174.94 174.48 3k0f s ASP 145 N 1.32 6.37 -0.53 3.58 3.68 -0.23 -0.23 116.67 130.63 3k0f s ASP 145 Ca 0.03 0.17 -0.03 0.00 2.13 0.00 0.00 52.55 54.85 3k0f s ASP 145 Cb -0.18 -2.28 -0.03 0.00 -1.45 0.00 0.00 42.92 38.97 3k0f s ASP 145 CO -0.11 -0.44 0.47 -1.54 0.13 0.00 0.00 175.17 173.67 3k0f n SER 146 N 5.74 -4.09 -0.15 -0.34 3.41 -1.24 -2.95 113.62 113.99 3k0f n SER 146 Ca -0.04 -0.35 -0.04 0.00 -0.26 0.00 0.00 58.87 58.18 3k0f n SER 146 Cb 0.49 -2.86 0.16 0.00 -0.26 0.00 0.00 64.21 61.74 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 -0.58 1.24 -0.79 -3.33 -1.51 -1.76 -2.71 116.25 106.80 3k0f h VAL 147 Ca -0.30 -0.89 0.17 0.00 -1.23 0.00 0.00 66.70 64.45 3k0f h VAL 147 Cb 1.16 0.69 -0.11 0.00 -2.13 0.00 0.00 31.29 30.89 3k0f h VAL 147 CO 0.22 0.33 0.27 0.74 -1.23 0.00 0.00 177.57 177.90 3k0f h THR 148 N 0.84 0.53 -0.22 7.19 2.02 -1.92 -1.55 112.91 119.80 3k0f h THR 148 Ca 0.18 -0.12 0.07 0.00 0.77 0.00 0.00 66.41 67.30 3k0f h THR 148 Cb 0.34 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.89 3k0f h THR 148 CO 0.00 0.06 0.32 0.77 0.37 0.00 0.00 175.52 177.05 3k0f h SER 149 N 0.35 0.00 0.02 4.18 4.64 -1.86 -2.41 113.55 118.47 3k0f h SER 149 Ca 0.46 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.59 3k0f h SER 149 Cb 0.79 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.90 3k0f h SER 149 CO -0.49 0.00 -0.76 1.62 -0.87 0.00 0.00 176.83 176.32 3k0f h VAL 150 N 0.00 1.39 0.00 0.95 3.04 -1.43 -3.02 116.25 117.18 3k0f h VAL 150 Ca 0.11 -2.19 0.00 0.00 -1.01 0.00 0.00 66.70 63.61 3k0f h VAL 150 Cb 0.75 2.62 0.00 0.00 -2.01 0.00 0.00 31.29 32.65 3k0f h VAL 150 CO -0.00 0.65 0.00 0.49 -1.01 0.00 0.00 177.57 177.69 3k0f n PHE 151 N -4.10 0.00 0.46 3.17 3.01 -0.99 -3.21 117.46 115.79 3k0f n PHE 151 Ca -0.11 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.35 3k0f n PHE 151 Cb 0.75 -0.46 0.00 0.00 -0.01 0.00 0.00 39.48 39.77 3k0f n PHE 151 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3k0f n GLN 152 N -1.46 0.64 -0.09 -1.08 1.13 -0.94 -2.32 117.38 113.26 3k0f n GLN 152 Ca 0.07 0.00 -0.11 0.00 -1.94 0.00 0.00 57.00 55.02 3k0f n GLN 152 Cb 0.27 -1.18 -0.10 0.00 0.11 0.00 0.00 30.24 29.34 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 0.87 0.95 0.00 -1.09 6.02 -1.20 -4.98 117.38 117.95 3k0f n GLN 153 Ca 0.00 0.06 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 3k0f n GLN 153 Cb 0.32 -1.38 0.00 0.00 1.02 0.00 0.00 30.24 30.20 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 -2.84 0.00 -4.31 1.08 0.18 -0.98 -5.03 117.16 105.26 3k0f n TYR 154 Ca -0.30 0.00 -0.16 0.00 1.88 0.00 0.00 57.90 59.32 3k0f n TYR 154 Cb 0.92 0.00 -0.10 0.00 -0.38 0.00 0.00 39.34 39.77 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 1.56 0.21 9.48 1.01 -1.12 -5.13 116.67 122.68 3k0f s ASP 155 Ca 0.00 -1.26 0.10 0.00 0.71 0.00 0.00 52.55 52.11 3k0f s ASP 155 Cb 0.00 0.07 -0.05 0.00 1.01 0.00 0.00 42.92 43.95 3k0f s ASP 155 CO 0.00 -0.58 -0.21 0.00 0.21 0.00 0.00 175.17 174.59 3k0f s ALA 156 N -3.55 2.40 0.23 5.23 0.00 -1.26 -5.02 121.76 119.79 3k0f s ALA 156 Ca 0.30 -1.66 -0.04 0.00 0.00 0.00 0.00 51.96 50.56 3k0f s ALA 156 Cb 0.06 -0.25 0.45 0.00 0.00 0.00 0.00 23.12 23.38 3k0f s ALA 156 CO 0.09 0.31 1.26 -1.13 0.00 0.00 0.00 175.76 176.29 3k0f n SER 157 N -0.01 -0.22 0.03 0.00 3.41 -1.26 -0.69 113.62 114.88 3k0f n SER 157 Ca -0.10 1.38 0.00 0.00 -0.26 0.00 0.00 58.87 59.89 3k0f n SER 157 Cb 0.58 -0.45 0.32 0.00 -0.26 0.00 0.00 64.21 64.40 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 0.41 -0.10 4.04 4.64 -1.97 -0.58 113.55 120.00 3k0f h SER 158 Ca 0.42 -0.08 -0.20 0.00 -0.47 0.00 0.00 61.79 61.45 3k0f h SER 158 Cb 0.73 -0.11 0.01 0.00 -0.31 0.00 0.00 62.40 62.72 3k0f h SER 158 CO -0.80 0.52 -0.74 0.58 -0.87 0.00 0.00 176.83 175.52 3k0f h VAL 159 N 0.42 1.31 0.03 0.95 2.07 -1.32 -3.06 116.25 116.65 3k0f h VAL 159 Ca 0.09 -1.99 -0.00 0.00 0.82 0.00 0.00 66.70 65.61 3k0f h VAL 159 Cb 0.36 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 32.30 3k0f h VAL 159 CO 0.02 0.62 -0.01 0.58 0.02 0.00 0.00 177.57 178.79 3k0f h VAL 160 N 0.34 1.02 -0.60 2.57 2.07 -1.22 -1.78 116.25 118.64 3k0f h VAL 160 Ca -0.07 -0.13 0.10 0.00 0.82 0.00 0.00 66.70 67.43 3k0f h VAL 160 Cb 1.39 1.10 -0.08 0.00 -1.52 0.00 0.00 31.29 32.18 3k0f h VAL 160 CO 0.15 0.03 0.19 -0.09 0.02 0.00 0.00 177.57 177.87 3k0f h ARG 161 N -0.09 0.33 0.10 1.57 2.43 -1.15 0.32 114.38 117.89 3k0f h ARG 161 Ca -0.00 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3k0f h ARG 161 Cb 0.08 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.56 3k0f h ARG 161 CO 0.01 0.22 -0.05 0.00 -1.51 0.00 0.00 179.97 178.64 3k0f h ARG 162 N 0.34 -0.13 -0.68 0.20 3.08 -1.40 -1.02 114.38 114.77 3k0f h ARG 162 Ca 0.31 0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.31 3k0f h ARG 162 Cb 0.42 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.47 3k0f h ARG 162 CO -0.35 -0.02 0.21 0.93 -1.07 0.00 0.00 179.97 179.68 3k0f h GLU 163 N -0.21 1.05 0.09 0.04 4.39 -0.84 -0.99 114.58 118.12 3k0f h GLU 163 Ca -0.01 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.47 3k0f h GLU 163 Cb 0.17 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 3k0f h GLU 163 CO 0.02 0.90 -0.05 -0.07 -1.16 0.00 0.00 179.01 178.65 3k0f h LEU 164 N 1.01 -0.11 0.15 1.33 3.38 -0.88 -1.80 115.31 118.39 3k0f h LEU 164 Ca 0.22 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 58.02 3k0f h LEU 164 Cb 0.28 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 3k0f h LEU 164 CO -0.01 0.13 -0.45 0.15 0.09 0.00 0.00 178.44 178.35 3k0f h PHE 165 N -0.35 -1.27 -0.47 1.13 3.57 -1.02 0.48 116.94 119.01 3k0f h PHE 165 Ca -0.01 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.59 3k0f h PHE 165 Cb 0.29 0.54 -0.10 0.00 2.79 0.00 0.00 35.95 39.47 3k0f h PHE 165 CO -0.00 -0.55 -0.44 -0.09 -2.23 0.00 0.00 178.31 175.00 3k0f h ARG 166 N -0.70 -0.28 0.12 1.11 2.43 -1.16 0.61 114.38 116.50 3k0f h ARG 166 Ca 0.01 0.02 0.02 0.00 -0.81 0.00 0.00 59.98 59.22 3k0f h ARG 166 Cb 0.71 0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 30.28 3k0f h ARG 166 CO -0.24 -0.19 -0.48 1.25 -1.51 0.00 0.00 179.97 178.81 3k0f h LEU 167 N -0.29 -1.42 -0.59 3.80 5.85 -0.80 -1.29 115.31 120.56 3k0f h LEU 167 Ca 0.15 0.15 0.10 0.00 0.84 0.00 0.00 57.88 59.12 3k0f h LEU 167 Cb 0.58 0.53 -0.08 0.00 0.37 0.00 0.00 40.66 42.06 3k0f h LEU 167 CO -0.62 -0.53 0.18 0.58 -0.34 0.00 0.00 178.44 177.72 3k0f h VAL 168 N -0.71 0.73 -0.29 1.05 2.07 -0.35 -1.60 116.25 117.15 3k0f h VAL 168 Ca 0.01 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 3k0f h VAL 168 Cb 0.73 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 3k0f h VAL 168 CO -0.27 0.06 0.07 0.00 0.02 0.00 0.00 177.57 177.45 3k0f h ALA 169 N 1.43 1.59 0.00 1.67 0.00 0.71 -0.25 119.26 124.42 3k0f h ALA 169 Ca 0.30 -0.12 -0.27 0.00 0.00 0.00 0.00 54.91 54.83 3k0f h ALA 169 Cb 0.40 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.09 3k0f h ALA 169 CO -0.34 0.31 -1.05 0.00 0.00 0.00 0.00 179.25 178.17 3k0f h ARG 170 N 0.41 0.69 -0.26 0.00 2.47 -0.66 -2.65 114.38 114.38 3k0f h ARG 170 Ca 0.10 -0.75 0.02 0.00 -1.26 0.00 0.00 59.98 58.09 3k0f h ARG 170 Cb 0.16 0.22 -0.02 0.00 -1.65 0.00 0.00 29.97 28.67 3k0f h ARG 170 CO -0.00 1.33 0.11 -0.07 0.56 0.00 0.00 179.97 181.89 3k0f h LEU 171 N 0.39 0.14 -0.41 3.04 3.38 -0.83 0.11 115.31 121.13 3k0f h LEU 171 Ca -0.13 0.02 0.07 0.00 0.09 0.00 0.00 57.88 57.93 3k0f h LEU 171 Cb 1.70 -0.00 -0.06 0.00 0.09 0.00 0.00 40.66 42.39 3k0f h LEU 171 CO 0.21 0.11 0.05 0.50 0.09 0.00 0.00 178.44 179.40 3k0f h LYS 172 N 0.23 0.16 0.09 1.13 3.64 -1.05 -1.98 116.57 118.79 3k0f h LYS 172 Ca 0.11 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 3k0f h LYS 172 Cb 0.06 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 3k0f h LYS 172 CO -0.10 0.11 -0.12 1.96 -2.27 0.00 0.00 179.45 179.02 3k0f h GLN 173 N 0.17 -0.24 0.00 1.90 4.20 -0.97 -1.00 115.11 119.16 3k0f h GLN 173 Ca 0.20 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.93 3k0f h GLN 173 Cb 0.26 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.10 3k0f h GLN 173 CO -0.29 -0.16 0.13 -0.89 -0.67 0.00 0.00 178.83 176.95 3k0f n ILE 174 N -5.25 1.32 0.00 2.54 2.08 0.30 -4.80 119.36 115.56 3k0f n ILE 174 Ca -0.07 0.58 0.00 0.00 0.56 0.00 0.00 62.75 63.82 3k0f n ILE 174 Cb 0.17 -1.58 0.00 0.00 -0.75 0.00 0.00 39.64 37.48 3k0f n ILE 174 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3k0f n GLY 175 N -1.36 2.47 3.72 7.39 0.00 -0.38 -5.04 105.19 111.99 3k0f n GLY 175 Ca -0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3k0f n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k0f n ALA 176 N -1.17 1.72 -2.61 4.61 0.00 -1.15 -3.80 120.51 118.12 3k0f n ALA 176 Ca 0.00 0.37 -0.44 0.00 0.00 0.00 0.00 53.44 53.37 3k0f n ALA 176 Cb 0.00 -2.33 -0.09 0.00 0.00 0.00 0.00 19.45 17.03 3k0f n ALA 176 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3k0f s THR 177 N -0.68 5.21 0.09 0.00 2.01 -1.15 -3.98 115.64 117.14 3k0f s THR 177 Ca 0.59 -0.74 0.02 0.00 0.31 0.00 0.00 61.69 61.87 3k0f s THR 177 Cb -0.55 -4.03 -0.04 0.00 0.01 0.00 0.00 72.50 67.89 3k0f s THR 177 CO 0.57 -0.44 0.16 -0.89 -0.69 0.00 0.00 174.62 173.34 3k0f s THR 178 N 1.77 4.95 -0.06 -0.82 2.01 -0.59 -1.85 115.64 121.04 3k0f s THR 178 Ca 0.06 -0.66 0.03 0.00 0.31 0.00 0.00 61.69 61.43 3k0f s THR 178 Cb -0.20 -3.44 0.01 0.00 0.01 0.00 0.00 72.50 68.88 3k0f s THR 178 CO 0.09 0.07 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.27 3k0f s VAL 179 N -1.53 1.16 -0.08 3.82 1.01 -0.25 -0.72 120.40 123.81 3k0f s VAL 179 Ca 0.32 -0.51 0.02 0.00 0.00 0.00 0.00 61.98 61.81 3k0f s VAL 179 Cb -0.12 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.22 3k0f s VAL 179 CO 0.25 0.36 -0.15 -0.04 0.00 0.00 0.00 175.10 175.52 3k0f s MET 180 N 0.52 2.02 0.31 2.72 -1.94 0.84 0.34 119.30 124.12 3k0f s MET 180 Ca -0.12 -0.51 -0.15 0.00 -1.71 0.00 0.00 55.69 53.20 3k0f s MET 180 Cb -0.15 -1.66 -0.09 0.00 2.01 0.00 0.00 34.83 34.95 3k0f s MET 180 CO 0.03 0.02 0.72 0.99 -0.01 0.00 0.00 175.02 176.77 3k0f s THR 181 N 0.73 4.70 0.06 2.05 2.01 0.68 -0.79 115.64 125.08 3k0f s THR 181 Ca -0.13 0.91 -0.14 0.00 0.31 0.00 0.00 61.69 62.65 3k0f s THR 181 Cb -0.16 -3.62 0.02 0.00 0.01 0.00 0.00 72.50 68.75 3k0f s THR 181 CO 0.03 -0.16 0.32 -0.89 -0.69 0.00 0.00 174.62 173.23 3k0f s THR 182 N -1.95 0.09 0.41 -0.82 2.01 -0.94 -3.16 115.64 111.27 3k0f s THR 182 Ca 0.53 -0.70 0.08 0.00 0.31 0.00 0.00 61.69 61.90 3k0f s THR 182 Cb -0.11 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.33 3k0f s THR 182 CO 0.18 -0.39 0.22 -1.83 -0.69 0.00 0.00 174.62 172.11 3k0f s GLU 183 N -2.91 2.31 0.01 4.92 -1.05 -1.26 -2.02 118.70 118.69 3k0f s GLU 183 Ca -0.02 -1.74 -0.28 0.00 -0.15 0.00 0.00 54.97 52.77 3k0f s GLU 183 Cb 0.00 -2.10 0.08 0.00 -0.44 0.00 0.00 34.13 31.68 3k0f s GLU 183 CO -0.06 -0.11 0.71 -0.98 0.95 0.00 0.00 175.26 175.77 3k0f s ARG 184 N -3.95 1.05 -0.10 -4.83 1.70 -1.16 -2.06 118.95 109.61 3k0f s ARG 184 Ca 0.42 -0.03 0.20 0.00 -0.47 0.00 0.00 55.73 55.86 3k0f s ARG 184 Cb 0.02 0.49 -0.30 0.00 -0.57 0.00 0.00 34.95 34.59 3k0f s ARG 184 CO 0.24 -0.39 0.31 0.44 -1.08 0.00 0.00 175.30 174.82 3k0f n ILE 185 N 0.39 0.57 -4.84 4.99 -0.00 -1.26 -4.13 119.36 115.07 3k0f n ILE 185 Ca -0.16 -0.64 -0.33 0.00 -0.00 0.00 0.00 62.75 61.62 3k0f n ILE 185 Cb 0.60 -0.19 -0.13 0.00 -0.00 0.00 0.00 39.64 39.92 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 -3.08 2.57 0.41 6.28 -6.30 -1.26 -5.01 118.70 112.32 3k0f s GLU 186 Ca -0.09 -0.67 0.19 0.00 -2.50 0.00 0.00 54.97 51.90 3k0f s GLU 186 Cb 0.11 -2.42 0.90 0.00 0.00 0.00 0.00 34.13 32.72 3k0f s GLU 186 CO 0.86 0.62 1.86 1.49 0.02 0.00 0.00 175.26 180.11 3k0f h GLU 187 N 5.37 0.00 0.00 4.30 4.57 -1.93 -3.31 114.58 123.58 3k0f h GLU 187 Ca -0.46 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.72 3k0f h GLU 187 Cb 1.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 3k0f h GLU 187 CO 0.51 0.30 0.00 0.66 -1.18 0.00 0.00 179.01 179.30 3k0f n TYR 188 N -3.73 0.00 0.00 0.92 4.02 -1.26 -4.98 117.16 112.13 3k0f n TYR 188 Ca -0.01 -0.02 0.00 0.00 -0.01 0.00 0.00 57.90 57.86 3k0f n TYR 188 Cb 0.40 -0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.72 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 -0.02 0.86 3.74 2.72 0.00 -1.25 -4.98 105.19 106.27 3k0f n GLY 189 Ca 0.00 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.48 3k0f n GLY 189 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k0f s PRO 190 N 0.47 2.84 0.06 1.61 0.04 -1.26 -4.94 135.00 133.82 3k0f s PRO 190 Ca 0.00 1.95 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 3k0f s PRO 190 Cb 0.00 -1.94 -0.18 0.00 0.04 0.00 0.00 34.50 32.43 3k0f s PRO 190 CO 0.00 -1.34 1.56 0.82 0.04 0.00 0.00 177.00 178.08 3k0f h ILE 191 N 0.83 0.50 -1.94 0.56 5.03 -1.93 -3.46 117.51 117.09 3k0f h ILE 191 Ca -0.51 -0.12 -0.58 0.00 -0.12 0.00 0.00 64.86 63.54 3k0f h ILE 191 Cb 1.31 0.55 -0.13 0.00 -3.03 0.00 0.00 36.82 35.52 3k0f h ILE 191 CO 0.55 0.02 -0.57 0.00 -0.68 0.00 0.00 178.15 177.46 3k0f s ALA 192 N -5.82 3.05 0.03 1.87 0.00 -1.26 -4.71 121.76 114.92 3k0f s ALA 192 Ca -0.16 -1.70 -0.09 0.00 0.00 0.00 0.00 51.96 50.01 3k0f s ALA 192 Cb 0.04 0.39 -0.03 0.00 0.00 0.00 0.00 23.12 23.51 3k0f s ALA 192 CO 0.61 -0.20 1.14 0.00 0.00 0.00 0.00 175.76 177.31 3k0f h ARG 193 N 1.81 -0.14 -0.80 0.00 3.08 -1.74 -2.88 114.38 113.70 3k0f h ARG 193 Ca -0.42 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.64 3k0f h ARG 193 Cb 1.26 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.34 3k0f h ARG 193 CO 0.72 -0.09 0.00 0.66 -1.07 0.00 0.00 179.97 180.19 3k0f n TYR 194 N -3.33 0.00 -3.83 3.04 4.02 -1.26 -4.87 117.16 110.93 3k0f n TYR 194 Ca -0.01 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.57 3k0f n TYR 194 Cb 0.10 -0.08 -0.06 0.00 -0.02 0.00 0.00 39.34 39.27 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 0.09 -0.25 0.00 2.72 0.00 -1.09 -4.62 105.19 102.04 3k0f n GLY 195 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -3.32 0.00 -0.10 1.61 0.31 -1.26 -4.85 118.33 110.71 3k0f n VAL 196 Ca 0.01 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.35 3k0f n VAL 196 Cb 0.39 -0.17 0.29 0.00 -0.91 0.00 0.00 33.84 33.44 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 0.75 -0.60 5.55 3.07 -1.93 -3.01 114.58 118.42 3k0f h GLU 197 Ca 0.00 -0.08 0.12 0.00 -0.50 0.00 0.00 59.36 58.90 3k0f h GLU 197 Cb 0.18 -0.15 -0.11 0.00 -0.84 0.00 0.00 28.75 27.83 3k0f h GLU 197 CO 0.00 0.57 -0.06 0.93 -1.40 0.00 0.00 179.01 179.05 3k0f h GLU 198 N 0.76 0.06 0.00 2.33 3.07 -1.96 -2.63 114.58 116.22 3k0f h GLU 198 Ca 0.19 -0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.05 3k0f h GLU 198 Cb 0.05 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.95 3k0f h GLU 198 CO -0.03 0.04 -0.19 0.74 -1.40 0.00 0.00 179.01 178.18 3k0f h PHE 199 N 0.06 0.00 0.00 4.33 0.04 -1.89 -3.31 116.94 116.17 3k0f h PHE 199 Ca 0.30 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.88 3k0f h PHE 199 Cb 0.48 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.60 3k0f h PHE 199 CO -0.41 0.00 -1.20 0.28 -0.60 0.00 0.00 178.31 176.38 3k0f h VAL 200 N 0.00 0.95 -4.11 -0.55 2.07 -1.45 -3.47 116.25 109.69 3k0f h VAL 200 Ca 0.00 -2.56 -0.47 0.00 0.82 0.00 0.00 66.70 64.50 3k0f h VAL 200 Cb 0.88 2.40 0.02 0.00 -1.52 0.00 0.00 31.29 33.08 3k0f h VAL 200 CO 0.00 0.54 0.37 -0.44 0.02 0.00 0.00 177.57 178.06 3k0f s SER 201 N -6.22 6.44 0.08 0.57 0.01 -1.10 -4.97 113.70 108.50 3k0f s SER 201 Ca -0.01 1.79 -0.12 0.00 1.31 0.00 0.00 55.95 58.92 3k0f s SER 201 Cb 0.09 -2.54 -0.23 0.00 0.21 0.00 0.00 66.02 63.54 3k0f s SER 201 CO 0.80 -0.71 1.18 0.44 0.41 0.00 0.00 173.24 175.36 3k0f h ASP 202 N 1.34 0.81 -4.33 2.44 3.32 -1.86 -3.46 116.42 114.68 3k0f h ASP 202 Ca -0.48 -0.70 -0.40 0.00 0.02 0.00 0.00 57.03 55.47 3k0f h ASP 202 Cb 1.20 -0.25 -0.20 0.00 0.22 0.00 0.00 39.33 40.30 3k0f h ASP 202 CO 0.60 1.50 -0.77 0.20 -1.72 0.00 0.00 179.24 179.05 3k0f s ASN 203 N -7.30 1.74 -0.08 6.45 0.01 -1.01 -2.11 114.94 112.65 3k0f s ASN 203 Ca -0.09 -0.71 -0.02 0.00 -0.71 0.00 0.00 52.86 51.34 3k0f s ASN 203 Cb 0.07 -0.05 0.03 0.00 0.41 0.00 0.00 41.25 41.71 3k0f s ASN 203 CO 0.92 -0.13 0.01 -0.69 -1.51 0.00 0.00 177.10 175.70 3k0f s VAL 204 N -1.73 0.34 -0.16 1.60 1.01 -0.23 -1.13 120.40 120.09 3k0f s VAL 204 Ca 0.03 0.11 -0.02 0.00 0.00 0.00 0.00 61.98 62.10 3k0f s VAL 204 Cb -0.07 -0.53 -0.01 0.00 0.00 0.00 0.00 36.38 35.77 3k0f s VAL 204 CO 0.02 0.22 -0.09 -0.69 0.00 0.00 0.00 175.10 174.57 3k0f s VAL 205 N 1.99 3.28 -0.18 2.92 1.01 0.25 0.26 120.40 129.93 3k0f s VAL 205 Ca 0.05 -0.56 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 3k0f s VAL 205 Cb -0.12 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 3k0f s VAL 205 CO -0.05 0.49 -0.03 -0.63 0.00 0.00 0.00 175.10 174.88 3k0f s ILE 206 N 0.71 3.81 -0.19 2.22 1.01 0.28 -0.91 121.20 128.13 3k0f s ILE 206 Ca -0.04 -0.37 -0.07 0.00 0.00 0.00 0.00 60.65 60.16 3k0f s ILE 206 Cb -0.15 -2.70 -0.04 0.00 0.01 0.00 0.00 42.46 39.58 3k0f s ILE 206 CO 0.02 0.46 0.06 -0.76 0.00 0.00 0.00 174.94 174.72 3k0f s LEU 207 N 0.75 3.79 0.25 2.97 1.43 0.16 -1.00 118.68 127.03 3k0f s LEU 207 Ca -0.01 0.06 0.09 0.00 -1.03 0.00 0.00 54.13 53.24 3k0f s LEU 207 Cb -0.14 -1.96 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 3k0f s LEU 207 CO 0.02 0.16 -0.13 -0.13 0.23 0.00 0.00 176.35 176.50 3k0f s ARG 208 N 0.45 1.51 -0.41 1.70 0.52 -0.91 -3.92 118.95 117.90 3k0f s ARG 208 Ca 0.03 -1.71 0.04 0.00 -0.52 0.00 0.00 55.73 53.56 3k0f s ARG 208 Cb -0.13 -1.34 0.17 0.00 0.52 0.00 0.00 34.95 34.17 3k0f s ARG 208 CO 0.01 0.18 0.34 1.21 0.02 0.00 0.00 175.30 177.05 3k0f s ASN 209 N -3.42 1.48 0.14 0.23 3.04 -1.26 -1.95 114.94 113.20 3k0f s ASN 209 Ca 0.27 -2.87 -0.30 0.00 0.04 0.00 0.00 52.86 49.99 3k0f s ASN 209 Cb -0.00 -0.32 -0.07 0.00 -1.54 0.00 0.00 41.25 39.32 3k0f s ASN 209 CO 0.11 -0.19 1.15 -0.69 -3.04 0.00 0.00 177.10 174.45 3k0f s VAL 210 N 0.25 3.84 0.00 -5.21 1.01 -0.00 -4.77 120.40 115.52 3k0f s VAL 210 Ca 0.31 1.49 0.00 0.00 0.00 0.00 0.00 61.98 63.78 3k0f s VAL 210 Cb -0.00 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.43 3k0f s VAL 210 CO -0.16 0.21 0.06 -0.11 0.00 0.00 0.00 175.10 175.10 3k0f n LEU 211 N 2.87 0.77 -2.39 3.92 7.94 -1.26 -1.23 117.00 127.63 3k0f n LEU 211 Ca 0.05 0.06 -0.01 0.00 -1.11 0.00 0.00 56.01 55.00 3k0f n LEU 211 Cb 0.46 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.40 3k0f n LEU 211 CO 0.55 0.00 -0.47 1.21 -1.11 0.00 0.00 177.39 177.57 3k0f n GLU 212 N -0.19 -4.52 -3.83 1.96 2.13 -1.26 -3.91 120.64 111.02 3k0f n GLU 212 Ca 0.00 3.30 -0.33 0.00 0.66 0.00 0.00 57.16 60.79 3k0f n GLU 212 Cb 0.00 -4.29 0.02 0.00 0.27 0.00 0.00 31.44 27.44 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 1.87 -0.78 3.76 8.31 0.00 -1.26 -2.51 105.19 114.58 3k0f n GLY 213 Ca -0.08 0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.31 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 -4.42 0.00 -2.82 1.61 1.02 -1.26 -4.91 120.64 109.86 3k0f n GLU 214 Ca -0.15 0.00 -0.19 0.00 -0.02 0.00 0.00 57.16 56.80 3k0f n GLU 214 Cb 0.61 -3.04 0.03 0.00 -0.02 0.00 0.00 31.44 29.03 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 -0.38 2.57 -0.08 3.49 1.81 -1.04 -5.11 118.95 120.21 3k0f s ARG 215 Ca 0.00 -1.07 0.03 0.00 -1.72 0.00 0.00 55.73 52.97 3k0f s ARG 215 Cb 0.00 -2.60 0.01 0.00 -0.45 0.00 0.00 34.95 31.91 3k0f s ARG 215 CO 0.00 -0.61 -0.17 1.03 -0.68 0.00 0.00 175.30 174.88 3k0f s ARG 216 N -4.62 2.19 -0.21 3.54 1.81 -1.26 -4.22 118.95 116.18 3k0f s ARG 216 Ca 0.57 -0.58 0.00 0.00 -1.72 0.00 0.00 55.73 54.00 3k0f s ARG 216 Cb -0.09 -1.73 0.05 0.00 -0.45 0.00 0.00 34.95 32.73 3k0f s ARG 216 CO 0.37 0.09 -0.05 0.50 -0.68 0.00 0.00 175.30 175.52 3k0f s ARG 217 N 0.54 1.57 0.11 3.54 3.52 -0.36 -4.90 118.95 122.96 3k0f s ARG 217 Ca -0.16 -0.84 -0.16 0.00 -0.13 0.00 0.00 55.73 54.44 3k0f s ARG 217 Cb -0.17 -2.43 -0.07 0.00 -1.56 0.00 0.00 34.95 30.73 3k0f s ARG 217 CO 0.06 -0.55 0.54 -0.98 -0.81 0.00 0.00 175.30 173.56 3k0f s ARG 218 N 1.47 4.04 0.17 5.12 1.70 -1.26 -0.82 118.95 129.37 3k0f s ARG 218 Ca -0.04 0.56 0.02 0.00 -0.47 0.00 0.00 55.73 55.80 3k0f s ARG 218 Cb -0.18 -3.05 -0.05 0.00 -0.57 0.00 0.00 34.95 31.10 3k0f s ARG 218 CO -0.07 0.55 0.00 0.95 -1.08 0.00 0.00 175.30 175.65 3k0f s THR 219 N -1.32 0.63 -0.05 4.99 -4.23 -0.82 -2.12 115.64 112.73 3k0f s THR 219 Ca 0.34 -1.97 0.01 0.00 -1.18 0.00 0.00 61.69 58.88 3k0f s THR 219 Cb -0.17 -2.09 0.02 0.00 1.34 0.00 0.00 72.50 71.60 3k0f s THR 219 CO 0.19 -0.49 -0.04 -0.22 -0.54 0.00 0.00 174.62 173.52 3k0f s LEU 220 N -3.16 1.24 -0.02 4.79 0.20 0.29 -2.15 118.68 119.87 3k0f s LEU 220 Ca 0.23 -0.11 0.01 0.00 0.69 0.00 0.00 54.13 54.95 3k0f s LEU 220 Cb 0.06 -0.43 0.01 0.00 -0.43 0.00 0.00 46.19 45.41 3k0f s LEU 220 CO 0.03 -0.07 -0.04 -0.70 -0.29 0.00 0.00 176.35 175.28 3k0f s GLU 221 N 1.03 0.51 -0.28 1.98 2.12 -0.17 -0.66 118.70 123.22 3k0f s GLU 221 Ca -0.09 -0.10 -0.14 0.00 0.36 0.00 0.00 54.97 55.00 3k0f s GLU 221 Cb -0.14 -0.55 -0.04 0.00 0.26 0.00 0.00 34.13 33.66 3k0f s GLU 221 CO -0.01 -0.01 0.32 0.42 -0.54 0.00 0.00 175.26 175.45 3k0f s ILE 222 N 0.46 5.21 -0.05 -3.70 1.01 -1.26 0.98 121.20 123.85 3k0f s ILE 222 Ca -0.05 0.39 -0.13 0.00 0.00 0.00 0.00 60.65 60.85 3k0f s ILE 222 Cb -0.09 -3.66 -0.30 0.00 0.01 0.00 0.00 42.46 38.41 3k0f s ILE 222 CO -0.00 0.15 0.69 0.25 0.00 0.00 0.00 174.94 176.02 3k0f h LEU 223 N 8.55 0.58 -7.30 2.97 6.46 -0.55 -3.42 115.31 122.60 3k0f h LEU 223 Ca -0.32 -0.92 -0.10 0.00 -0.12 0.00 0.00 57.88 56.42 3k0f h LEU 223 Cb 1.17 -0.19 -0.20 0.00 -0.73 0.00 0.00 40.66 40.71 3k0f h LEU 223 CO 0.62 1.72 -0.10 -1.59 -0.62 0.00 0.00 178.44 178.47 3k0f s LYS 224 N -2.55 0.78 -0.23 1.25 -2.85 -1.22 -4.97 119.74 109.95 3k0f s LYS 224 Ca -0.16 0.10 -0.04 0.00 -1.00 0.00 0.00 55.97 54.86 3k0f s LYS 224 Cb 0.05 0.36 0.09 0.00 -2.06 0.00 0.00 37.83 36.26 3k0f s LYS 224 CO 0.84 -0.21 0.15 -0.51 0.10 0.00 0.00 175.35 175.71 3k0f s LEU 225 N -1.02 0.29 -0.27 2.77 1.43 -1.26 -1.07 118.68 119.55 3k0f s LEU 225 Ca -0.11 -0.83 -0.29 0.00 -1.03 0.00 0.00 54.13 51.88 3k0f s LEU 225 Cb -0.03 -0.11 -0.03 0.00 0.03 0.00 0.00 46.19 46.05 3k0f s LEU 225 CO 0.05 -0.39 1.83 -0.13 0.23 0.00 0.00 176.35 177.95 3k0f s ARG 226 N 2.17 3.45 0.00 1.70 0.52 -0.90 -3.44 118.95 122.46 3k0f s ARG 226 Ca 0.06 1.63 0.00 0.00 -0.52 0.00 0.00 55.73 56.90 3k0f s ARG 226 Cb -0.16 -4.18 0.00 0.00 0.52 0.00 0.00 34.95 31.13 3k0f s ARG 226 CO -0.23 -1.72 0.00 0.41 0.02 0.00 0.00 175.30 173.78 3k0f n GLY 227 N 5.26 2.72 2.57 -3.53 0.00 -1.26 -5.01 105.19 105.94 3k0f n GLY 227 Ca 0.23 -0.78 -0.18 0.00 0.00 0.00 0.00 46.02 45.29 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 -2.90 2.61 -2.24 -1.22 -4.29 114.28 106.24 3k0f n THR 228 Ca 0.00 -1.86 0.00 0.00 -2.27 0.00 0.00 64.05 59.92 3k0f n THR 228 Cb 0.00 0.76 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 3k0f n THR 228 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3k0f n SER 229 N -1.76 0.09 0.00 3.42 3.41 -1.26 -4.70 113.62 112.81 3k0f n SER 229 Ca -0.01 -0.85 0.00 0.00 -0.26 0.00 0.00 58.87 57.75 3k0f n SER 229 Cb 0.47 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.42 3k0f n SER 229 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k0f n HIS 230 N -0.82 0.00 -2.48 7.33 -0.00 -1.26 -4.61 115.22 113.39 3k0f n HIS 230 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 57.72 57.31 3k0f n HIS 230 Cb 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 29.95 3k0f n HIS 230 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 3k0f s MET 231 N -2.00 4.54 0.30 -1.40 -1.94 0.95 -5.00 119.30 114.75 3k0f s MET 231 Ca 0.00 1.75 -0.03 0.00 -1.71 0.00 0.00 55.69 55.70 3k0f s MET 231 Cb 0.00 -3.29 -0.05 0.00 2.01 0.00 0.00 34.83 33.51 3k0f s MET 231 CO 0.00 -0.02 0.53 0.15 -0.01 0.00 0.00 175.02 175.67 3k0f s LYS 232 N -0.03 3.58 0.25 2.03 3.01 -1.26 -4.55 119.74 122.76 3k0f s LYS 232 Ca 0.52 -0.13 0.00 0.00 -1.01 0.00 0.00 55.97 55.35 3k0f s LYS 232 Cb -0.30 -2.67 0.00 0.00 -1.01 0.00 0.00 37.83 33.85 3k0f s LYS 232 CO 0.34 0.21 0.00 0.41 0.51 0.00 0.00 175.35 176.82 3k0f n GLY 233 N -1.14 -2.59 3.84 -3.33 0.00 -1.26 -4.97 105.19 95.75 3k0f n GLY 233 Ca -0.03 -1.69 -0.33 0.00 0.00 0.00 0.00 46.02 43.98 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 -0.64 4.04 -0.05 1.61 2.02 -1.26 -4.30 118.70 120.12 3k0f s GLU 234 Ca 0.00 0.74 0.00 0.00 0.02 0.00 0.00 54.97 55.74 3k0f s GLU 234 Cb 0.00 -2.39 0.02 0.00 0.10 0.00 0.00 34.13 31.87 3k0f s GLU 234 CO 0.00 0.13 -0.02 0.71 0.02 0.00 0.00 175.26 176.09 3k0f s TYR 235 N -2.02 0.64 0.58 1.61 1.51 0.16 -4.89 117.35 114.94 3k0f s TYR 235 Ca 0.55 -0.15 -0.19 0.00 -1.01 0.00 0.00 57.07 56.27 3k0f s TYR 235 Cb -0.10 -0.65 -0.04 0.00 -0.11 0.00 0.00 41.96 41.06 3k0f s TYR 235 CO 0.17 -0.21 1.20 -1.25 -1.11 0.00 0.00 175.55 174.34 3k0f s PRO 236 N 1.21 3.06 0.06 -1.71 0.04 -1.26 0.10 135.00 136.50 3k0f s PRO 236 Ca -0.07 1.80 -0.26 0.00 0.04 0.00 0.00 61.00 62.51 3k0f s PRO 236 Cb -0.14 -1.96 0.09 0.00 0.04 0.00 0.00 34.50 32.53 3k0f s PRO 236 CO -0.02 -1.13 0.78 -0.59 0.04 0.00 0.00 177.00 176.09 3k0f s PHE 237 N -1.61 -0.41 0.05 0.56 -0.12 -0.90 -2.83 117.98 112.72 3k0f s PHE 237 Ca 0.76 0.24 0.04 0.00 -0.05 0.00 0.00 56.93 57.93 3k0f s PHE 237 Cb -0.30 0.55 -0.02 0.00 -0.63 0.00 0.00 43.02 42.62 3k0f s PHE 237 CO 0.32 -0.67 -0.12 0.99 -0.05 0.00 0.00 175.22 175.69 3k0f s THR 238 N -3.36 0.94 -0.24 -4.49 2.01 -0.89 -4.33 115.64 105.26 3k0f s THR 238 Ca 0.04 -1.10 -0.10 0.00 0.31 0.00 0.00 61.69 60.84 3k0f s THR 238 Cb -0.01 -0.90 -0.05 0.00 0.01 0.00 0.00 72.50 71.55 3k0f s THR 238 CO -0.10 -0.18 0.15 -0.63 -0.69 0.00 0.00 174.62 173.17 3k0f s ILE 239 N -1.11 5.19 0.00 1.82 1.01 -1.26 -1.65 121.20 125.20 3k0f s ILE 239 Ca -0.03 0.12 0.00 0.00 0.00 0.00 0.00 60.65 60.75 3k0f s ILE 239 Cb -0.09 -3.42 0.00 0.00 0.01 0.00 0.00 42.46 38.96 3k0f s ILE 239 CO 0.01 0.34 0.00 0.35 0.00 0.00 0.00 174.94 175.65 3k0f n THR 240 N 4.38 0.00 0.69 2.92 -2.24 -0.82 -4.97 114.28 114.25 3k0f n THR 240 Ca -0.15 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.70 3k0f n THR 240 Cb 0.52 0.00 0.37 0.00 -2.10 0.00 0.00 70.33 69.12 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 -0.63 0.00 -0.42 3.42 8.00 -1.26 -2.33 116.55 123.33 3k0f n ASP 241 Ca 0.00 0.07 0.05 0.00 0.71 0.00 0.00 54.79 55.62 3k0f n ASP 241 Cb 0.00 -0.28 0.12 0.00 -0.02 0.00 0.00 41.12 40.94 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 -1.28 0.35 -0.58 1.24 8.25 -1.26 -4.29 115.22 117.65 3k0f n HIS 242 Ca 0.07 -0.63 0.00 0.00 -0.26 0.00 0.00 57.72 56.90 3k0f n HIS 242 Cb 0.12 -0.10 0.00 0.00 1.12 0.00 0.00 29.99 31.13 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 -0.20 -1.34 3.77 -1.41 0.00 -0.99 -4.93 105.19 100.10 3k0f n GLY 243 Ca 0.10 -1.85 -0.37 0.00 0.00 0.00 0.00 46.02 43.90 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 3.28 -0.21 -0.61 1.01 -1.26 -1.94 121.20 121.47 3k0f s ILE 244 Ca 0.00 0.94 -0.04 0.00 0.00 0.00 0.00 60.65 61.54 3k0f s ILE 244 Cb 0.00 -3.46 0.08 0.00 0.01 0.00 0.00 42.46 39.09 3k0f s ILE 244 CO 0.00 -0.04 0.14 0.21 0.00 0.00 0.00 174.94 175.26 3k0f s ASN 245 N -1.48 2.31 -0.07 3.58 2.47 -0.66 -4.39 114.94 116.70 3k0f s ASN 245 Ca 0.64 -0.67 -0.06 0.00 0.42 0.00 0.00 52.86 53.19 3k0f s ASN 245 Cb -0.26 -0.06 -0.04 0.00 -1.45 0.00 0.00 41.25 39.44 3k0f s ASN 245 CO 0.32 -0.37 0.17 -0.63 -3.72 0.00 0.00 177.10 172.87 3k0f s ILE 246 N 2.19 5.46 -0.39 -5.21 1.01 -0.62 -2.10 121.20 121.54 3k0f s ILE 246 Ca 0.05 0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.81 3k0f s ILE 246 Cb -0.16 -3.46 0.11 0.00 0.01 0.00 0.00 42.46 38.96 3k0f s ILE 246 CO -0.17 0.51 0.15 -0.36 0.00 0.00 0.00 174.94 175.07 3k0f s PHE 247 N -1.14 3.65 -1.41 3.97 0.40 -1.13 -4.30 117.98 118.02 3k0f s PHE 247 Ca 0.20 -2.62 -0.09 0.00 -0.60 0.00 0.00 56.93 53.81 3k0f s PHE 247 Cb -0.12 -3.13 -0.11 0.00 0.51 0.00 0.00 43.02 40.17 3k0f s PHE 247 CO 0.10 -0.96 3.05 -2.30 0.70 0.00 0.00 175.22 175.80 3k0f n PRO 248 N 4.47 3.50 0.17 0.24 -0.02 -1.26 -4.48 135.00 137.61 3k0f n PRO 248 Ca -0.00 -2.07 0.01 0.00 -2.02 0.00 0.00 63.50 59.43 3k0f n PRO 248 Cb 0.41 -2.69 0.07 0.00 -0.02 0.00 0.00 33.50 31.28 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 6.71 0.00 -1.62 2.45 3.38 -1.95 1.21 115.31 125.49 3k0f h LEU 249 Ca 0.79 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.76 3k0f h LEU 249 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3k0f h LEU 249 CO 1.58 0.00 -0.04 0.61 0.09 0.00 0.00 178.44 180.68 3k0f n GLY 250 N -1.26 0.34 1.04 0.83 0.00 -1.26 -4.01 105.19 100.87 3k0f n GLY 250 Ca -0.00 -0.52 0.11 0.00 0.00 0.00 0.00 46.02 45.62 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 0.90 2.43 -2.38 4.61 0.00 0.42 -4.86 120.51 121.63 3k0f n ALA 251 Ca 0.10 -0.89 -0.42 0.00 0.00 0.00 0.00 53.44 52.23 3k0f n ALA 251 Cb 0.44 -0.81 -0.02 0.00 0.00 0.00 0.00 19.45 19.06 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 -1.59 3.44 1.09 0.00 0.00 -1.21 -5.00 119.30 116.03 3k0f s MET 252 Ca 0.34 0.67 -0.18 0.00 0.00 0.00 0.00 55.69 56.52 3k0f s MET 252 Cb 0.21 -4.07 0.25 0.00 0.00 0.00 0.00 34.83 31.21 3k0f s MET 252 CO 0.30 -1.75 1.19 1.03 0.00 0.00 0.00 175.02 175.79 3k0f s ARG 253 N 5.21 -0.38 -0.68 4.11 0.52 -1.26 -5.01 118.95 121.46 3k0f s ARG 253 Ca 0.56 -0.18 0.04 0.00 -0.52 0.00 0.00 55.73 55.64 3k0f s ARG 253 Cb -0.12 -1.70 0.29 0.00 0.52 0.00 0.00 34.95 33.94 3k0f s ARG 253 CO 0.29 -3.14 0.94 -0.11 0.02 0.00 0.00 175.30 173.31 3k0f n LEU 254 N -4.33 4.46 -2.58 2.53 7.94 -1.26 -4.81 117.00 118.95 3k0f n LEU 254 Ca 0.14 -5.51 -0.12 0.00 -1.11 0.00 0.00 56.01 49.41 3k0f n LEU 254 Cb 0.59 -0.71 0.03 0.00 0.53 0.00 0.00 43.42 43.86 3k0f n LEU 254 CO 0.46 2.13 0.02 0.41 -1.11 0.00 0.00 177.39 179.30 3k0f n THR 255 N 0.46 1.57 -2.58 1.96 -1.04 -1.26 -5.09 114.28 108.30 3k0f n THR 255 Ca 0.31 -3.54 -0.39 0.00 -2.04 0.00 0.00 64.05 58.39 3k0f n THR 255 Cb 0.39 0.23 -0.05 0.00 -1.82 0.00 0.00 70.33 69.08 3k0f n THR 255 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 3k0f s GLN 256 N -3.49 4.59 0.54 -2.82 -1.52 -1.26 -5.01 119.66 110.70 3k0f s GLN 256 Ca 0.35 1.63 -0.20 0.00 -1.95 0.00 0.00 55.36 55.19 3k0f s GLN 256 Cb 0.40 -3.05 -0.06 0.00 -0.22 0.00 0.00 33.01 30.08 3k0f s GLN 256 CO -0.03 0.22 1.12 1.03 -0.25 0.00 0.00 175.29 177.39 3k0f s ARG 257 N -1.64 3.39 -0.14 2.91 0.52 -1.26 -5.04 118.95 117.69 3k0f s ARG 257 Ca 0.47 1.60 -0.02 0.00 -0.52 0.00 0.00 55.73 57.26 3k0f s ARG 257 Cb -0.27 -2.01 0.04 0.00 0.52 0.00 0.00 34.95 33.22 3k0f s ARG 257 CO 0.35 -0.82 -0.00 0.45 0.02 0.00 0.00 175.30 175.30 3k0f s SER 258 N -1.78 2.43 0.28 0.23 0.15 -1.26 -4.93 113.70 108.82 3k0f s SER 258 Ca 0.72 -0.52 0.07 0.00 0.70 0.00 0.00 55.95 56.92 3k0f s SER 258 Cb -0.23 -0.63 -0.03 0.00 -1.71 0.00 0.00 66.02 63.41 3k0f s SER 258 CO 0.26 -0.23 0.28 -0.94 1.20 0.00 0.00 173.24 173.81 3k0f s SER 259 N 1.83 5.65 -0.27 5.45 1.04 -1.26 -5.01 113.70 121.13 3k0f s SER 259 Ca 0.02 -0.25 0.12 0.00 0.48 0.00 0.00 55.95 56.32 3k0f s SER 259 Cb -0.15 -1.36 0.75 0.00 0.10 0.00 0.00 66.02 65.37 3k0f s SER 259 CO -0.07 -0.17 1.74 0.59 0.98 0.00 0.00 173.24 176.32 3k0f n ASN 260 N -1.32 5.07 -4.70 7.02 3.02 -1.26 -4.68 115.26 118.42 3k0f n ASN 260 Ca -0.06 -3.10 -0.42 0.00 -0.03 0.00 0.00 54.58 50.97 3k0f n ASN 260 Cb 0.58 -0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 39.02 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 -2.90 4.68 0.27 2.41 1.01 -1.26 -4.96 120.40 119.64 3k0f s VAL 261 Ca 0.54 1.93 0.03 0.00 0.00 0.00 0.00 61.98 64.48 3k0f s VAL 261 Cb 0.42 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 3k0f s VAL 261 CO 0.14 0.08 0.42 -0.13 0.00 0.00 0.00 175.10 175.61 3k0f s ARG 262 N 1.53 3.46 0.17 2.72 1.81 -1.25 0.13 118.95 127.52 3k0f s ARG 262 Ca 0.52 -0.60 -0.07 0.00 -1.72 0.00 0.00 55.73 53.85 3k0f s ARG 262 Cb -0.21 -2.82 -0.02 0.00 -0.45 0.00 0.00 34.95 31.45 3k0f s ARG 262 CO 0.24 0.34 0.25 0.08 -0.68 0.00 0.00 175.30 175.53 3k0f s VAL 263 N -2.08 0.05 0.52 3.52 1.01 0.11 -4.67 120.40 118.87 3k0f s VAL 263 Ca 0.36 -1.55 -0.04 0.00 0.00 0.00 0.00 61.98 60.75 3k0f s VAL 263 Cb -0.09 -2.00 -0.01 0.00 0.00 0.00 0.00 36.38 34.28 3k0f s VAL 263 CO 0.31 -0.25 0.82 -0.55 0.00 0.00 0.00 175.10 175.43 3k0f s SER 264 N -3.01 5.88 -0.00 3.32 0.15 -1.26 -1.91 113.70 116.87 3k0f s SER 264 Ca 0.22 0.72 0.17 0.00 0.70 0.00 0.00 55.95 57.75 3k0f s SER 264 Cb 0.04 -1.88 -0.20 0.00 -1.71 0.00 0.00 66.02 62.28 3k0f s SER 264 CO 0.03 -0.82 0.71 -1.54 1.20 0.00 0.00 173.24 172.82 3k0f n SER 265 N -2.37 0.83 0.00 5.45 3.41 -1.26 -4.79 113.62 114.88 3k0f n SER 265 Ca 0.02 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.79 3k0f n SER 265 Cb 0.57 1.06 0.00 0.00 -0.26 0.00 0.00 64.21 65.58 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 1.42 0.39 2.76 5.00 0.00 -1.25 -2.32 105.19 111.18 3k0f n GLY 266 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.04 0.66 0.14 1.61 1.01 -1.26 -4.86 120.40 115.66 3k0f s VAL 267 Ca 0.00 -0.72 -0.27 0.00 0.00 0.00 0.00 61.98 60.99 3k0f s VAL 267 Cb 0.00 -1.18 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 3k0f s VAL 267 CO 0.00 -0.25 1.59 0.58 0.00 0.00 0.00 175.10 177.02 3k0f h VAL 268 N 6.53 0.20 -0.73 2.92 2.07 -1.95 -1.87 116.25 123.42 3k0f h VAL 268 Ca -0.16 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.43 3k0f h VAL 268 Cb 1.10 0.20 -0.06 0.00 -1.52 0.00 0.00 31.29 31.01 3k0f h VAL 268 CO 0.36 0.00 0.41 -0.09 0.02 0.00 0.00 177.57 178.27 3k0f h ARG 269 N -0.41 0.72 0.53 1.57 9.65 -1.96 -2.56 114.38 121.92 3k0f h ARG 269 Ca 0.10 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.92 3k0f h ARG 269 Cb 0.58 -0.16 -0.02 0.00 -1.39 0.00 0.00 29.97 28.99 3k0f h ARG 269 CO -0.42 0.48 -0.43 1.25 2.80 0.00 0.00 179.97 183.65 3k0f h LEU 270 N 0.74 -1.13 -1.19 3.80 6.46 -1.87 -0.30 115.31 121.83 3k0f h LEU 270 Ca 0.33 0.08 0.35 0.00 -0.12 0.00 0.00 57.88 58.53 3k0f h LEU 270 Cb 0.23 0.36 -0.14 0.00 -0.73 0.00 0.00 40.66 40.38 3k0f h LEU 270 CO -0.20 -0.61 0.67 0.44 -0.62 0.00 0.00 178.44 178.12 3k0f h ASP 271 N -0.94 0.41 0.05 1.25 3.32 -1.04 1.54 116.42 121.02 3k0f h ASP 271 Ca -0.06 0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3k0f h ASP 271 Cb 0.80 0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.47 3k0f h ASP 271 CO -0.00 -0.13 -0.03 -0.33 -1.72 0.00 0.00 179.24 177.03 3k0f h GLU 272 N 0.24 -0.07 -0.46 3.56 5.08 -0.92 0.64 114.58 122.65 3k0f h GLU 272 Ca 0.75 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 59.24 3k0f h GLU 272 Cb 1.96 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 31.21 3k0f h GLU 272 CO -0.51 0.16 0.41 0.52 -1.00 0.00 0.00 179.01 178.60 3k0f h MET 273 N -0.29 0.00 -0.62 2.33 2.86 0.38 0.56 114.93 120.14 3k0f h MET 273 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 3k0f h MET 273 Cb 0.26 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.92 3k0f h MET 273 CO 0.01 0.00 0.00 0.00 1.06 0.00 0.00 176.91 177.98 3k0f n GLY 275 N 0.94 -0.10 0.00 0.00 0.00 0.19 -4.20 105.19 102.02 3k0f n GLY 275 Ca 0.20 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -1.10 0.75 0.83 -0.02 0.00 0.18 -4.88 105.19 100.94 3k0f n GLY 276 Ca -0.11 -0.04 0.10 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.75 3.73 -0.02 0.00 0.10 -4.56 105.19 101.68 3k0f n GLY 277 Ca 0.00 -1.24 -0.30 0.00 0.00 0.00 0.00 46.02 44.48 3k0f n GLY 277 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k0f s PHE 278 N -3.29 2.36 0.23 1.61 2.99 -0.80 -4.62 117.98 116.45 3k0f s PHE 278 Ca 0.00 1.18 -0.18 0.00 0.00 0.00 0.00 56.93 57.94 3k0f s PHE 278 Cb 0.00 -3.18 -0.08 0.00 0.00 0.00 0.00 43.02 39.76 3k0f s PHE 278 CO 0.00 -2.39 0.70 -0.06 -0.00 0.00 0.00 175.22 173.46 3k0f s PHE 279 N -2.98 3.58 0.08 0.36 0.40 -1.26 0.07 117.98 118.23 3k0f s PHE 279 Ca 0.63 1.29 -0.32 0.00 -0.60 0.00 0.00 56.93 57.93 3k0f s PHE 279 Cb -0.17 -2.55 -0.17 0.00 0.51 0.00 0.00 43.02 40.63 3k0f s PHE 279 CO 0.56 0.30 1.63 -0.22 0.70 0.00 0.00 175.22 178.19 3k0f h LYS 280 N 3.17 -0.78 -5.76 0.44 3.64 0.82 -3.28 116.57 114.83 3k0f h LYS 280 Ca -0.48 0.05 -0.66 0.00 -1.27 0.00 0.00 60.65 58.30 3k0f h LYS 280 Cb 1.19 0.18 -0.11 0.00 -0.41 0.00 0.00 32.23 33.08 3k0f h LYS 280 CO 0.65 -0.52 1.70 -0.51 -2.27 0.00 0.00 179.45 178.51 3k0f s ASP 281 N -4.49 6.71 -0.29 4.20 1.01 -1.26 -3.36 116.67 119.18 3k0f s ASP 281 Ca -0.17 -2.07 -0.24 0.00 0.71 0.00 0.00 52.55 50.78 3k0f s ASP 281 Cb 0.04 -2.54 0.14 0.00 1.01 0.00 0.00 42.92 41.58 3k0f s ASP 281 CO 0.63 -1.25 1.15 -0.94 0.21 0.00 0.00 175.17 174.96 3k0f s SER 282 N 4.32 -0.34 -0.14 0.27 1.04 -1.24 -4.74 113.70 112.88 3k0f s SER 282 Ca 0.47 0.64 -0.21 0.00 0.48 0.00 0.00 55.95 57.34 3k0f s SER 282 Cb 0.01 0.69 -0.03 0.00 0.10 0.00 0.00 66.02 66.79 3k0f s SER 282 CO -0.02 -0.11 0.62 -0.63 0.98 0.00 0.00 173.24 174.08 3k0f s ILE 283 N 0.26 5.07 -0.12 -1.02 -1.09 -1.26 -3.11 121.20 119.93 3k0f s ILE 283 Ca 0.03 1.22 -0.03 0.00 -2.23 0.00 0.00 60.65 59.64 3k0f s ILE 283 Cb -0.05 -3.95 -0.03 0.00 -1.58 0.00 0.00 42.46 36.85 3k0f s ILE 283 CO -0.09 0.20 -0.02 -0.63 -1.23 0.00 0.00 174.94 173.17 3k0f s ILE 284 N 1.26 4.13 -0.15 2.92 -1.09 0.48 -2.14 121.20 126.62 3k0f s ILE 284 Ca 0.31 -0.29 0.01 0.00 -2.23 0.00 0.00 60.65 58.44 3k0f s ILE 284 Cb -0.16 -2.77 -0.00 0.00 -1.58 0.00 0.00 42.46 37.94 3k0f s ILE 284 CO 0.13 0.55 -0.16 -0.22 -1.23 0.00 0.00 174.94 174.00 3k0f s LEU 285 N -0.30 2.42 -0.20 2.97 2.96 0.19 0.60 118.68 127.32 3k0f s LEU 285 Ca 0.06 -0.48 0.00 0.00 -0.22 0.00 0.00 54.13 53.49 3k0f s LEU 285 Cb -0.12 -1.54 0.02 0.00 0.50 0.00 0.00 46.19 45.04 3k0f s LEU 285 CO 0.02 0.09 -0.16 0.00 -1.32 0.00 0.00 176.35 174.98 3k0f s ALA 286 N 0.76 2.44 0.01 5.97 0.00 0.11 0.28 121.76 131.32 3k0f s ALA 286 Ca -0.07 -1.28 0.01 0.00 0.00 0.00 0.00 51.96 50.62 3k0f s ALA 286 Cb -0.16 -1.32 -0.01 0.00 0.00 0.00 0.00 23.12 21.64 3k0f s ALA 286 CO 0.01 -0.47 -0.03 0.99 0.00 0.00 0.00 175.76 176.26 3k0f s THR 287 N 1.30 0.20 0.01 0.00 2.01 -0.22 0.06 115.64 119.00 3k0f s THR 287 Ca 0.03 -0.40 -0.28 0.00 0.31 0.00 0.00 61.69 61.36 3k0f s THR 287 Cb -0.14 -0.23 0.10 0.00 0.01 0.00 0.00 72.50 72.24 3k0f s THR 287 CO -0.10 -0.13 1.25 -0.83 -0.69 0.00 0.00 174.62 174.12 3k0f s GLY 288 N -0.55 -0.12 0.77 4.40 0.00 -1.20 -0.20 107.32 110.42 3k0f s GLY 288 Ca -0.04 0.04 -0.11 0.00 0.00 0.00 0.00 44.72 44.61 3k0f s GLY 288 CO -0.00 4.64 1.09 0.00 0.00 0.00 0.00 173.10 178.83 3k0f s ALA 289 N -2.08 2.39 0.07 3.20 0.00 -1.25 -2.33 121.76 121.75 3k0f s ALA 289 Ca 0.27 -0.15 -0.33 0.00 0.00 0.00 0.00 51.96 51.75 3k0f s ALA 289 Cb -0.00 -3.12 -0.12 0.00 0.00 0.00 0.00 23.12 19.88 3k0f s ALA 289 CO -0.00 -1.57 1.75 -2.37 0.00 0.00 0.00 175.76 173.57 3k0f n THR 290 N -3.33 0.29 -0.03 0.00 5.66 -1.26 -1.41 114.28 114.20 3k0f n THR 290 Ca 0.07 -0.05 0.00 0.00 -3.05 0.00 0.00 64.05 61.02 3k0f n THR 290 Cb 0.56 -1.80 0.00 0.00 -1.55 0.00 0.00 70.33 67.54 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 3.96 0.54 0.24 1.09 0.00 -1.26 -4.95 105.19 104.81 3k0f n GLY 291 Ca 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 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 1.23 0.00 2.61 1.35 -1.59 -3.47 112.91 113.04 3k0f h THR 292 Ca 0.00 -1.06 0.00 0.00 -0.55 0.00 0.00 66.41 64.80 3k0f h THR 292 Cb 0.00 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 67.67 3k0f h THR 292 CO 0.00 0.34 0.00 0.61 -0.25 0.00 0.00 175.52 176.22 3k0f n GLY 293 N -0.60 1.57 0.09 5.82 0.00 -1.26 -4.93 105.19 105.88 3k0f n GLY 293 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 0.17 0.00 1.61 6.56 -1.92 -2.84 116.57 120.15 3k0f h LYS 294 Ca 0.00 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.54 3k0f h LYS 294 Cb 0.00 -0.01 0.00 0.00 -0.57 0.00 0.00 32.23 31.65 3k0f h LYS 294 CO 0.00 0.43 0.33 1.15 -2.06 0.00 0.00 179.45 179.30 3k0f h THR 295 N -0.12 0.00 0.00 -0.16 2.02 -1.98 -0.82 112.91 111.86 3k0f h THR 295 Ca 0.03 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.20 3k0f h THR 295 Cb 0.35 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 3k0f h THR 295 CO 0.00 0.00 -0.02 0.25 0.37 0.00 0.00 175.52 176.13 3k0f h LEU 296 N 0.00 0.01 -1.76 2.58 5.85 -1.91 -2.81 115.31 117.27 3k0f h LEU 296 Ca 0.00 -0.93 0.07 0.00 0.84 0.00 0.00 57.88 57.86 3k0f h LEU 296 Cb 0.66 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 3k0f h LEU 296 CO 0.00 0.94 0.29 -0.07 -0.34 0.00 0.00 178.44 179.26 3k0f h LEU 297 N -0.92 0.26 -0.32 2.25 3.38 -1.19 0.49 115.31 119.26 3k0f h LEU 297 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3k0f h LEU 297 Cb 0.94 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 3k0f h LEU 297 CO 0.00 0.17 0.06 0.58 0.09 0.00 0.00 178.44 179.34 3k0f h VAL 298 N 0.30 1.23 -0.60 1.22 2.07 -1.45 0.37 116.25 119.40 3k0f h VAL 298 Ca 0.19 -0.81 -0.05 0.00 0.82 0.00 0.00 66.70 66.85 3k0f h VAL 298 Cb 0.38 1.14 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 3k0f h VAL 298 CO -0.04 0.27 0.16 0.28 0.02 0.00 0.00 177.57 178.26 3k0f h SER 299 N 0.36 0.89 0.18 0.57 0.02 -0.97 -1.82 113.55 112.78 3k0f h SER 299 Ca 0.10 -0.23 -0.14 0.00 -0.84 0.00 0.00 61.79 60.68 3k0f h SER 299 Cb 0.34 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.64 3k0f h SER 299 CO 0.01 0.89 -0.53 -0.09 -1.14 0.00 0.00 176.83 175.96 3k0f h ARG 300 N 0.86 0.38 -0.28 3.45 9.65 -0.78 -2.07 114.38 125.60 3k0f h ARG 300 Ca 0.19 -0.23 -0.06 0.00 -1.10 0.00 0.00 59.98 58.78 3k0f h ARG 300 Cb 0.33 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.93 3k0f h ARG 300 CO -0.00 0.82 -0.05 0.35 2.80 0.00 0.00 179.97 183.88 3k0f h PHE 301 N 0.30 0.60 -0.18 2.20 3.57 0.16 -2.97 116.94 120.62 3k0f h PHE 301 Ca 0.01 -0.12 -0.19 0.00 3.53 0.00 0.00 57.97 61.20 3k0f h PHE 301 Cb 1.03 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.62 3k0f h PHE 301 CO 0.03 0.72 -0.64 0.28 -2.23 0.00 0.00 178.31 176.47 3k0f h VAL 302 N 0.30 1.31 -0.19 1.41 2.07 -1.32 -3.21 116.25 116.61 3k0f h VAL 302 Ca 0.07 -1.89 -0.07 0.00 0.82 0.00 0.00 66.70 65.63 3k0f h VAL 302 Cb 0.52 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.13 3k0f h VAL 302 CO 0.03 0.59 -0.18 -0.08 0.02 0.00 0.00 177.57 177.95 3k0f h GLU 303 N 0.49 0.33 0.00 1.57 4.81 -1.42 -2.52 114.58 117.83 3k0f h GLU 303 Ca -0.01 -0.09 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 3k0f h GLU 303 Cb 1.23 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.58 3k0f h GLU 303 CO 0.13 0.50 0.00 -0.97 -0.73 0.00 0.00 179.01 177.94 3k0f h ASN 304 N 0.30 0.00 1.61 1.04 -0.73 -1.52 -0.51 115.58 115.77 3k0f h ASN 304 Ca 0.05 0.00 -0.06 0.00 1.87 0.00 0.00 56.30 58.16 3k0f h ASN 304 Cb 0.50 0.00 -0.01 0.00 0.27 0.00 0.00 38.32 39.08 3k0f h ASN 304 CO 0.03 0.00 -0.29 0.00 -0.37 0.00 0.00 177.43 176.80 3k0f h ALA 305 N 2.02 0.83 0.00 1.57 0.00 -1.50 -2.97 119.26 119.21 3k0f h ALA 305 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3k0f h ALA 305 Cb 0.61 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3k0f h ALA 305 CO 0.00 0.36 -1.14 0.00 0.00 0.00 0.00 179.25 178.47 3k0f n ALA 307 N -1.97 2.99 -0.36 0.00 0.00 -0.26 -3.06 120.51 117.85 3k0f n ALA 307 Ca 0.01 -0.27 0.04 0.00 0.00 0.00 0.00 53.44 53.21 3k0f n ALA 307 Cb 0.48 -1.27 0.08 0.00 0.00 0.00 0.00 19.45 18.74 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 -1.27 2.36 -3.41 0.00 3.02 -1.13 -5.00 115.26 109.83 3k0f n ASN 308 Ca 0.09 -2.34 -0.20 0.00 -0.03 0.00 0.00 54.58 52.10 3k0f n ASN 308 Cb 0.32 -0.18 0.06 0.00 -0.61 0.00 0.00 39.78 39.38 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 -0.57 -2.61 -4.27 3.52 5.02 -1.17 -5.03 118.16 113.04 3k0f n LYS 309 Ca 0.07 0.74 -0.17 0.00 -2.02 0.00 0.00 58.31 56.93 3k0f n LYS 309 Cb 0.42 -5.36 -0.14 0.00 -0.02 0.00 0.00 35.03 29.93 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 -5.00 0.70 0.81 1.97 2.02 0.32 -5.00 118.70 114.52 3k0f s GLU 310 Ca 0.38 -0.51 -0.12 0.00 0.02 0.00 0.00 54.97 54.74 3k0f s GLU 310 Cb -0.08 -0.64 0.08 0.00 0.10 0.00 0.00 34.13 33.59 3k0f s GLU 310 CO 0.78 0.16 1.10 1.03 0.02 0.00 0.00 175.26 178.35 3k0f s ARG 311 N -0.74 1.94 -0.29 1.61 0.52 -1.26 -3.55 118.95 117.19 3k0f s ARG 311 Ca -0.00 0.63 -0.22 0.00 -0.52 0.00 0.00 55.73 55.62 3k0f s ARG 311 Cb -0.06 -1.90 0.13 0.00 0.52 0.00 0.00 34.95 33.64 3k0f s ARG 311 CO 0.00 -1.72 1.05 0.00 0.02 0.00 0.00 175.30 174.65 3k0f s ALA 312 N -3.14 -2.08 0.14 2.13 0.00 -0.38 -2.95 121.76 115.48 3k0f s ALA 312 Ca 0.61 1.96 0.06 0.00 0.00 0.00 0.00 51.96 54.59 3k0f s ALA 312 Cb -0.15 -1.55 -0.04 0.00 0.00 0.00 0.00 23.12 21.39 3k0f s ALA 312 CO 0.54 -0.26 0.06 0.42 0.00 0.00 0.00 175.76 176.52 3k0f s ILE 313 N 0.55 4.13 -0.29 0.00 1.01 -0.80 -0.25 121.20 125.56 3k0f s ILE 313 Ca -0.00 -1.15 -0.02 0.00 0.00 0.00 0.00 60.65 59.48 3k0f s ILE 313 Cb -0.05 -3.06 0.09 0.00 0.01 0.00 0.00 42.46 39.46 3k0f s ILE 313 CO -0.10 -0.04 0.10 -0.22 0.00 0.00 0.00 174.94 174.68 3k0f s LEU 314 N -2.81 1.59 -0.30 2.97 2.96 0.14 -2.22 118.68 121.01 3k0f s LEU 314 Ca 0.28 -1.42 -0.23 0.00 -0.22 0.00 0.00 54.13 52.55 3k0f s LEU 314 Cb -0.10 -0.68 -0.00 0.00 0.50 0.00 0.00 46.19 45.91 3k0f s LEU 314 CO 0.21 -0.41 0.75 -0.36 -1.32 0.00 0.00 176.35 175.22 3k0f s PHE 315 N 1.79 3.22 -0.15 5.38 0.40 -0.59 -0.07 117.98 127.97 3k0f s PHE 315 Ca 0.08 0.80 -0.04 0.00 -0.60 0.00 0.00 56.93 57.17 3k0f s PHE 315 Cb -0.17 -3.13 -0.03 0.00 0.51 0.00 0.00 43.02 40.20 3k0f s PHE 315 CO -0.26 -0.51 -0.00 0.00 0.70 0.00 0.00 175.22 175.14 3k0f s ALA 316 N 2.85 3.16 -0.00 5.36 0.00 -1.26 -1.85 121.76 130.02 3k0f s ALA 316 Ca 0.31 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.47 3k0f s ALA 316 Cb -0.14 -1.63 0.00 0.00 0.00 0.00 0.00 23.12 21.34 3k0f s ALA 316 CO 0.12 0.29 0.91 0.66 0.00 0.00 0.00 175.76 177.73 3k0f n TYR 317 N 3.24 0.00 0.00 0.00 4.02 -1.24 0.02 117.16 123.19 3k0f n TYR 317 Ca -0.17 -0.41 0.00 0.00 -0.01 0.00 0.00 57.90 57.30 3k0f n TYR 317 Cb 0.53 -0.04 0.00 0.00 -0.02 0.00 0.00 39.34 39.80 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 -0.41 0.32 -4.45 -0.72 1.02 -1.26 -4.51 120.64 110.63 3k0f n GLU 318 Ca 0.00 0.00 -0.33 0.00 -0.02 0.00 0.00 57.16 56.81 3k0f n GLU 318 Cb 0.30 -0.75 -0.10 0.00 -0.02 0.00 0.00 31.44 30.87 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 -1.50 2.76 1.10 3.49 2.02 -1.26 -5.11 118.70 120.21 3k0f s GLU 319 Ca 0.00 -0.57 -0.13 0.00 0.02 0.00 0.00 54.97 54.29 3k0f s GLU 319 Cb 0.00 -2.63 0.25 0.00 0.10 0.00 0.00 34.13 31.84 3k0f s GLU 319 CO 0.00 0.65 1.06 -1.54 0.02 0.00 0.00 175.26 175.45 3k0f s SER 320 N -1.15 1.63 0.40 -0.19 1.04 -1.26 -4.78 113.70 109.39 3k0f s SER 320 Ca 0.15 1.30 0.20 0.00 0.48 0.00 0.00 55.95 58.08 3k0f s SER 320 Cb -0.11 -2.04 0.83 0.00 0.10 0.00 0.00 66.02 64.80 3k0f s SER 320 CO 0.05 -3.77 1.81 0.03 0.98 0.00 0.00 173.24 172.35 3k0f h ARG 321 N -2.33 0.00 0.30 4.02 3.08 -1.98 -2.38 114.38 115.09 3k0f h ARG 321 Ca -0.59 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.45 3k0f h ARG 321 Cb 1.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.39 3k0f h ARG 321 CO 0.54 0.32 -0.14 0.00 -1.07 0.00 0.00 179.97 179.62 3k0f h ALA 322 N 1.68 -0.40 -0.33 0.04 0.00 -2.00 -3.25 119.26 115.00 3k0f h ALA 322 Ca -0.00 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.88 3k0f h ALA 322 Cb 0.76 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 18.62 3k0f h ALA 322 CO 0.04 -0.38 -0.23 0.37 0.00 0.00 0.00 179.25 179.06 3k0f h GLN 323 N -1.09 -0.18 -1.33 0.00 4.15 -1.93 0.22 115.11 114.95 3k0f h GLN 323 Ca -0.04 0.01 0.39 0.00 0.77 0.00 0.00 58.65 59.78 3k0f h GLN 323 Cb 0.33 0.04 -0.07 0.00 0.21 0.00 0.00 27.48 27.99 3k0f h GLN 323 CO 0.07 -0.12 0.93 -0.07 -1.93 0.00 0.00 178.83 177.70 3k0f h LEU 324 N -0.19 0.11 0.09 -2.39 3.38 -1.55 0.49 115.31 115.24 3k0f h LEU 324 Ca 0.17 0.03 -0.33 0.00 0.09 0.00 0.00 57.88 57.84 3k0f h LEU 324 Cb 0.45 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3k0f h LEU 324 CO -0.44 -0.01 -1.77 -0.07 0.09 0.00 0.00 178.44 176.24 3k0f h LEU 325 N 0.08 0.31 -0.29 1.67 3.38 -0.74 -2.24 115.31 117.48 3k0f h LEU 325 Ca 0.67 -0.58 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 3k0f h LEU 325 Cb 2.46 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 43.09 3k0f h LEU 325 CO -0.11 1.51 0.04 -0.09 0.09 0.00 0.00 178.44 179.88 3k0f h ARG 326 N 0.05 0.49 -0.31 1.13 2.43 0.23 -1.05 114.38 117.35 3k0f h ARG 326 Ca -0.33 -0.14 -0.12 0.00 -0.81 0.00 0.00 59.98 58.58 3k0f h ARG 326 Cb 2.03 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 31.52 3k0f h ARG 326 CO 0.11 0.60 -0.28 -0.91 -1.51 0.00 0.00 179.97 177.99 3k0f h ASN 327 N 0.30 0.79 -0.35 -3.80 2.35 -0.48 -2.59 115.58 111.80 3k0f h ASN 327 Ca 0.09 -0.46 0.02 0.00 -0.55 0.00 0.00 56.30 55.40 3k0f h ASN 327 Cb 0.36 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.48 3k0f h ASN 327 CO 0.01 1.08 0.19 0.00 -1.65 0.00 0.00 177.43 177.06 3k0f h ALA 328 N 0.73 0.43 -0.54 -0.83 0.00 -1.33 -2.60 119.26 115.11 3k0f h ALA 328 Ca 0.05 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 3k0f h ALA 328 Cb 0.85 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 3k0f h ALA 328 CO 0.07 -0.17 0.28 -0.92 0.00 0.00 0.00 179.25 178.50 3k0f h TYR 329 N 0.39 0.76 0.00 0.00 3.20 -1.19 -1.84 116.97 118.28 3k0f h TYR 329 Ca 0.14 -0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.98 3k0f h TYR 329 Cb 0.03 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 38.06 3k0f h TYR 329 CO -0.09 0.58 0.02 0.43 -1.64 0.00 0.00 178.16 177.47 3k0f n SER 330 N -4.59 0.48 -1.18 -2.11 7.64 -0.98 0.13 113.62 113.01 3k0f n SER 330 Ca 0.03 0.72 0.10 0.00 1.01 0.00 0.00 58.87 60.72 3k0f n SER 330 Cb 0.10 -0.77 0.28 0.00 -1.01 0.00 0.00 64.21 62.81 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 -2.15 0.89 -0.56 1.43 8.01 -0.70 -4.43 117.44 119.93 3k0f n TRP 331 Ca -0.01 -0.52 0.00 0.00 -1.31 0.00 0.00 57.50 55.66 3k0f n TRP 331 Cb 0.05 -0.03 0.00 0.00 -2.01 0.00 0.00 31.31 29.32 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 1.26 0.87 0.67 6.99 0.00 0.36 -4.16 105.19 111.18 3k0f n GLY 332 Ca 0.21 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 3.03 0.00 -3.11 1.61 0.00 -1.26 -3.44 117.12 113.94 3k0f n MET 333 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 57.70 57.27 3k0f n MET 333 Cb 0.00 -0.19 -0.06 0.00 0.00 0.00 0.00 33.22 32.97 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 6.28 0.38 3.17 -1.08 -1.26 -3.60 116.67 120.56 3k0f s ASP 334 Ca 0.00 -0.56 0.20 0.00 -0.52 0.00 0.00 52.55 51.67 3k0f s ASP 334 Cb 0.00 -2.32 0.63 0.00 -1.46 0.00 0.00 42.92 39.77 3k0f s ASP 334 CO 0.00 -0.85 1.70 -0.26 0.52 0.00 0.00 175.17 176.28 3k0f h PHE 335 N 8.95 0.00 -0.62 -5.34 0.05 -1.89 -3.15 116.94 114.95 3k0f h PHE 335 Ca -0.26 0.00 0.08 0.00 3.82 0.00 0.00 57.97 61.60 3k0f h PHE 335 Cb 1.09 0.00 -0.06 0.00 2.00 0.00 0.00 35.95 38.98 3k0f h PHE 335 CO 0.75 0.35 0.29 0.93 -0.18 0.00 0.00 178.31 180.45 3k0f h GLU 336 N 0.00 0.50 -0.17 1.51 4.39 -1.95 -2.27 114.58 116.59 3k0f h GLU 336 Ca -0.00 -0.03 -0.11 0.00 0.34 0.00 0.00 59.36 59.55 3k0f h GLU 336 Cb 0.95 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 3k0f h GLU 336 CO 0.05 0.33 -0.33 1.49 -1.16 0.00 0.00 179.01 179.39 3k0f h GLU 337 N 0.52 0.53 -0.91 2.33 4.57 -1.98 -2.75 114.58 116.90 3k0f h GLU 337 Ca 0.30 -0.34 0.18 0.00 -1.18 0.00 0.00 59.36 58.32 3k0f h GLU 337 Cb 0.29 0.04 -0.07 0.00 -0.16 0.00 0.00 28.75 28.85 3k0f h GLU 337 CO -0.24 0.95 0.59 0.52 -1.18 0.00 0.00 179.01 179.64 3k0f h MET 338 N 0.18 0.54 -0.21 1.92 2.86 -1.46 0.28 114.93 119.03 3k0f h MET 338 Ca 0.01 -0.03 -0.17 0.00 -2.06 0.00 0.00 59.70 57.45 3k0f h MET 338 Cb 0.93 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.47 3k0f h MET 338 CO 0.07 0.36 -0.52 0.93 1.06 0.00 0.00 176.91 178.81 3k0f h GLU 339 N 0.55 0.72 -0.13 1.72 5.08 -1.32 -0.84 114.58 120.36 3k0f h GLU 339 Ca 0.47 -0.50 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 3k0f h GLU 339 Cb 0.97 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 30.29 3k0f h GLU 339 CO -0.21 1.12 -0.04 0.00 -1.00 0.00 0.00 179.01 178.87 3k0f h ARG 340 N 0.44 0.26 -0.03 2.33 3.08 -0.85 -2.78 114.38 116.82 3k0f h ARG 340 Ca -0.01 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3k0f h ARG 340 Cb 1.13 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.17 3k0f h ARG 340 CO 0.11 0.57 0.00 1.04 -1.07 0.00 0.00 179.97 180.62 3k0f n GLN 341 N -4.70 0.26 -4.13 0.04 6.02 -0.06 -4.79 117.38 110.02 3k0f n GLN 341 Ca -0.06 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.65 3k0f n GLN 341 Cb 0.26 -1.02 -0.06 0.00 1.02 0.00 0.00 30.24 30.45 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 -0.39 0.28 0.00 1.08 4.13 -1.05 -4.85 115.26 114.45 3k0f n ASN 342 Ca 0.00 -1.14 0.00 0.00 1.68 0.00 0.00 54.58 55.12 3k0f n ASN 342 Cb 0.01 -2.33 0.00 0.00 -1.54 0.00 0.00 39.78 35.91 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 -4.50 1.03 -4.21 3.41 4.77 -0.97 -4.92 117.00 111.62 3k0f n LEU 343 Ca -0.32 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.33 3k0f n LEU 343 Cb 0.69 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.62 3k0f n LEU 343 CO 0.80 0.17 -0.52 -0.22 -1.33 0.00 0.00 177.39 176.29 3k0f s LEU 344 N -4.16 2.26 -0.19 2.23 1.98 -0.36 -1.25 118.68 119.19 3k0f s LEU 344 Ca 0.00 -0.55 -0.01 0.00 -2.89 0.00 0.00 54.13 50.68 3k0f s LEU 344 Cb 0.00 -1.49 0.01 0.00 0.66 0.00 0.00 46.19 45.36 3k0f s LEU 344 CO 0.00 0.08 -0.13 -0.75 -1.89 0.00 0.00 176.35 173.66 3k0f s LYS 345 N 0.81 3.18 -0.13 1.98 2.20 0.65 -4.06 119.74 124.37 3k0f s LYS 345 Ca -0.06 -0.73 -0.08 0.00 -0.36 0.00 0.00 55.97 54.73 3k0f s LYS 345 Cb -0.15 -2.76 -0.04 0.00 -1.51 0.00 0.00 37.83 33.37 3k0f s LYS 345 CO -0.01 -0.17 0.15 0.42 -0.36 0.00 0.00 175.35 175.38 3k0f s ILE 346 N 1.29 5.47 0.00 5.43 1.01 -1.26 0.24 121.20 133.37 3k0f s ILE 346 Ca 0.04 0.24 0.00 0.00 0.00 0.00 0.00 60.65 60.93 3k0f s ILE 346 Cb -0.14 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 38.90 3k0f s ILE 346 CO -0.07 0.58 0.00 0.52 0.00 0.00 0.00 174.94 175.97 3k0f n VAL 347 N 2.26 0.00 -0.32 2.92 0.31 0.90 -4.91 118.33 119.50 3k0f n VAL 347 Ca -0.19 0.04 0.00 0.00 -0.01 0.00 0.00 64.34 64.18 3k0f n VAL 347 Cb 0.54 -1.01 0.00 0.00 -0.91 0.00 0.00 33.84 32.46 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 -0.19 -2.11 0.11 0.00 0.00 0.10 -4.89 121.76 114.78 3k0f s ALA 349 Ca 0.00 1.78 -0.30 0.00 0.00 0.00 0.00 51.96 53.44 3k0f s ALA 349 Cb 0.00 -1.47 -0.06 0.00 0.00 0.00 0.00 23.12 21.59 3k0f s ALA 349 CO 0.00 -0.21 1.06 0.71 0.00 0.00 0.00 175.76 177.32 3k0f s TYR 350 N -0.63 3.64 0.44 0.00 1.51 -1.26 -4.02 117.35 117.03 3k0f s TYR 350 Ca 0.06 1.62 0.17 0.00 -1.01 0.00 0.00 57.07 57.91 3k0f s TYR 350 Cb -0.02 -3.21 1.10 0.00 -0.11 0.00 0.00 41.96 39.71 3k0f s TYR 350 CO -0.09 -0.41 1.93 -1.35 -1.11 0.00 0.00 175.55 174.53 3k0f h PRO 351 N 5.84 0.35 0.00 -1.71 0.11 -1.85 0.32 132.00 135.06 3k0f h PRO 351 Ca -0.43 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 3k0f h PRO 351 Cb 1.21 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.24 3k0f h PRO 351 CO 0.74 0.23 -0.01 0.93 -0.21 0.00 0.00 178.00 179.69 3k0f h GLU 352 N 0.36 0.00 -0.03 1.05 3.07 -1.91 -3.13 114.58 113.99 3k0f h GLU 352 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 3k0f h GLU 352 Cb 0.87 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.78 3k0f h GLU 352 CO -0.10 0.01 0.00 -1.13 -1.40 0.00 0.00 179.01 176.39 3k0f n SER 353 N -3.16 0.03 0.00 1.42 3.41 0.10 -4.84 113.62 110.58 3k0f n SER 353 Ca -0.02 -0.96 0.00 0.00 -0.26 0.00 0.00 58.87 57.63 3k0f n SER 353 Cb 0.15 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.08 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 -0.45 0.00 -2.79 7.33 0.00 -1.18 -5.04 120.51 118.37 3k0f n ALA 354 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 3k0f n ALA 354 Cb 0.01 0.00 -0.05 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 0.00 1.53 0.22 0.00 0.00 -1.26 -4.94 107.32 102.86 3k0f s GLY 355 Ca 0.00 -1.38 -0.17 0.00 0.00 0.00 0.00 44.72 43.16 3k0f s GLY 355 CO 0.00 -1.42 1.57 1.41 0.00 0.00 0.00 173.10 174.66 3k0f h LEU 356 N 1.83 -1.25 -0.50 0.66 4.07 -1.95 -0.34 115.31 117.83 3k0f h LEU 356 Ca -0.48 0.28 0.05 0.00 0.08 0.00 0.00 57.88 57.81 3k0f h LEU 356 Cb 1.23 0.66 -0.07 0.00 1.08 0.00 0.00 40.66 43.56 3k0f h LEU 356 CO 0.61 -0.29 -0.36 1.05 -1.08 0.00 0.00 178.44 178.37 3k0f h GLU 357 N -0.06 -0.08 -0.35 1.13 4.11 -1.96 0.97 114.58 118.35 3k0f h GLU 357 Ca 0.32 0.01 0.08 0.00 0.07 0.00 0.00 59.36 59.83 3k0f h GLU 357 Cb 0.59 0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.77 3k0f h GLU 357 CO -0.87 -0.05 -0.28 -0.44 0.07 0.00 0.00 179.01 177.44 3k0f h ASP 358 N -0.08 -0.92 -0.41 3.06 3.32 -1.54 -0.86 116.42 118.98 3k0f h ASP 358 Ca 0.08 0.17 0.06 0.00 0.02 0.00 0.00 57.03 57.36 3k0f h ASP 358 Cb 0.29 0.44 -0.05 0.00 0.22 0.00 0.00 39.33 40.23 3k0f h ASP 358 CO -0.52 -0.30 0.11 0.45 -1.72 0.00 0.00 179.24 177.27 3k0f h HIS 359 N -0.23 0.19 -0.88 4.55 3.86 0.51 0.26 115.15 123.41 3k0f h HIS 359 Ca 0.17 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.40 3k0f h HIS 359 Cb 0.50 -0.03 -0.04 0.00 1.06 0.00 0.00 27.41 28.90 3k0f h HIS 359 CO -0.48 0.05 0.55 1.25 0.86 0.00 0.00 177.93 180.16 3k0f h LEU 360 N 0.26 1.04 0.43 2.43 6.46 0.16 -1.41 115.31 124.67 3k0f h LEU 360 Ca 0.19 -0.05 -0.02 0.00 -0.12 0.00 0.00 57.88 57.88 3k0f h LEU 360 Cb 0.21 -0.26 0.00 0.00 -0.73 0.00 0.00 40.66 39.89 3k0f h LEU 360 CO -0.23 0.78 -0.21 -0.61 -0.62 0.00 0.00 178.44 177.55 3k0f h GLN 361 N 1.20 -0.56 -0.92 1.25 4.15 -0.53 -0.47 115.11 119.24 3k0f h GLN 361 Ca 0.32 0.04 0.17 0.00 0.77 0.00 0.00 58.65 59.95 3k0f h GLN 361 Cb -0.08 0.13 -0.17 0.00 0.21 0.00 0.00 27.48 27.57 3k0f h GLN 361 CO -0.06 -0.25 -0.27 0.82 -1.93 0.00 0.00 178.83 177.14 3k0f h ILE 362 N -0.95 0.07 0.13 2.39 1.08 -0.80 0.65 117.51 120.07 3k0f h ILE 362 Ca -0.06 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.42 3k0f h ILE 362 Cb 0.57 0.07 -0.03 0.00 -3.07 0.00 0.00 36.82 34.36 3k0f h ILE 362 CO 0.10 0.00 -0.21 0.40 -0.69 0.00 0.00 178.15 177.75 3k0f h ILE 363 N -0.01 0.53 -0.48 -0.67 2.04 -1.14 -0.14 117.51 117.64 3k0f h ILE 363 Ca 0.41 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.36 3k0f h ILE 363 Cb 0.65 0.53 -0.08 0.00 -0.74 0.00 0.00 36.82 37.19 3k0f h ILE 363 CO -0.94 0.00 0.01 0.11 0.00 0.00 0.00 178.15 177.33 3k0f h LYS 364 N -0.41 0.12 0.03 2.37 1.57 0.17 -1.56 116.57 118.87 3k0f h LYS 364 Ca 0.02 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3k0f h LYS 364 Cb 0.42 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.70 3k0f h LYS 364 CO -0.10 0.08 -0.06 1.03 -0.57 0.00 0.00 179.45 179.83 3k0f h SER 365 N 0.13 -0.17 -0.81 0.86 0.87 0.42 -2.12 113.55 112.73 3k0f h SER 365 Ca 0.24 0.02 0.23 0.00 -1.23 0.00 0.00 61.79 61.05 3k0f h SER 365 Cb 0.35 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.34 3k0f h SER 365 CO -0.39 -0.07 0.87 -0.08 -0.53 0.00 0.00 176.83 176.63 3k0f h GLU 366 N -0.10 0.00 0.00 2.24 4.57 -0.82 1.15 114.58 121.62 3k0f h GLU 366 Ca -0.00 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 3k0f h GLU 366 Cb 0.09 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 3k0f h GLU 366 CO -0.02 0.00 -0.48 0.82 -1.18 0.00 0.00 179.01 178.15 3k0f h ILE 367 N 0.00 0.87 0.09 2.32 2.04 -0.63 -3.21 117.51 119.00 3k0f h ILE 367 Ca 0.38 -2.05 -0.24 0.00 1.00 0.00 0.00 64.86 63.95 3k0f h ILE 367 Cb 2.11 2.30 -0.01 0.00 -0.74 0.00 0.00 36.82 40.49 3k0f h ILE 367 CO -0.00 0.47 -1.25 0.78 0.00 0.00 0.00 178.15 178.15 3k0f h ASN 368 N 0.00 0.29 0.00 1.72 2.35 0.17 -2.72 115.58 117.40 3k0f h ASN 368 Ca -0.00 -0.82 0.00 0.00 -0.55 0.00 0.00 56.30 54.92 3k0f h ASN 368 Cb 1.26 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.54 3k0f h ASN 368 CO 0.06 1.54 0.00 0.47 -1.65 0.00 0.00 177.43 177.85 3k0f n ASP 369 N -4.06 0.00 0.00 5.81 8.00 -0.73 -3.38 116.55 122.19 3k0f n ASP 369 Ca -0.24 -1.11 0.00 0.00 0.71 0.00 0.00 54.79 54.14 3k0f n ASP 369 Cb 0.83 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.93 3k0f n ASP 369 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 3k0f n PHE 370 N -0.54 0.00 -3.72 1.24 7.35 -1.21 -5.05 117.46 115.52 3k0f n PHE 370 Ca 0.01 0.00 -0.22 0.00 -0.76 0.00 0.00 57.45 56.48 3k0f n PHE 370 Cb 0.01 0.03 -0.04 0.00 0.35 0.00 0.00 39.48 39.82 3k0f n PHE 370 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 3k0f n LYS 371 N 0.00 -0.84 -0.64 -4.13 -0.00 -1.02 -4.87 118.16 106.66 3k0f n LYS 371 Ca 0.00 -0.01 -0.31 0.00 -0.00 0.00 0.00 58.31 57.99 3k0f n LYS 371 Cb 0.27 -1.90 0.19 0.00 -0.00 0.00 0.00 35.03 33.59 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 -3.30 -1.43 0.00 -1.58 -0.02 -1.26 -4.80 135.00 122.61 3k0f n PRO 372 Ca -0.16 -0.38 0.00 0.00 -2.02 0.00 0.00 63.50 60.93 3k0f n PRO 372 Cb 0.41 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 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 -4.40 1.32 -3.66 3.55 0.00 -1.15 -4.86 120.51 111.31 3k0f n ALA 373 Ca 0.04 -0.17 -0.06 0.00 0.00 0.00 0.00 53.44 53.25 3k0f n ALA 373 Cb 0.56 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.94 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 -0.24 0.49 0.05 0.00 0.52 -1.23 -2.96 118.95 115.57 3k0f s ARG 374 Ca 0.00 1.15 0.07 0.00 -0.52 0.00 0.00 55.73 56.43 3k0f s ARG 374 Cb 0.00 0.38 -0.03 0.00 0.52 0.00 0.00 34.95 35.83 3k0f s ARG 374 CO 0.00 -0.20 -0.21 -1.50 0.02 0.00 0.00 175.30 173.41 3k0f s ILE 375 N 2.27 1.68 -0.04 1.52 2.07 -0.01 -1.90 121.20 126.79 3k0f s ILE 375 Ca -0.06 -1.24 0.00 0.00 -1.41 0.00 0.00 60.65 57.94 3k0f s ILE 375 Cb -0.10 -1.47 0.03 0.00 0.13 0.00 0.00 42.46 41.05 3k0f s ILE 375 CO -0.16 0.18 -0.00 0.00 -1.91 0.00 0.00 174.94 173.05 3k0f s ALA 376 N -0.84 0.40 -0.48 1.50 0.00 -0.94 -0.46 121.76 120.95 3k0f s ALA 376 Ca 0.07 0.11 -0.04 0.00 0.00 0.00 0.00 51.96 52.10 3k0f s ALA 376 Cb -0.09 -0.39 0.13 0.00 0.00 0.00 0.00 23.12 22.77 3k0f s ALA 376 CO 0.02 -0.12 0.29 0.42 0.00 0.00 0.00 175.76 176.37 3k0f s ILE 377 N 1.14 3.54 -0.38 0.00 1.01 -0.47 -1.54 121.20 124.49 3k0f s ILE 377 Ca -0.08 -2.27 -0.29 0.00 0.00 0.00 0.00 60.65 58.01 3k0f s ILE 377 Cb -0.13 -3.38 0.00 0.00 0.01 0.00 0.00 42.46 38.96 3k0f s ILE 377 CO -0.02 -0.76 1.54 -0.62 0.00 0.00 0.00 174.94 175.09 3k0f s ASP 378 N 1.63 6.19 -0.01 3.58 -1.08 -0.77 -2.41 116.67 123.81 3k0f s ASP 378 Ca 0.10 0.98 -0.00 0.00 -0.52 0.00 0.00 52.55 53.11 3k0f s ASP 378 Cb -0.22 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.70 3k0f s ASP 378 CO -0.04 -1.52 0.01 -0.24 0.52 0.00 0.00 175.17 173.90 3k0f n SER 379 N 9.30 -2.08 -0.16 -0.34 2.88 -1.25 -3.73 113.62 118.24 3k0f n SER 379 Ca 0.19 0.01 -0.07 0.00 -1.33 0.00 0.00 58.87 57.66 3k0f n SER 379 Cb 0.48 -1.06 0.02 0.00 -0.75 0.00 0.00 64.21 62.89 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 0.03 0.57 0.00 2.46 3.38 -0.50 0.18 115.31 121.44 3k0f h LEU 380 Ca 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3k0f h LEU 380 Cb 0.01 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.62 3k0f h LEU 380 CO 0.00 0.44 0.01 -1.54 0.09 0.00 0.00 178.44 177.44 3k0f n SER 381 N -4.72 0.00 0.04 -0.43 3.41 -1.26 0.55 113.62 111.20 3k0f n SER 381 Ca 0.02 0.14 -0.21 0.00 -0.26 0.00 0.00 58.87 58.56 3k0f n SER 381 Cb 0.04 -0.14 -0.14 0.00 -0.26 0.00 0.00 64.21 63.71 3k0f n SER 381 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3k0f h ALA 382 N 1.93 0.33 0.00 7.33 0.00 -1.29 -3.27 119.26 124.28 3k0f h ALA 382 Ca 0.00 -1.27 -0.02 0.00 0.00 0.00 0.00 54.91 53.62 3k0f h ALA 382 Cb 0.01 0.55 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 3k0f h ALA 382 CO 0.00 1.20 -0.10 -0.07 0.00 0.00 0.00 179.25 180.28 3k0f h LEU 383 N 0.08 0.00 -1.84 0.00 3.38 0.10 -2.87 115.31 114.16 3k0f h LEU 383 Ca -0.36 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.58 3k0f h LEU 383 Cb 2.06 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.81 3k0f h LEU 383 CO 0.13 0.10 -0.11 0.00 0.09 0.00 0.00 178.44 178.65 3k0f h ALA 384 N 1.90 1.19 -1.68 1.53 0.00 -1.20 -3.43 119.26 117.57 3k0f h ALA 384 Ca -0.00 -0.10 -0.65 0.00 0.00 0.00 0.00 54.91 54.15 3k0f h ALA 384 Cb 0.78 -0.02 0.08 0.00 0.00 0.00 0.00 17.79 18.64 3k0f h ALA 384 CO 0.01 0.14 0.18 0.54 0.00 0.00 0.00 179.25 180.12 3k0f n ARG 385 N -3.50 1.04 0.00 0.00 1.74 -1.08 -3.46 116.66 111.39 3k0f n ARG 385 Ca -0.01 0.37 0.00 0.00 -0.77 0.00 0.00 57.85 57.43 3k0f n ARG 385 Cb 0.26 -1.81 0.00 0.00 -1.02 0.00 0.00 32.46 29.89 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 1.88 0.54 3.45 -0.13 0.00 -1.26 -4.92 105.19 104.75 3k0f n GLY 386 Ca 0.15 -0.01 -0.45 0.00 0.00 0.00 0.00 46.02 45.71 3k0f n GLY 386 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3k0f n VAL 387 N 0.00 1.81 -0.62 1.61 0.31 -1.23 -4.93 118.33 115.28 3k0f n VAL 387 Ca 0.00 -0.50 -0.28 0.00 -0.01 0.00 0.00 64.34 63.55 3k0f n VAL 387 Cb 0.00 -0.37 0.24 0.00 -0.91 0.00 0.00 33.84 32.80 3k0f n VAL 387 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3k0f s SER 388 N -0.87 1.19 0.18 4.52 1.04 -1.26 -4.83 113.70 113.67 3k0f s SER 388 Ca 0.62 1.51 -0.05 0.00 0.48 0.00 0.00 55.95 58.51 3k0f s SER 388 Cb -0.77 -2.26 0.06 0.00 0.10 0.00 0.00 66.02 63.15 3k0f s SER 388 CO 0.58 -4.07 1.48 -1.13 0.98 0.00 0.00 173.24 171.08 3k0f h ASN 389 N -2.53 0.69 -0.20 7.02 -0.73 -1.95 -2.60 115.58 115.28 3k0f h ASN 389 Ca -0.60 -0.37 -0.19 0.00 1.87 0.00 0.00 56.30 57.00 3k0f h ASN 389 Cb 1.33 -0.20 0.00 0.00 0.27 0.00 0.00 38.32 39.72 3k0f h ASN 389 CO 0.51 1.11 -0.59 0.78 -0.37 0.00 0.00 177.43 178.86 3k0f h ASN 390 N 0.47 0.91 0.26 1.15 2.35 -1.99 -0.50 115.58 118.24 3k0f h ASN 390 Ca 0.01 -0.51 -0.03 0.00 -0.55 0.00 0.00 56.30 55.21 3k0f h ASN 390 Cb 1.12 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 39.23 3k0f h ASN 390 CO 0.11 1.30 -0.15 0.00 -1.65 0.00 0.00 177.43 177.03 3k0f h ALA 391 N 0.71 1.49 0.08 -0.83 0.00 -1.92 -0.24 119.26 118.55 3k0f h ALA 391 Ca 0.00 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.64 3k0f h ALA 391 Cb 1.20 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.98 3k0f h ALA 391 CO 0.13 0.19 -0.57 0.35 0.00 0.00 0.00 179.25 179.35 3k0f h PHE 392 N 0.00 0.42 -0.37 0.00 3.57 -1.17 -3.12 116.94 116.28 3k0f h PHE 392 Ca -0.00 -0.29 -0.01 0.00 3.53 0.00 0.00 57.97 61.20 3k0f h PHE 392 Cb 0.33 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.02 3k0f h PHE 392 CO 0.00 1.19 0.18 0.00 -2.23 0.00 0.00 178.31 177.44 3k0f h ARG 393 N -0.46 0.51 -0.77 1.11 3.08 -0.71 0.40 114.38 117.54 3k0f h ARG 393 Ca -0.09 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 59.85 3k0f h ARG 393 Cb 1.41 -0.10 -0.03 0.00 0.08 0.00 0.00 29.97 31.32 3k0f h ARG 393 CO 0.11 0.40 0.28 0.37 -1.07 0.00 0.00 179.97 180.06 3k0f h GLN 394 N 0.52 1.18 0.17 0.04 4.15 -1.12 0.13 115.11 120.18 3k0f h GLN 394 Ca 0.13 -0.23 -0.01 0.00 0.77 0.00 0.00 58.65 59.31 3k0f h GLN 394 Cb 0.06 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 27.57 3k0f h GLN 394 CO -0.02 0.98 -0.08 0.35 -1.93 0.00 0.00 178.83 178.13 3k0f h PHE 395 N 1.14 -0.22 -0.35 3.99 3.57 -1.17 -1.34 116.94 122.58 3k0f h PHE 395 Ca 0.25 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.85 3k0f h PHE 395 Cb 0.26 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 3k0f h PHE 395 CO 0.02 0.11 0.25 0.28 -2.23 0.00 0.00 178.31 176.74 3k0f h VAL 396 N -0.56 0.84 -0.10 1.41 2.07 -0.67 0.32 116.25 119.56 3k0f h VAL 396 Ca -0.02 -0.01 -0.22 0.00 0.82 0.00 0.00 66.70 67.27 3k0f h VAL 396 Cb 0.42 0.82 0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3k0f h VAL 396 CO 0.04 0.00 -0.81 0.40 0.02 0.00 0.00 177.57 177.23 3k0f h ILE 397 N 0.02 1.32 0.91 4.57 1.08 -0.56 -2.36 117.51 122.48 3k0f h ILE 397 Ca 0.16 -2.09 -0.04 0.00 -0.39 0.00 0.00 64.86 62.50 3k0f h ILE 397 Cb 0.63 2.10 0.01 0.00 -3.07 0.00 0.00 36.82 36.49 3k0f h ILE 397 CO -0.00 0.65 -0.44 1.23 -0.69 0.00 0.00 178.15 178.90 3k0f h GLY 398 N 0.83 -1.27 0.99 5.37 0.00 0.72 0.15 103.07 109.86 3k0f h GLY 398 Ca -0.06 0.47 -0.01 0.00 0.00 0.00 0.00 47.33 47.74 3k0f h GLY 398 CO 0.15 -0.46 0.31 -2.08 0.00 0.00 0.00 176.54 174.46 3k0f h VAL 399 N -1.33 1.17 0.00 4.60 2.07 -1.10 -0.31 116.25 121.35 3k0f h VAL 399 Ca -0.12 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 66.96 3k0f h VAL 399 Cb 0.93 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3k0f h VAL 399 CO 0.20 0.17 -0.21 0.74 0.02 0.00 0.00 177.57 178.49 3k0f h THR 400 N 0.71 0.83 0.00 2.57 2.02 -1.45 -2.82 112.91 114.77 3k0f h THR 400 Ca 0.19 -0.84 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 3k0f h THR 400 Cb 0.01 1.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3k0f h THR 400 CO -0.03 0.21 -0.17 1.23 0.37 0.00 0.00 175.52 177.13 3k0f h GLY 401 N 1.05 0.00 0.19 2.16 0.00 -0.09 -2.99 103.07 103.40 3k0f h GLY 401 Ca -0.00 0.00 0.18 0.00 0.00 0.00 0.00 47.33 47.51 3k0f h GLY 401 CO 0.03 0.00 0.62 -1.82 0.00 0.00 0.00 176.54 175.36 3k0f h TYR 402 N -1.00 1.04 -0.15 5.60 3.20 -1.13 -1.54 116.97 123.00 3k0f h TYR 402 Ca -0.03 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.83 3k0f h TYR 402 Cb 0.55 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 3k0f h TYR 402 CO 0.10 0.26 -0.06 0.00 -1.64 0.00 0.00 178.16 176.82 3k0f h ALA 403 N 1.63 0.20 -0.98 1.82 0.00 -1.64 -2.44 119.26 117.85 3k0f h ALA 403 Ca 0.56 -0.26 0.07 0.00 0.00 0.00 0.00 54.91 55.29 3k0f h ALA 403 Cb 0.86 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.53 3k0f h ALA 403 CO -0.35 -0.01 0.63 0.87 0.00 0.00 0.00 179.25 180.39 3k0f h LYS 404 N -0.03 1.08 -0.00 0.00 1.57 -1.14 -0.78 116.57 117.27 3k0f h LYS 404 Ca 0.03 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 3k0f h LYS 404 Cb 0.51 -0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.58 3k0f h LYS 404 CO 0.02 0.72 -0.09 0.00 -0.57 0.00 0.00 179.45 179.52 3k0f n GLN 405 N -4.51 0.80 -0.26 3.15 10.64 -0.88 -3.22 117.38 123.10 3k0f n GLN 405 Ca 0.15 -0.28 0.07 0.00 -1.83 0.00 0.00 57.00 55.12 3k0f n GLN 405 Cb 0.21 -1.49 0.21 0.00 -0.86 0.00 0.00 30.24 28.31 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 -0.86 2.89 -0.45 2.61 4.07 -0.34 -4.92 120.64 123.65 3k0f n GLU 406 Ca 0.16 -2.29 0.00 0.00 -0.06 0.00 0.00 57.16 54.97 3k0f n GLU 406 Cb 0.27 -1.41 0.00 0.00 -0.06 0.00 0.00 31.44 30.24 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 0.75 0.00 -2.10 5.31 -0.58 -0.95 -4.90 120.64 118.17 3k0f n GLU 407 Ca 0.16 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.47 3k0f n GLU 407 Cb 0.53 -4.29 -0.03 0.00 -0.57 0.00 0.00 31.44 27.08 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 -0.95 3.70 0.50 -3.67 1.01 -1.04 -4.50 121.20 116.25 3k0f s ILE 408 Ca 0.00 0.80 -0.21 0.00 0.00 0.00 0.00 60.65 61.24 3k0f s ILE 408 Cb 0.00 -3.67 -0.06 0.00 0.01 0.00 0.00 42.46 38.74 3k0f s ILE 408 CO 0.00 -0.24 1.16 -0.89 0.00 0.00 0.00 174.94 174.97 3k0f s THR 409 N 4.96 3.07 -0.04 2.92 2.01 -1.16 -4.54 115.64 122.85 3k0f s THR 409 Ca 0.71 0.74 -0.05 0.00 0.31 0.00 0.00 61.69 63.40 3k0f s THR 409 Cb -0.26 -3.34 0.01 0.00 0.01 0.00 0.00 72.50 68.92 3k0f s THR 409 CO 0.29 -0.07 0.14 -0.83 -0.69 0.00 0.00 174.62 173.45 3k0f s GLY 410 N -1.52 -0.07 -0.22 4.40 0.00 -1.18 -0.83 107.32 107.89 3k0f s GLY 410 Ca 0.68 0.29 -0.02 0.00 0.00 0.00 0.00 44.72 45.68 3k0f s GLY 410 CO 0.32 0.22 -0.09 -2.27 0.00 0.00 0.00 173.10 171.28 3k0f s LEU 411 N -0.21 2.83 -0.08 0.66 2.96 0.40 -0.39 118.68 124.85 3k0f s LEU 411 Ca -0.03 -0.66 0.01 0.00 -0.22 0.00 0.00 54.13 53.23 3k0f s LEU 411 Cb -0.02 -1.64 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 3k0f s LEU 411 CO 0.00 -0.06 -0.09 -0.36 -1.32 0.00 0.00 176.35 174.53 3k0f s PHE 412 N 1.37 2.88 0.17 5.38 0.40 0.20 -1.37 117.98 127.01 3k0f s PHE 412 Ca 0.03 -0.11 0.05 0.00 -0.60 0.00 0.00 56.93 56.30 3k0f s PHE 412 Cb -0.15 -1.73 -0.04 0.00 0.51 0.00 0.00 43.02 41.61 3k0f s PHE 412 CO -0.06 0.21 0.13 0.99 0.70 0.00 0.00 175.22 177.19 3k0f s THR 413 N -0.57 4.43 -0.25 0.64 2.01 -1.01 0.04 115.64 120.93 3k0f s THR 413 Ca 0.08 -1.14 -0.16 0.00 0.31 0.00 0.00 61.69 60.79 3k0f s THR 413 Cb -0.12 -3.27 0.07 0.00 0.01 0.00 0.00 72.50 69.19 3k0f s THR 413 CO 0.02 -0.13 0.64 0.21 -0.69 0.00 0.00 174.62 174.66 3k0f s ASN 414 N -3.17 -0.83 -0.32 3.53 2.47 0.11 0.11 114.94 116.84 3k0f s ASN 414 Ca 0.31 1.37 -0.09 0.00 0.42 0.00 0.00 52.86 54.88 3k0f s ASN 414 Cb -0.10 1.27 0.01 0.00 -1.45 0.00 0.00 41.25 40.99 3k0f s ASN 414 CO 0.23 -0.23 0.13 -0.89 -3.72 0.00 0.00 177.10 172.63 3k0f s THR 415 N 1.35 4.27 -0.12 -5.21 2.01 -1.26 -3.22 115.64 113.46 3k0f s THR 415 Ca -0.08 -0.70 -0.29 0.00 0.31 0.00 0.00 61.69 60.92 3k0f s THR 415 Cb -0.05 -3.26 -0.02 0.00 0.01 0.00 0.00 72.50 69.17 3k0f s THR 415 CO -0.15 -0.03 1.24 -0.94 -0.69 0.00 0.00 174.62 174.05 3k0f s SER 416 N 1.53 6.98 0.00 3.53 1.04 -0.98 -4.88 113.70 120.92 3k0f s SER 416 Ca 0.03 1.74 0.00 0.00 0.48 0.00 0.00 55.95 58.19 3k0f s SER 416 Cb -0.18 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.40 3k0f s SER 416 CO 0.05 -0.70 0.53 0.47 0.98 0.00 0.00 173.24 174.57 3k0f n ASP 417 N 6.09 0.00 -3.58 7.02 8.00 -1.26 -4.26 116.55 128.56 3k0f n ASP 417 Ca 0.13 0.12 -0.19 0.00 0.71 0.00 0.00 54.79 55.55 3k0f n ASP 417 Cb 0.45 -0.12 -0.15 0.00 -0.02 0.00 0.00 41.12 41.28 3k0f n ASP 417 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k0f s GLN 418 N -2.07 0.10 0.07 -1.24 -2.07 -1.26 -5.06 119.66 108.13 3k0f s GLN 418 Ca 0.00 0.28 -0.31 0.00 -1.82 0.00 0.00 55.36 53.51 3k0f s GLN 418 Cb 0.00 -0.99 -0.08 0.00 -1.09 0.00 0.00 33.01 30.85 3k0f s GLN 418 CO 0.00 -0.53 1.58 -0.59 -1.32 0.00 0.00 175.29 174.44 3k0f s PHE 419 N 2.27 2.62 0.24 9.60 -0.12 -1.26 -3.89 117.98 127.45 3k0f s PHE 419 Ca 0.04 0.48 0.00 0.00 -0.05 0.00 0.00 56.93 57.40 3k0f s PHE 419 Cb -0.14 -3.89 0.00 0.00 -0.63 0.00 0.00 43.02 38.35 3k0f s PHE 419 CO -0.09 -3.48 0.00 -1.33 -0.05 0.00 0.00 175.22 170.27 3k0f n MET 420 N 5.26 -4.95 -0.07 1.99 2.81 -1.26 -4.79 117.12 116.11 3k0f n MET 420 Ca 0.15 3.56 0.00 0.00 -1.81 0.00 0.00 57.70 59.60 3k0f n MET 420 Cb 0.41 -3.82 0.00 0.00 -0.71 0.00 0.00 33.22 29.10 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 1.29 0.47 3.59 3.03 0.00 -1.17 -4.95 105.19 107.45 3k0f n GLY 421 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3k0f n GLY 421 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k0f s ALA 422 N -2.19 2.60 -0.66 4.61 0.00 -1.25 -4.84 121.76 120.03 3k0f s ALA 422 Ca 0.00 0.47 0.23 0.00 0.00 0.00 0.00 51.96 52.66 3k0f s ALA 422 Cb 0.00 -4.10 0.90 0.00 0.00 0.00 0.00 23.12 19.92 3k0f s ALA 422 CO 0.00 -3.01 1.71 0.72 0.00 0.00 0.00 175.76 175.17 3k0f n HIS 423 N 11.88 0.65 -4.11 0.00 8.25 -1.26 -4.82 115.22 125.81 3k0f n HIS 423 Ca 0.28 0.23 -0.14 0.00 -0.26 0.00 0.00 57.72 57.84 3k0f n HIS 423 Cb 0.47 -0.88 -0.11 0.00 1.12 0.00 0.00 29.99 30.59 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 -4.02 1.14 0.04 0.41 1.04 -1.26 -5.07 113.70 105.98 3k0f s SER 424 Ca 0.07 -0.66 -0.21 0.00 0.48 0.00 0.00 55.95 55.63 3k0f s SER 424 Cb 0.11 0.02 -0.11 0.00 0.10 0.00 0.00 66.02 66.14 3k0f s SER 424 CO 0.43 -0.22 1.32 0.40 0.98 0.00 0.00 173.24 176.15 3k0f h ILE 425 N 4.11 0.00 -3.90 -1.02 5.03 -2.02 -3.43 117.51 116.28 3k0f h ILE 425 Ca -0.37 0.00 -0.66 0.00 -0.12 0.00 0.00 64.86 63.71 3k0f h ILE 425 Cb 1.19 0.00 -0.32 0.00 -3.03 0.00 0.00 36.82 34.67 3k0f h ILE 425 CO 0.46 0.00 -0.88 0.00 -0.68 0.00 0.00 178.15 177.05 3k0f s ALA 426 N -4.71 2.04 -0.92 1.87 0.00 -1.26 -4.84 121.76 113.94 3k0f s ALA 426 Ca -0.11 -0.97 0.13 0.00 0.00 0.00 0.00 51.96 51.01 3k0f s ALA 426 Cb 0.02 -0.66 0.55 0.00 0.00 0.00 0.00 23.12 23.02 3k0f s ALA 426 CO 0.34 0.37 1.40 -0.25 0.00 0.00 0.00 175.76 177.62 3k0f n ASP 427 N 3.07 0.09 -0.00 0.00 8.00 -1.26 -2.45 116.55 123.99 3k0f n ASP 427 Ca -0.18 0.53 0.09 0.00 0.71 0.00 0.00 54.79 55.94 3k0f n ASP 427 Cb 0.52 -0.54 -0.13 0.00 -0.02 0.00 0.00 41.12 40.95 3k0f n ASP 427 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 3k0f n SER 428 N -1.60 0.75 -1.34 -2.24 3.41 -1.26 -5.03 113.62 106.31 3k0f n SER 428 Ca 0.02 -0.48 -0.08 0.00 -0.26 0.00 0.00 58.87 58.07 3k0f n SER 428 Cb 0.14 1.42 0.02 0.00 -0.26 0.00 0.00 64.21 65.53 3k0f n SER 428 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3k0f n HIS 429 N -1.79 -0.79 -2.62 7.33 8.25 -1.02 -5.00 115.22 119.57 3k0f n HIS 429 Ca 0.00 0.22 -0.43 0.00 -0.26 0.00 0.00 57.72 57.25 3k0f n HIS 429 Cb 0.39 -2.35 0.00 0.00 1.12 0.00 0.00 29.99 29.15 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 -3.67 4.28 0.00 1.59 2.08 -1.26 -4.71 119.36 117.66 3k0f n ILE 430 Ca -0.04 -4.52 0.00 0.00 0.56 0.00 0.00 62.75 58.75 3k0f n ILE 430 Cb 0.54 -2.41 0.00 0.00 -0.75 0.00 0.00 39.64 37.02 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 4.84 0.00 1.10 -1.39 0.00 -1.26 -3.62 120.51 120.18 3k0f n ALA 432 Ca 0.39 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.96 3k0f n ALA 432 Cb 0.40 0.00 0.54 0.00 0.00 0.00 0.00 19.45 20.38 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 0.00 0.00 -4.75 0.00 -0.00 -1.26 -4.84 119.36 108.50 3k0f n ILE 433 Ca 0.00 -0.01 -0.33 0.00 -0.00 0.00 0.00 62.75 62.41 3k0f n ILE 433 Cb 0.00 -0.24 -0.13 0.00 -0.00 0.00 0.00 39.64 39.27 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 -2.88 3.28 -0.07 1.39 -1.32 -1.24 -4.93 115.64 109.87 3k0f s THR 434 Ca 0.17 -0.62 -0.24 0.00 -1.21 0.00 0.00 61.69 59.79 3k0f s THR 434 Cb 0.19 -2.34 -0.29 0.00 -1.51 0.00 0.00 72.50 68.55 3k0f s THR 434 CO 0.56 0.56 0.88 0.44 -2.21 0.00 0.00 174.62 174.85 3k0f h ASP 435 N 5.87 0.34 -4.36 8.08 3.32 -1.85 -3.47 116.42 124.36 3k0f h ASP 435 Ca -0.39 -0.95 -0.60 0.00 0.02 0.00 0.00 57.03 55.11 3k0f h ASP 435 Cb 1.18 -0.11 -0.30 0.00 0.22 0.00 0.00 39.33 40.32 3k0f h ASP 435 CO 0.54 1.26 -0.85 -0.89 -1.72 0.00 0.00 179.24 177.58 3k0f s THR 436 N -2.44 1.60 -0.11 0.35 2.01 -0.91 -2.24 115.64 113.90 3k0f s THR 436 Ca -0.15 -0.86 0.01 0.00 0.31 0.00 0.00 61.69 61.00 3k0f s THR 436 Cb -0.00 -1.33 0.02 0.00 0.01 0.00 0.00 72.50 71.20 3k0f s THR 436 CO 0.79 0.45 -0.13 -0.63 -0.69 0.00 0.00 174.62 174.41 3k0f s ILE 437 N -0.42 1.34 -0.32 1.82 1.01 0.10 -0.64 121.20 124.09 3k0f s ILE 437 Ca 0.06 -0.53 -0.06 0.00 0.00 0.00 0.00 60.65 60.12 3k0f s ILE 437 Cb -0.08 -1.25 0.03 0.00 0.01 0.00 0.00 42.46 41.17 3k0f s ILE 437 CO -0.00 0.41 0.09 -0.63 0.00 0.00 0.00 174.94 174.81 3k0f s ILE 438 N 1.17 3.75 -0.30 2.92 -1.09 0.79 -1.89 121.20 126.54 3k0f s ILE 438 Ca -0.04 -1.04 -0.07 0.00 -2.23 0.00 0.00 60.65 57.27 3k0f s ILE 438 Cb -0.14 -3.07 0.00 0.00 -1.58 0.00 0.00 42.46 37.67 3k0f s ILE 438 CO -0.03 -0.10 0.10 -0.22 -1.23 0.00 0.00 174.94 173.45 3k0f s LEU 439 N 1.41 3.89 0.09 2.97 2.96 -0.04 -1.05 118.68 128.90 3k0f s LEU 439 Ca -0.01 -0.64 0.03 0.00 -0.22 0.00 0.00 54.13 53.29 3k0f s LEU 439 Cb -0.19 -1.91 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 3k0f s LEU 439 CO 0.02 -0.18 0.08 -0.76 -1.32 0.00 0.00 176.35 174.19 3k0f s LEU 440 N 1.53 3.79 0.15 -0.68 1.43 0.72 -0.06 118.68 125.57 3k0f s LEU 440 Ca 0.03 -0.03 -0.24 0.00 -1.03 0.00 0.00 54.13 52.87 3k0f s LEU 440 Cb -0.17 -2.47 0.07 0.00 0.03 0.00 0.00 46.19 43.65 3k0f s LEU 440 CO 0.03 0.16 0.67 0.00 0.23 0.00 0.00 176.35 177.44 3k0f s GLN 441 N -2.48 1.29 -0.18 1.70 -2.07 -0.36 -3.79 119.66 113.78 3k0f s GLN 441 Ca 0.29 -0.53 -0.12 0.00 -1.82 0.00 0.00 55.36 53.18 3k0f s GLN 441 Cb -0.12 0.56 -0.05 0.00 -1.09 0.00 0.00 33.01 32.31 3k0f s GLN 441 CO 0.22 -0.57 0.24 0.71 -1.32 0.00 0.00 175.29 174.57 3k0f s TYR 442 N -3.67 3.44 -0.12 9.60 4.12 -1.26 -1.01 117.35 128.44 3k0f s TYR 442 Ca 0.03 0.49 -0.02 0.00 0.02 0.00 0.00 57.07 57.60 3k0f s TYR 442 Cb -0.02 -2.28 -0.03 0.00 -1.52 0.00 0.00 41.96 38.11 3k0f s TYR 442 CO -0.09 0.24 -0.06 0.08 0.02 0.00 0.00 175.55 175.75 3k0f s VAL 443 N 0.47 3.75 -0.56 0.71 1.01 0.13 -4.64 120.40 121.27 3k0f s VAL 443 Ca 0.13 -0.43 -0.20 0.00 0.00 0.00 0.00 61.98 61.49 3k0f s VAL 443 Cb -0.12 -2.60 0.08 0.00 0.00 0.00 0.00 36.38 33.73 3k0f s VAL 443 CO 0.02 0.53 0.72 -0.70 0.00 0.00 0.00 175.10 175.67 3k0f s GLU 444 N -0.03 3.11 -0.13 2.72 2.12 0.81 -1.41 118.70 125.89 3k0f s GLU 444 Ca 0.00 -1.00 0.00 0.00 0.36 0.00 0.00 54.97 54.33 3k0f s GLU 444 Cb -0.13 -4.17 0.02 0.00 0.26 0.00 0.00 34.13 30.11 3k0f s GLU 444 CO 0.03 -1.43 -0.11 0.42 -0.54 0.00 0.00 175.26 173.62 3k0f s ILE 445 N 2.91 1.35 -0.50 -3.70 -1.09 -0.61 -4.11 121.20 115.44 3k0f s ILE 445 Ca 0.16 -0.49 -0.27 0.00 -2.23 0.00 0.00 60.65 57.82 3k0f s ILE 445 Cb -0.20 -1.30 0.04 0.00 -1.58 0.00 0.00 42.46 39.42 3k0f s ILE 445 CO 0.10 0.42 0.64 0.54 -1.23 0.00 0.00 174.94 175.42 3k0f n ARG 446 N 4.83 -1.99 -0.62 2.79 1.74 -1.26 -2.16 116.66 119.99 3k0f n ARG 446 Ca -0.15 1.57 -0.02 0.00 -0.77 0.00 0.00 57.85 58.47 3k0f n ARG 446 Cb 0.50 -3.31 -0.01 0.00 -1.02 0.00 0.00 32.46 28.62 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 -0.45 0.21 3.15 -0.13 0.00 -1.26 -4.90 105.19 101.81 3k0f n GLY 447 Ca -0.05 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.29 0.77 -0.82 1.61 2.02 -0.92 -5.11 118.70 114.96 3k0f s GLU 448 Ca 0.00 -1.07 -0.17 0.00 0.02 0.00 0.00 54.97 53.75 3k0f s GLU 448 Cb 0.00 -0.47 0.16 0.00 0.10 0.00 0.00 34.13 33.92 3k0f s GLU 448 CO 0.00 0.07 0.90 -1.64 0.02 0.00 0.00 175.26 174.61 3k0f s MET 449 N -2.56 3.49 0.41 1.61 -1.94 -1.26 -1.58 119.30 117.47 3k0f s MET 449 Ca 0.02 -1.94 0.00 0.00 -1.71 0.00 0.00 55.69 52.06 3k0f s MET 449 Cb -0.04 -4.60 -0.02 0.00 2.01 0.00 0.00 34.83 32.19 3k0f s MET 449 CO -0.00 -1.54 0.63 -1.54 -0.01 0.00 0.00 175.02 172.55 3k0f s SER 450 N 3.06 6.03 0.36 3.03 1.04 -0.50 -4.89 113.70 121.83 3k0f s SER 450 Ca 0.23 0.37 0.02 0.00 0.48 0.00 0.00 55.95 57.04 3k0f s SER 450 Cb -0.11 -1.75 -0.02 0.00 0.10 0.00 0.00 66.02 64.25 3k0f s SER 450 CO -0.06 -0.54 0.54 -0.13 0.98 0.00 0.00 173.24 174.03 3k0f s ARG 451 N -4.47 3.31 -0.21 4.02 3.00 -1.26 -0.70 118.95 122.65 3k0f s ARG 451 Ca 0.45 -0.54 -0.05 0.00 0.00 0.00 0.00 55.73 55.60 3k0f s ARG 451 Cb -0.10 -2.69 0.11 0.00 0.00 0.00 0.00 34.95 32.27 3k0f s ARG 451 CO 0.37 0.06 0.37 0.00 0.00 0.00 0.00 175.30 176.11 3k0f s ALA 452 N -2.31 -1.03 -0.10 2.13 0.00 -0.18 -2.98 121.76 117.30 3k0f s ALA 452 Ca 0.42 1.13 -0.04 0.00 0.00 0.00 0.00 51.96 53.47 3k0f s ALA 452 Cb -0.10 -1.45 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 3k0f s ALA 452 CO 0.35 -0.99 0.05 -1.50 0.00 0.00 0.00 175.76 173.67 3k0f s ILE 453 N 2.55 4.73 -0.10 0.00 2.07 0.06 -1.22 121.20 129.28 3k0f s ILE 453 Ca 0.06 -0.10 -0.04 0.00 -1.41 0.00 0.00 60.65 59.16 3k0f s ILE 453 Cb -0.14 -3.02 0.05 0.00 0.13 0.00 0.00 42.46 39.48 3k0f s ILE 453 CO -0.14 0.60 0.20 0.21 -1.91 0.00 0.00 174.94 173.91 3k0f s ASN 454 N -0.95 0.13 -0.96 4.50 2.47 0.92 -1.50 114.94 119.54 3k0f s ASN 454 Ca 0.14 0.44 -0.24 0.00 0.42 0.00 0.00 52.86 53.62 3k0f s ASN 454 Cb -0.12 0.39 0.05 0.00 -1.45 0.00 0.00 41.25 40.12 3k0f s ASN 454 CO 0.03 -0.19 1.42 -0.69 -3.72 0.00 0.00 177.10 173.95 3k0f s VAL 455 N 1.71 3.88 0.04 -5.21 1.01 -1.26 -0.87 120.40 119.70 3k0f s VAL 455 Ca -0.04 -0.53 -0.25 0.00 0.00 0.00 0.00 61.98 61.16 3k0f s VAL 455 Cb -0.11 -5.03 -0.17 0.00 0.00 0.00 0.00 36.38 31.07 3k0f s VAL 455 CO -0.07 -1.92 1.49 0.15 0.00 0.00 0.00 175.10 174.74 3k0f h PHE 456 N 9.86 -0.15 -2.76 5.22 3.57 -1.71 -3.45 116.94 127.51 3k0f h PHE 456 Ca 0.11 -0.00 -0.11 0.00 3.53 0.00 0.00 57.97 61.49 3k0f h PHE 456 Cb 1.02 0.05 -0.22 0.00 2.79 0.00 0.00 35.95 39.59 3k0f h PHE 456 CO 1.25 0.09 -0.19 -1.59 -2.23 0.00 0.00 178.31 175.64 3k0f s LYS 457 N -5.29 0.63 -0.09 1.11 -2.85 -1.19 -4.97 119.74 107.09 3k0f s LYS 457 Ca -0.15 0.23 -0.04 0.00 -1.00 0.00 0.00 55.97 55.02 3k0f s LYS 457 Cb 0.04 0.29 0.05 0.00 -2.06 0.00 0.00 37.83 36.15 3k0f s LYS 457 CO 0.64 -0.14 0.19 -1.64 0.10 0.00 0.00 175.35 174.50 3k0f s MET 458 N -0.57 0.09 0.09 1.78 -1.94 -1.26 0.02 119.30 117.52 3k0f s MET 458 Ca -0.07 0.55 -0.15 0.00 -1.71 0.00 0.00 55.69 54.31 3k0f s MET 458 Cb -0.04 -0.18 -0.09 0.00 2.01 0.00 0.00 34.83 36.53 3k0f s MET 458 CO 0.03 -0.25 1.42 0.00 -0.01 0.00 0.00 175.02 176.21 3k0f h ARG 459 N 7.95 0.66 0.00 2.03 3.08 -1.83 -3.35 114.38 122.92 3k0f h ARG 459 Ca -0.24 -0.34 0.00 0.00 0.07 0.00 0.00 59.98 59.47 3k0f h ARG 459 Cb 1.13 0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.18 3k0f h ARG 459 CO 0.23 0.95 -1.24 0.41 -1.07 0.00 0.00 179.97 179.25 3k0f n GLY 460 N 0.14 -0.76 4.01 0.04 0.00 -1.26 -5.00 105.19 102.35 3k0f n GLY 460 Ca -0.04 -0.48 -0.18 0.00 0.00 0.00 0.00 46.02 45.31 3k0f n GLY 460 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3k0f s SER 461 N -3.27 5.44 -0.13 1.61 0.15 -1.26 -5.06 113.70 111.18 3k0f s SER 461 Ca 0.01 -0.41 -0.11 0.00 0.70 0.00 0.00 55.95 56.14 3k0f s SER 461 Cb 0.13 -0.51 -0.25 0.00 -1.71 0.00 0.00 66.02 63.68 3k0f s SER 461 CO 0.75 -0.98 0.38 -0.25 1.20 0.00 0.00 173.24 174.35 3k0f h TRP 462 N 0.41 0.40 -2.85 3.44 7.01 -1.86 -3.45 115.95 119.04 3k0f h TRP 462 Ca -0.39 -0.29 0.00 0.00 2.11 0.00 0.00 58.89 60.32 3k0f h TRP 462 Cb 1.28 -0.02 0.00 0.00 -2.10 0.00 0.00 29.16 28.33 3k0f h TRP 462 CO 0.37 1.69 -0.41 -2.39 -2.79 0.00 0.00 178.44 174.91 3k0f n HIS 463 N -3.75 -1.99 -1.97 2.65 1.44 -1.26 -4.87 115.22 105.47 3k0f n HIS 463 Ca -0.31 1.06 -0.41 0.00 -2.01 0.00 0.00 57.72 56.05 3k0f n HIS 463 Cb 0.96 -1.83 -0.02 0.00 0.12 0.00 0.00 29.99 29.22 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 -3.35 6.60 0.00 4.39 2.15 0.24 -4.92 116.67 121.79 3k0f s ASP 464 Ca 0.00 2.77 0.26 0.00 0.43 0.00 0.00 52.55 56.01 3k0f s ASP 464 Cb 0.00 -2.64 0.71 0.00 -0.30 0.00 0.00 42.92 40.69 3k0f s ASP 464 CO 0.00 -0.72 1.54 0.29 -0.17 0.00 0.00 175.17 176.11 3k0f n LYS 465 N 1.69 0.92 -1.99 4.34 4.76 -1.26 -4.51 118.16 122.11 3k0f n LYS 465 Ca 0.05 -0.57 -0.30 0.00 -2.87 0.00 0.00 58.31 54.61 3k0f n LYS 465 Cb 0.40 -1.49 0.01 0.00 -1.84 0.00 0.00 35.03 32.11 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 -2.47 3.15 -0.84 7.82 0.00 -1.26 -5.00 121.76 123.16 3k0f s ALA 466 Ca 0.25 -0.16 -0.06 0.00 0.00 0.00 0.00 51.96 51.99 3k0f s ALA 466 Cb 0.19 -3.00 0.21 0.00 0.00 0.00 0.00 23.12 20.52 3k0f s ALA 466 CO 0.51 -0.64 0.73 0.42 0.00 0.00 0.00 175.76 176.78 3k0f s ILE 467 N -3.11 4.67 0.88 0.00 1.01 -1.26 -4.48 121.20 118.90 3k0f s ILE 467 Ca 0.54 -3.26 -0.11 0.00 0.00 0.00 0.00 60.65 57.81 3k0f s ILE 467 Cb -0.11 -3.91 0.12 0.00 0.01 0.00 0.00 42.46 38.57 3k0f s ILE 467 CO 0.53 -1.03 1.09 -0.13 0.00 0.00 0.00 174.94 175.40 3k0f s ARG 468 N -0.66 1.43 -0.10 2.79 0.52 -0.56 -4.12 118.95 118.26 3k0f s ARG 468 Ca 0.23 0.78 -0.04 0.00 -0.52 0.00 0.00 55.73 56.19 3k0f s ARG 468 Cb -0.12 -1.83 -0.04 0.00 0.52 0.00 0.00 34.95 33.48 3k0f s ARG 468 CO -0.08 -2.11 0.05 -2.00 0.02 0.00 0.00 175.30 171.18 3k0f s GLU 469 N -4.98 3.15 -0.01 3.54 2.12 0.12 -0.76 118.70 121.88 3k0f s GLU 469 Ca 0.63 -0.31 0.00 0.00 0.36 0.00 0.00 54.97 55.65 3k0f s GLU 469 Cb -0.17 -2.94 0.00 0.00 0.26 0.00 0.00 34.13 31.29 3k0f s GLU 469 CO 0.56 0.73 -0.01 -0.59 -0.54 0.00 0.00 175.26 175.41 3k0f s PHE 470 N -0.94 0.15 0.06 5.30 -0.12 -1.16 -0.11 117.98 121.16 3k0f s PHE 470 Ca 0.14 -0.01 0.02 0.00 -0.05 0.00 0.00 56.93 57.03 3k0f s PHE 470 Cb -0.12 -0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.10 3k0f s PHE 470 CO 0.03 -0.02 0.09 0.00 -0.05 0.00 0.00 175.22 175.27 3k0f s MET 471 N 0.15 2.99 -0.27 1.99 0.23 -0.75 -4.03 119.30 119.60 3k0f s MET 471 Ca -0.01 -0.61 -0.03 0.00 -1.03 0.00 0.00 55.69 54.01 3k0f s MET 471 Cb -0.03 -2.79 0.03 0.00 -1.53 0.00 0.00 34.83 30.51 3k0f s MET 471 CO -0.00 0.59 -0.01 0.42 -2.03 0.00 0.00 175.02 173.99 3k0f s ILE 472 N -1.35 3.15 0.00 3.16 1.01 -1.26 -1.46 121.20 124.45 3k0f s ILE 472 Ca 0.28 -1.06 0.00 0.00 0.00 0.00 0.00 60.65 59.87 3k0f s ILE 472 Cb -0.12 -2.67 0.00 0.00 0.01 0.00 0.00 42.46 39.68 3k0f s ILE 472 CO 0.21 0.08 0.00 -1.54 0.00 0.00 0.00 174.94 173.69 3k0f n SER 473 N 4.70 1.52 0.14 3.58 3.41 -0.60 -4.96 113.62 121.42 3k0f n SER 473 Ca -0.15 -0.77 0.00 0.00 -0.26 0.00 0.00 58.87 57.69 3k0f n SER 473 Cb 0.46 0.00 0.19 0.00 -0.26 0.00 0.00 64.21 64.60 3k0f n SER 473 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 3k0f h ASP 474 N 0.00 0.00 0.01 4.04 3.32 -1.92 -2.91 116.42 118.96 3k0f h ASP 474 Ca 0.00 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.92 3k0f h ASP 474 Cb 0.00 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 3k0f h ASP 474 CO 0.00 0.58 -0.41 0.11 -1.72 0.00 0.00 179.24 177.80 3k0f h LYS 475 N 0.00 0.50 0.00 3.56 1.57 -1.83 -2.94 116.57 117.43 3k0f h LYS 475 Ca -0.01 -0.25 0.00 0.00 -1.87 0.00 0.00 60.65 58.52 3k0f h LYS 475 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.42 3k0f h LYS 475 CO 0.08 0.83 0.00 0.41 -0.57 0.00 0.00 179.45 180.19 3k0f n GLY 476 N -0.04 0.59 3.58 3.86 0.00 -1.10 -4.70 105.19 107.39 3k0f n GLY 476 Ca -0.02 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.52 3.75 -0.39 1.61 0.04 -1.26 -1.56 135.00 135.67 3k0f s PRO 477 Ca 0.00 0.21 -0.10 0.00 0.04 0.00 0.00 61.00 61.15 3k0f s PRO 477 Cb 0.00 -3.79 0.05 0.00 0.04 0.00 0.00 34.50 30.79 3k0f s PRO 477 CO 0.00 -0.75 0.23 0.34 0.04 0.00 0.00 177.00 176.85 3k0f s ASP 478 N 1.78 5.71 -0.70 6.66 2.15 -0.53 -4.97 116.67 126.77 3k0f s ASP 478 Ca 0.28 -1.18 -0.25 0.00 0.43 0.00 0.00 52.55 51.82 3k0f s ASP 478 Cb -0.14 -2.01 0.05 0.00 -0.30 0.00 0.00 42.92 40.51 3k0f s ASP 478 CO 0.15 -0.45 1.14 -0.63 -0.17 0.00 0.00 175.17 175.21 3k0f s ILE 479 N 1.51 4.00 0.00 4.11 1.01 -1.26 -1.82 121.20 128.75 3k0f s ILE 479 Ca 0.02 0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.77 3k0f s ILE 479 Cb -0.21 -4.80 0.00 0.00 0.01 0.00 0.00 42.46 37.46 3k0f s ILE 479 CO 0.05 -1.65 0.00 0.29 0.00 0.00 0.00 174.94 173.63 3k0f n LYS 480 N 8.60 0.00 -3.86 2.79 5.02 0.85 -4.98 118.16 126.58 3k0f n LYS 480 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 3k0f n LYS 480 Cb 0.47 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.45 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 2.87 -4.88 4.39 8.00 -1.26 -4.62 116.55 121.05 3k0f n ASP 481 Ca 0.00 -2.69 -0.33 0.00 0.71 0.00 0.00 54.79 52.48 3k0f n ASP 481 Cb 0.00 0.17 -0.05 0.00 -0.02 0.00 0.00 41.12 41.22 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 -3.37 6.57 -1.42 -2.24 1.04 -1.26 0.16 113.70 113.18 3k0f s SER 482 Ca 0.09 0.73 -0.15 0.00 0.48 0.00 0.00 55.95 57.10 3k0f s SER 482 Cb -0.01 -2.15 0.05 0.00 0.10 0.00 0.00 66.02 64.01 3k0f s SER 482 CO 0.06 0.08 2.12 0.49 0.98 0.00 0.00 173.24 176.96 3k0f n PHE 483 N 0.37 3.78 0.13 5.02 3.01 -1.26 -4.78 117.46 123.73 3k0f n PHE 483 Ca -0.04 -2.95 -0.15 0.00 1.01 0.00 0.00 57.45 55.32 3k0f n PHE 483 Cb 0.52 -2.57 -0.08 0.00 -0.01 0.00 0.00 39.48 37.34 3k0f n PHE 483 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 3k0f h ARG 484 N 6.33 -0.68 -2.24 -1.08 2.43 -1.94 -3.01 114.38 114.19 3k0f h ARG 484 Ca 0.54 0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.65 3k0f h ARG 484 Cb 0.69 0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 30.35 3k0f h ARG 484 CO 1.79 -0.45 -0.11 0.27 -1.51 0.00 0.00 179.97 179.96 3k0f n ASN 485 N -5.48 3.74 -3.83 -3.80 6.94 -1.26 -4.77 115.26 106.80 3k0f n ASN 485 Ca -0.08 -2.16 -0.12 0.00 -0.02 0.00 0.00 54.58 52.20 3k0f n ASN 485 Cb 0.39 -0.97 -0.10 0.00 -2.36 0.00 0.00 39.78 36.74 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 1.40 -0.10 0.24 -2.53 0.40 -1.14 -3.10 117.98 113.15 3k0f s PHE 486 Ca 0.39 0.19 0.10 0.00 -0.60 0.00 0.00 56.93 57.01 3k0f s PHE 486 Cb 0.19 0.02 -0.05 0.00 0.51 0.00 0.00 43.02 43.69 3k0f s PHE 486 CO 0.00 -0.24 -0.17 -1.21 0.70 0.00 0.00 175.22 174.30 3k0f s GLU 487 N -0.82 1.49 -1.56 0.44 2.02 -0.80 -4.69 118.70 114.78 3k0f s GLU 487 Ca -0.09 -1.67 0.00 0.00 0.02 0.00 0.00 54.97 53.22 3k0f s GLU 487 Cb -0.05 -1.42 0.00 0.00 0.10 0.00 0.00 34.13 32.76 3k0f s GLU 487 CO 0.02 0.25 0.00 0.54 0.02 0.00 0.00 175.26 176.09 3k0f n ARG 488 N -0.49 -1.09 0.00 1.61 1.74 -1.26 -1.48 116.66 115.69 3k0f n ARG 488 Ca -0.07 0.98 0.00 0.00 -0.77 0.00 0.00 57.85 57.99 3k0f n ARG 488 Cb 0.60 -5.16 0.00 0.00 -1.02 0.00 0.00 32.46 26.88 3k0f n ARG 488 CO 0.00 0.00 0.00 -0.89 -1.52 0.00 0.00 177.63 175.22 3k0f n ILE 489 N -2.84 0.00 -0.49 0.55 2.08 -1.26 -0.63 119.36 116.77 3k0f n ILE 489 Ca -0.16 1.02 0.40 0.00 0.56 0.00 0.00 62.75 64.57 3k0f n ILE 489 Cb 0.53 -1.43 0.69 0.00 -0.75 0.00 0.00 39.64 38.67 3k0f n ILE 489 CO 0.00 0.00 0.00 0.40 0.56 0.00 0.00 176.55 177.51 3k0f h ILE 490 N 0.00 0.09 -1.10 1.39 1.08 -1.97 -0.78 117.51 116.22 3k0f h ILE 490 Ca 0.00 -0.02 0.37 0.00 -0.39 0.00 0.00 64.86 64.82 3k0f h ILE 490 Cb 0.00 0.03 -0.14 0.00 -3.07 0.00 0.00 36.82 33.64 3k0f h ILE 490 CO 0.00 0.01 0.66 0.77 -0.69 0.00 0.00 178.15 178.90 3k0f h SER 491 N 0.05 0.40 0.00 1.72 4.64 -1.26 -3.35 113.55 115.75 3k0f h SER 491 Ca 0.84 0.18 0.00 0.00 -0.47 0.00 0.00 61.79 62.34 3k0f h SER 491 Cb 2.80 0.15 0.00 0.00 -0.31 0.00 0.00 62.40 65.04 3k0f h SER 491 CO -0.36 -0.18 0.00 0.61 -0.87 0.00 0.00 176.83 176.03 3k0f n GLY 492 N -1.37 1.46 2.60 -0.77 0.00 -0.30 -3.06 105.19 103.75 3k0f n GLY 492 Ca 0.34 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.65 3k0f n GLY 492 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k0f s SER 493 N -0.57 3.39 1.02 1.61 1.04 -1.26 -0.13 113.70 118.80 3k0f s SER 493 Ca 0.00 -2.23 -0.14 0.00 0.48 0.00 0.00 55.95 54.06 3k0f s SER 493 Cb 0.00 -0.69 0.20 0.00 0.10 0.00 0.00 66.02 65.63 3k0f s SER 493 CO 0.00 -0.31 1.11 -2.84 0.98 0.00 0.00 173.24 172.18 3k0f s PRO 494 N 0.92 0.22 -0.16 4.02 0.02 -1.26 -4.93 135.00 133.84 3k0f s PRO 494 Ca 0.16 0.33 0.01 0.00 0.02 0.00 0.00 61.00 61.52 3k0f s PRO 494 Cb -0.23 -1.73 0.01 0.00 0.02 0.00 0.00 34.50 32.57 3k0f s PRO 494 CO -0.05 -2.83 -0.17 0.99 -0.33 0.00 0.00 177.00 174.61 3k0f s THR 495 N -3.05 2.40 -0.52 0.99 2.01 -0.55 -4.95 115.64 111.96 3k0f s THR 495 Ca 0.66 -0.85 -0.28 0.00 0.31 0.00 0.00 61.69 61.54 3k0f s THR 495 Cb -0.16 -2.00 0.03 0.00 0.01 0.00 0.00 72.50 70.38 3k0f s THR 495 CO 0.56 0.52 1.10 0.00 -0.69 0.00 0.00 174.62 176.11 3k0f s ARG 496 N 0.98 3.58 0.02 4.92 3.03 -1.26 -1.91 118.95 128.30 3k0f s ARG 496 Ca -0.02 0.30 0.04 0.00 2.03 0.00 0.00 55.73 58.07 3k0f s ARG 496 Cb -0.15 -3.96 -0.03 0.00 -1.03 0.00 0.00 34.95 29.78 3k0f s ARG 496 CO -0.04 -1.46 -0.10 0.96 -1.13 0.00 0.00 175.30 173.53 3k0f s ILE 497 N 4.44 3.43 -0.12 4.99 -5.25 -1.18 -5.03 121.20 122.47 3k0f s ILE 497 Ca 0.42 -0.90 -0.04 0.00 -0.99 0.00 0.00 60.65 59.15 3k0f s ILE 497 Cb -0.08 -2.49 0.05 0.00 2.95 0.00 0.00 42.46 42.89 3k0f s ILE 497 CO 0.27 0.36 0.12 0.42 -1.79 0.00 0.00 174.94 174.33 3k0f s THR 498 N -0.99 -0.18 -1.00 8.37 -4.23 -1.26 -4.34 115.64 112.01 3k0f s THR 498 Ca 0.17 0.14 0.25 0.00 -1.18 0.00 0.00 61.69 61.07 3k0f s THR 498 Cb -0.11 -0.40 0.01 0.00 1.34 0.00 0.00 72.50 73.33 3k0f s THR 498 CO 0.07 -0.03 1.42 0.55 -0.54 0.00 0.00 174.62 176.10 3k0f n VAL 499 N 5.30 0.00 -0.02 2.29 3.14 -1.26 -4.96 118.33 122.83 3k0f n VAL 499 Ca -0.05 -0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.33 3k0f n VAL 499 Cb 0.50 0.24 0.00 0.00 -1.06 0.00 0.00 33.84 33.52 3k0f n VAL 499 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 3k0f n ASP 500 N -1.50 3.27 0.00 6.55 5.75 -1.26 -5.05 116.55 124.31 3k0f n ASP 500 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.84 3k0f n ASP 500 Cb 0.34 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 3k0f n ASP 500 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 3k0f n GLU 501 N 0.00 0.00 0.00 0.11 -0.00 -1.26 -4.84 120.64 114.65 3k0f n GLU 501 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 57.16 57.26 3k0f n GLU 501 Cb 0.00 0.00 0.59 0.00 -0.00 0.00 0.00 31.44 32.03 3k0f n GLU 501 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 3k0f n LYS 502 N 0.00 0.54 -1.76 3.44 3.00 -1.26 -4.81 118.16 117.32 3k0f n LYS 502 Ca 0.00 0.03 -0.42 0.00 -0.00 0.00 0.00 58.31 57.92 3k0f n LYS 502 Cb 0.00 -1.50 -0.03 0.00 0.00 0.00 0.00 35.03 33.50 3k0f n LYS 502 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 3k0f s SER 503 N -2.18 6.40 0.00 3.14 1.04 -1.26 -4.88 113.70 115.96 3k0f s SER 503 Ca 0.28 2.85 0.00 0.00 0.48 0.00 0.00 55.95 59.56 3k0f s SER 503 Cb 0.14 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.66 3k0f s SER 503 CO 0.26 -0.95 0.00 -1.84 0.98 0.00 0.00 173.24 171.69 3k0f n GLU 504 N 3.76 0.00 0.00 4.02 -0.00 -1.26 -4.76 120.64 122.40 3k0f n GLU 504 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.31 3k0f n GLU 504 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 31.80 3k0f n GLU 504 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 3k0f n LEU 505 N 0.00 0.00 0.00 -1.84 4.32 -1.26 -4.02 117.00 114.20 3k0f n LEU 505 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 3k0f n LEU 505 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 3k0f n LEU 505 CO 0.00 0.00 0.00 -1.54 -1.22 0.00 0.00 177.39 174.63 3k0f n SER 506 N 0.78 0.00 0.00 -1.43 3.41 -1.26 -5.12 113.62 109.99 3k0f n SER 506 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3k0f n SER 506 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3k0f n SER 506 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3k0f n ARG 507 N 0.00 0.00 -1.93 4.33 3.00 -1.26 -4.82 116.66 115.98 3k0f n ARG 507 Ca 0.00 0.07 -0.13 0.00 -0.01 0.00 0.00 57.85 57.78 3k0f n ARG 507 Cb 0.00 -0.62 0.01 0.00 0.00 0.00 0.00 32.46 31.86 3k0f n ARG 507 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 3k0f n ILE 508 N -0.19 -1.40 0.00 0.55 -0.00 -1.26 -4.93 119.36 112.13 3k0f n ILE 508 Ca 0.00 0.06 0.00 0.00 -0.00 0.00 0.00 62.75 62.81 3k0f n ILE 508 Cb 0.00 -1.37 0.00 0.00 -0.00 0.00 0.00 39.64 38.27 3k0f n ILE 508 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 3k0f n VAL 509 N 0.10 0.00 -0.22 1.39 0.31 -1.26 -4.78 118.33 113.86 3k0f n VAL 509 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 3k0f n VAL 509 Cb 0.26 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.19 3k0f n VAL 509 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 3k0f n ARG 510 N 0.00 0.00 -2.90 5.55 5.12 -1.26 -4.11 116.66 119.05 3k0f n ARG 510 Ca 0.00 0.00 -0.43 0.00 -1.93 0.00 0.00 57.85 55.49 3k0f n ARG 510 Cb 0.00 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.26 3k0f n ARG 510 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 3k0f s GLY 511 N -0.04 1.46 -0.10 -0.13 0.00 -1.26 -4.84 107.32 102.40 3k0f s GLY 511 Ca 0.00 -1.94 0.20 0.00 0.00 0.00 0.00 44.72 42.98 3k0f s GLY 511 CO 0.00 1.98 0.32 -0.62 0.00 0.00 0.00 173.10 174.77 3k0f n VAL 512 N 5.84 0.78 -3.32 1.40 0.31 -1.26 -5.03 118.33 117.06 3k0f n VAL 512 Ca -0.04 -0.69 -0.19 0.00 -0.01 0.00 0.00 64.34 63.40 3k0f n VAL 512 Cb 0.45 -0.29 -0.01 0.00 -0.91 0.00 0.00 33.84 33.08 3k0f n VAL 512 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3k0f s GLN 513 N -2.97 2.63 -0.14 5.55 -1.52 -1.26 -5.09 119.66 116.86 3k0f s GLN 513 Ca -0.08 -1.44 0.01 0.00 -1.95 0.00 0.00 55.36 51.89 3k0f s GLN 513 Cb 0.10 -2.54 -0.09 0.00 -0.22 0.00 0.00 33.01 30.26 3k0f s GLN 513 CO 0.86 -0.28 -0.13 -0.85 -0.25 0.00 0.00 175.29 174.65 3k0f n GLU 514 N -1.72 0.35 0.00 2.91 -0.00 -1.26 -5.14 120.64 115.78 3k0f n GLU 514 Ca 0.06 0.08 0.00 0.00 -0.00 0.00 0.00 57.16 57.30 3k0f n GLU 514 Cb 0.61 -1.26 0.00 0.00 -0.00 0.00 0.00 31.44 30.78 3k0f n GLU 514 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.13 178.30 3k0f n LYS 515 N -2.96 0.00 -0.33 3.44 3.00 -1.26 -4.55 118.16 115.50 3k0f n LYS 515 Ca -0.25 0.00 0.30 0.00 -0.00 0.00 0.00 58.31 58.36 3k0f n LYS 515 Cb 0.76 0.00 0.63 0.00 0.00 0.00 0.00 35.03 36.42 3k0f n LYS 515 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 3k0f h GLY 516 N 0.00 0.64 0.00 3.14 0.00 -2.08 -3.33 103.07 101.45 3k0f h GLY 516 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 3k0f h GLY 516 CO 0.00 -0.09 0.00 -1.55 0.00 0.00 0.00 176.54 174.90 3k0f n PRO 517 N -4.42 0.00 -3.88 4.80 -0.04 -1.26 -5.00 135.00 125.20 3k0f n PRO 517 Ca 0.26 0.16 -0.09 0.00 -0.04 0.00 0.00 63.50 63.79 3k0f n PRO 517 Cb 1.09 -1.13 -0.05 0.00 -0.04 0.00 0.00 33.50 33.36 3k0f n PRO 517 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 3k0f s GLU 518 N -1.54 1.39 0.00 0.54 2.12 -1.25 -5.23 118.70 114.74 3k0f s GLU 518 Ca 0.00 -1.06 0.00 0.00 0.36 0.00 0.00 54.97 54.27 3k0f s GLU 518 Cb 0.00 0.47 0.00 0.00 0.26 0.00 0.00 34.13 34.86 3k0f s GLU 518 CO 0.00 -0.57 0.00 -1.13 -0.54 0.00 0.00 175.26 173.02