#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vkm s ILE -6 N 0.00 4.75 0.40 0.58 1.01 -1.26 -4.99 121.20 121.69 1vkm s ILE -6 Ca 0.00 1.98 0.07 0.00 0.00 0.00 0.00 60.65 62.70 1vkm s ILE -6 Cb 0.00 -4.29 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 1vkm s ILE -6 CO 0.00 -0.08 0.18 -1.38 0.00 0.00 0.00 174.94 173.65 1vkm s HIS -5 N 2.62 2.62 0.76 3.97 -3.43 -1.26 -5.11 115.29 115.46 1vkm s HIS -5 Ca 0.45 -0.56 -0.11 0.00 -0.80 0.00 0.00 55.06 54.03 1vkm s HIS -5 Cb -0.16 -1.92 0.05 0.00 -1.43 0.00 0.00 32.58 29.11 1vkm s HIS -5 CO 0.11 0.20 1.09 -3.38 -2.00 0.00 0.00 174.74 170.76 1vkm s HIS -4 N -2.58 2.94 -0.19 0.38 -3.43 -1.26 -5.05 115.29 106.10 1vkm s HIS -4 Ca 0.41 1.22 -0.09 0.00 -0.80 0.00 0.00 55.06 55.80 1vkm s HIS -4 Cb 0.03 -3.05 -0.05 0.00 -1.43 0.00 0.00 32.58 28.08 1vkm s HIS -4 CO 0.23 -1.58 0.11 -1.58 -2.00 0.00 0.00 174.74 169.91 1vkm s HIS -3 N -3.13 3.37 0.23 0.38 2.46 -1.26 -5.08 115.29 112.25 1vkm s HIS -3 Ca 0.60 0.26 -0.30 0.00 0.47 0.00 0.00 55.06 56.09 1vkm s HIS -3 Cb -0.14 -2.13 -0.09 0.00 -0.13 0.00 0.00 32.58 30.09 1vkm s HIS -3 CO 0.54 0.27 0.99 -1.01 -2.47 0.00 0.00 174.74 173.06 1vkm s HIS -2 N 0.32 3.85 -0.03 3.88 3.76 -1.26 -4.95 115.29 120.86 1vkm s HIS -2 Ca 0.07 1.83 -0.01 0.00 -0.15 0.00 0.00 55.06 56.80 1vkm s HIS -2 Cb -0.11 -3.07 -0.01 0.00 1.11 0.00 0.00 32.58 30.49 1vkm s HIS -2 CO -0.01 0.14 -0.03 0.72 -0.85 0.00 0.00 174.74 174.71 1vkm n HIS -1 N 1.68 0.00 -0.00 1.40 8.25 -1.26 -4.88 115.22 120.40 1vkm n HIS -1 Ca -0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.32 1vkm n HIS -1 Cb 0.47 -0.09 -0.14 0.00 1.12 0.00 0.00 29.99 31.35 1vkm n HIS -1 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1vkm h HIS 0 N -0.07 0.18 -3.51 4.41 3.86 -2.02 -3.43 115.15 114.57 1vkm h HIS 0 Ca -0.06 -0.13 -0.75 0.00 -1.16 0.00 0.00 60.37 58.26 1vkm h HIS 0 Cb 1.06 -0.01 -0.28 0.00 1.06 0.00 0.00 27.41 29.24 1vkm h HIS 0 CO -0.01 1.27 -0.17 0.08 0.86 0.00 0.00 177.93 179.97 1vkm s VAL 1 N -2.59 4.83 -0.25 2.45 1.01 -1.26 -4.94 120.40 119.66 1vkm s VAL 1 Ca -0.10 -2.23 -0.16 0.00 0.00 0.00 0.00 61.98 59.49 1vkm s VAL 1 Cb 0.07 -4.08 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 1vkm s VAL 1 CO 0.81 -0.91 0.43 -0.63 0.00 0.00 0.00 175.10 174.80 1vkm s ILE 2 N 0.66 5.14 -0.22 2.22 -1.09 -1.26 -4.90 121.20 121.76 1vkm s ILE 2 Ca 0.12 0.71 -0.04 0.00 -2.23 0.00 0.00 60.65 59.20 1vkm s ILE 2 Cb -0.19 -3.75 -0.01 0.00 -1.58 0.00 0.00 42.46 36.92 1vkm s ILE 2 CO -0.04 0.16 -0.02 -0.63 -1.23 0.00 0.00 174.94 173.17 1vkm s ILE 3 N 1.97 3.57 -0.42 2.92 1.01 -1.26 -1.73 121.20 127.26 1vkm s ILE 3 Ca 0.18 -0.43 -0.13 0.00 0.00 0.00 0.00 60.65 60.27 1vkm s ILE 3 Cb -0.15 -2.63 0.05 0.00 0.01 0.00 0.00 42.46 39.74 1vkm s ILE 3 CO 0.09 0.41 0.30 -0.70 0.00 0.00 0.00 174.94 175.05 1vkm s GLU 4 N 1.41 2.88 -0.18 2.79 2.12 0.13 -4.99 118.70 122.85 1vkm s GLU 4 Ca 0.05 -1.22 -0.17 0.00 0.36 0.00 0.00 54.97 54.00 1vkm s GLU 4 Cb -0.14 -3.94 -0.04 0.00 0.26 0.00 0.00 34.13 30.26 1vkm s GLU 4 CO -0.01 -0.87 0.43 0.45 -0.54 0.00 0.00 175.26 174.72 1vkm s SER 5 N 2.03 6.51 -0.31 -1.70 0.15 -1.26 -0.75 113.70 118.37 1vkm s SER 5 Ca 0.04 0.61 0.10 0.00 0.70 0.00 0.00 55.95 57.39 1vkm s SER 5 Cb -0.21 -2.25 0.61 0.00 -1.71 0.00 0.00 66.02 62.46 1vkm s SER 5 CO 0.07 -0.06 1.64 0.54 1.20 0.00 0.00 173.24 176.63 1vkm n ARG 6 N 4.28 2.65 -3.60 5.44 1.74 0.36 -4.97 116.66 122.57 1vkm n ARG 6 Ca -0.08 -3.06 -0.37 0.00 -0.77 0.00 0.00 57.85 53.57 1vkm n ARG 6 Cb 0.51 -2.01 -0.06 0.00 -1.02 0.00 0.00 32.46 29.88 1vkm n ARG 6 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1vkm s ILE 7 N -3.11 5.23 -0.35 0.55 -1.09 -1.26 -4.94 121.20 116.22 1vkm s ILE 7 Ca 0.50 0.60 -0.26 0.00 -2.23 0.00 0.00 60.65 59.26 1vkm s ILE 7 Cb 0.42 -3.61 0.01 0.00 -1.58 0.00 0.00 42.46 37.70 1vkm s ILE 7 CO 0.07 0.52 0.94 -1.61 -1.23 0.00 0.00 174.94 173.64 1vkm s GLU 8 N -0.55 3.89 0.51 2.79 2.02 -1.26 -4.94 118.70 121.16 1vkm s GLU 8 Ca 0.19 0.66 0.19 0.00 0.02 0.00 0.00 54.97 56.04 1vkm s GLU 8 Cb -0.14 -3.78 1.28 0.00 0.10 0.00 0.00 34.13 31.58 1vkm s GLU 8 CO 0.08 -0.91 2.06 1.57 0.02 0.00 0.00 175.26 178.08 1vkm h LYS 9 N 8.38 0.07 -0.00 1.61 2.10 -1.99 -0.86 116.57 125.87 1vkm h LYS 9 Ca -0.23 -0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.42 1vkm h LYS 9 Cb 1.08 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 1vkm h LYS 9 CO 0.98 0.05 -0.00 0.41 -2.00 0.00 0.00 179.45 178.88 1vkm n GLY 10 N -1.58 -0.94 3.54 0.07 0.00 -1.26 -4.80 105.19 100.22 1vkm n GLY 10 Ca 0.04 -0.22 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 1vkm n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vkm s LYS 11 N -2.08 2.01 0.68 1.61 1.02 -0.33 -5.11 119.74 117.55 1vkm s LYS 11 Ca 0.44 -1.07 -0.17 0.00 0.02 0.00 0.00 55.97 55.19 1vkm s LYS 11 Cb 0.22 -2.24 0.00 0.00 -0.52 0.00 0.00 37.83 35.29 1vkm s LYS 11 CO 0.38 0.50 1.25 -2.30 -0.92 0.00 0.00 175.35 174.27 1vkm n PRO 12 N 0.76 0.93 -3.81 -1.68 -0.02 -1.26 -4.87 135.00 125.05 1vkm n PRO 12 Ca -0.14 0.38 -0.12 0.00 -2.02 0.00 0.00 63.50 61.59 1vkm n PRO 12 Cb 0.52 -2.49 -0.12 0.00 -0.02 0.00 0.00 33.50 31.39 1vkm n PRO 12 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1vkm s VAL 13 N -1.53 0.01 -0.12 -1.45 0.11 -1.26 -0.56 120.40 115.60 1vkm s VAL 13 Ca 0.81 -0.11 0.02 0.00 -2.93 0.00 0.00 61.98 59.77 1vkm s VAL 13 Cb -0.37 -0.31 0.01 0.00 -1.53 0.00 0.00 36.38 34.19 1vkm s VAL 13 CO 0.42 -0.06 -0.20 -0.69 -3.33 0.00 0.00 175.10 171.25 1vkm s VAL 14 N -0.15 1.85 0.83 2.04 1.01 -0.37 -4.33 120.40 121.27 1vkm s VAL 14 Ca -0.03 -0.86 -0.10 0.00 0.00 0.00 0.00 61.98 60.99 1vkm s VAL 14 Cb -0.02 -1.65 0.18 0.00 0.00 0.00 0.00 36.38 34.89 1vkm s VAL 14 CO 0.01 0.51 1.13 0.61 0.00 0.00 0.00 175.10 177.35 1vkm n GLY 15 N 4.06 -0.73 3.68 4.51 0.00 0.55 -0.45 105.19 116.82 1vkm n GLY 15 Ca -0.20 -1.82 -0.24 0.00 0.00 0.00 0.00 46.02 43.76 1vkm n GLY 15 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1vkm s GLU 17 N -5.42 2.19 -0.07 1.61 -1.05 -1.26 -1.18 118.70 113.51 1vkm s GLU 17 Ca 0.67 -1.73 0.21 0.00 -0.15 0.00 0.00 54.97 53.96 1vkm s GLU 17 Cb -0.02 -1.99 -0.31 0.00 -0.44 0.00 0.00 34.13 31.36 1vkm s GLU 17 CO 0.46 0.06 0.37 0.25 0.95 0.00 0.00 175.26 177.35 1vkm n THR 18 N -1.08 0.36 -0.05 1.83 -2.24 -1.07 -4.60 114.28 107.42 1vkm n THR 18 Ca -0.03 -0.59 -0.01 0.00 -2.27 0.00 0.00 64.05 61.16 1vkm n THR 18 Cb 0.63 -0.12 0.27 0.00 -2.10 0.00 0.00 70.33 69.01 1vkm n THR 18 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vkm h THR 19 N 0.00 1.20 -0.90 4.28 1.03 -1.32 -1.21 112.91 115.99 1vkm h THR 19 Ca -0.14 -0.70 0.12 0.00 -0.01 0.00 0.00 66.41 65.68 1vkm h THR 19 Cb 1.31 0.76 -0.08 0.00 -1.07 0.00 0.00 68.15 69.07 1vkm h THR 19 CO 0.01 0.26 0.53 1.62 -0.01 0.00 0.00 175.52 177.92 1vkm h VAL 20 N 0.63 0.86 -0.08 0.00 3.04 -1.81 0.44 116.25 119.33 1vkm h VAL 20 Ca 0.14 -0.28 -0.22 0.00 -1.01 0.00 0.00 66.70 65.34 1vkm h VAL 20 Cb 0.25 -0.03 0.01 0.00 -2.01 0.00 0.00 31.29 29.50 1vkm h VAL 20 CO -0.00 0.15 -0.82 -0.26 -1.01 0.00 0.00 177.57 175.62 1vkm h PHE 21 N 0.82 0.81 0.07 3.17 0.04 -1.53 -2.35 116.94 117.97 1vkm h PHE 21 Ca 0.46 -0.38 -0.37 0.00 2.80 0.00 0.00 57.97 60.48 1vkm h PHE 21 Cb 0.51 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 38.50 1vkm h PHE 21 CO -0.05 1.19 -2.10 0.28 -0.60 0.00 0.00 178.31 177.04 1vkm n VAL 22 N -3.86 1.65 -0.02 -0.55 0.31 -0.73 -4.47 118.33 110.66 1vkm n VAL 22 Ca -0.07 -0.54 0.02 0.00 -0.01 0.00 0.00 64.34 63.74 1vkm n VAL 22 Cb 0.77 -1.69 -0.08 0.00 -0.91 0.00 0.00 33.84 31.92 1vkm n VAL 22 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1vkm n HIS 23 N -3.58 0.00 0.99 3.52 8.25 0.14 -4.77 115.22 119.78 1vkm n HIS 23 Ca -0.38 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.20 1vkm n HIS 23 Cb 0.98 -0.34 0.04 0.00 1.12 0.00 0.00 29.99 31.80 1vkm n HIS 23 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1vkm n GLY 24 N 2.04 0.47 3.11 -1.41 0.00 -0.41 -4.82 105.19 104.18 1vkm n GLY 24 Ca -0.07 -0.66 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 1vkm n GLY 24 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vkm s LEU 25 N -2.24 1.80 0.63 0.99 1.43 -0.91 -4.97 118.68 115.41 1vkm s LEU 25 Ca 0.23 -0.51 -0.16 0.00 -1.03 0.00 0.00 54.13 52.65 1vkm s LEU 25 Cb 0.19 0.60 -0.01 0.00 0.03 0.00 0.00 46.19 46.99 1vkm s LEU 25 CO 0.44 -0.50 1.12 -2.84 0.23 0.00 0.00 176.35 174.80 1vkm s PRO 26 N -2.52 2.92 0.19 1.29 0.02 -1.26 -4.73 135.00 130.90 1vkm s PRO 26 Ca -0.06 1.46 -0.13 0.00 0.02 0.00 0.00 61.00 62.30 1vkm s PRO 26 Cb -0.02 -1.96 0.20 0.00 0.02 0.00 0.00 34.50 32.75 1vkm s PRO 26 CO -0.04 -1.17 1.71 -0.09 -0.33 0.00 0.00 177.00 177.08 1vkm h ARG 27 N 0.31 0.21 -0.14 5.54 2.43 -1.95 -0.45 114.38 120.34 1vkm h ARG 27 Ca -0.48 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1vkm h ARG 27 Cb 1.25 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 1vkm h ARG 27 CO 0.55 0.14 0.08 -0.22 -1.51 0.00 0.00 179.97 179.01 1vkm h LYS 28 N 0.22 0.17 -0.18 0.20 3.64 -1.98 -1.81 116.57 116.82 1vkm h LYS 28 Ca 0.26 -0.01 -0.13 0.00 -1.27 0.00 0.00 60.65 59.50 1vkm h LYS 28 Cb 0.35 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 1vkm h LYS 28 CO -0.35 0.11 -0.44 0.93 -2.27 0.00 0.00 179.45 177.44 1vkm h GLU 29 N 0.17 0.44 -0.39 1.90 3.07 -1.89 -2.05 114.58 115.82 1vkm h GLU 29 Ca 0.05 -0.23 -0.01 0.00 -0.50 0.00 0.00 59.36 58.68 1vkm h GLU 29 Cb -0.01 0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 27.89 1vkm h GLU 29 CO -0.02 0.79 0.21 0.00 -1.40 0.00 0.00 179.01 178.60 1vkm h ALA 30 N 1.18 0.51 -0.10 3.43 0.00 -0.72 0.22 119.26 123.78 1vkm h ALA 30 Ca 0.03 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.65 1vkm h ALA 30 Cb 0.91 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1vkm h ALA 30 CO 0.08 0.03 -0.77 0.82 0.00 0.00 0.00 179.25 179.41 1vkm h ILE 31 N 0.51 1.34 -0.57 0.00 1.08 -1.26 -0.53 117.51 118.08 1vkm h ILE 31 Ca 0.14 -2.10 -0.08 0.00 -0.39 0.00 0.00 64.86 62.43 1vkm h ILE 31 Cb 0.06 2.08 -0.02 0.00 -3.07 0.00 0.00 36.82 35.87 1vkm h ILE 31 CO -0.02 0.64 0.03 -0.08 -0.69 0.00 0.00 178.15 178.03 1vkm h GLU 32 N 0.38 0.96 -0.49 2.37 4.57 -1.18 -1.21 114.58 119.97 1vkm h GLU 32 Ca -0.04 -0.27 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 1vkm h GLU 32 Cb 1.37 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.83 1vkm h GLU 32 CO 0.14 0.93 0.32 1.25 -1.18 0.00 0.00 179.01 180.47 1vkm h LEU 33 N 0.89 0.57 -0.19 1.64 5.85 -0.40 -0.97 115.31 122.69 1vkm h LEU 33 Ca 0.17 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.90 1vkm h LEU 33 Cb 0.48 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1vkm h LEU 33 CO 0.02 0.42 -0.00 0.15 -0.34 0.00 0.00 178.44 178.69 1vkm h PHE 34 N 0.66 -0.02 -0.90 1.25 3.57 -0.88 -0.69 116.94 119.94 1vkm h PHE 34 Ca 0.18 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.69 1vkm h PHE 34 Cb -0.06 0.04 -0.04 0.00 2.79 0.00 0.00 35.95 38.67 1vkm h PHE 34 CO -0.04 -0.03 0.55 0.00 -2.23 0.00 0.00 178.31 176.56 1vkm h ARG 35 N 0.06 1.21 -0.63 1.11 3.08 -1.09 -2.03 114.38 116.10 1vkm h ARG 35 Ca 0.09 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 59.94 1vkm h ARG 35 Cb 0.11 -0.26 -0.02 0.00 0.08 0.00 0.00 29.97 29.88 1vkm h ARG 35 CO -0.16 0.84 0.02 -0.09 -1.07 0.00 0.00 179.97 179.52 1vkm h ARG 36 N 1.23 1.09 -0.78 0.04 9.65 -0.85 -1.81 114.38 122.95 1vkm h ARG 36 Ca 0.32 -0.33 -0.04 0.00 -1.10 0.00 0.00 59.98 58.83 1vkm h ARG 36 Cb -0.06 -0.11 -0.04 0.00 -1.39 0.00 0.00 29.97 28.38 1vkm h ARG 36 CO -0.06 1.04 0.34 0.00 2.80 0.00 0.00 179.97 184.09 1vkm h ALA 37 N 1.01 1.13 -0.50 2.80 0.00 -0.88 -0.58 119.26 122.25 1vkm h ALA 37 Ca 0.18 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 1vkm h ALA 37 Cb 0.54 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1vkm h ALA 37 CO 0.03 0.64 -0.14 0.87 0.00 0.00 0.00 179.25 180.64 1vkm h LYS 38 N 1.13 0.98 -0.53 0.00 1.79 -1.27 -0.30 116.57 118.37 1vkm h LYS 38 Ca 0.27 -0.39 0.02 0.00 -2.18 0.00 0.00 60.65 58.37 1vkm h LYS 38 Cb 0.16 -0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.73 1vkm h LYS 38 CO -0.03 1.06 0.32 1.49 -1.08 0.00 0.00 179.45 181.21 1vkm h GLU 39 N 0.84 0.61 -0.72 3.15 4.81 -1.01 0.35 114.58 122.61 1vkm h GLU 39 Ca 0.12 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.29 1vkm h GLU 39 Cb 0.71 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.92 1vkm h GLU 39 CO 0.05 0.40 0.33 0.82 -0.73 0.00 0.00 179.01 179.89 1vkm h ILE 40 N 0.63 1.24 -0.74 2.32 2.04 -0.93 -0.51 117.51 121.56 1vkm h ILE 40 Ca 0.21 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 1vkm h ILE 40 Cb 0.02 0.36 -0.04 0.00 -0.74 0.00 0.00 36.82 36.42 1vkm h ILE 40 CO -0.09 0.29 0.41 0.77 0.00 0.00 0.00 178.15 179.52 1vkm h SER 41 N 1.01 0.93 -0.30 1.72 4.64 -0.24 0.71 113.55 122.02 1vkm h SER 41 Ca 0.25 -0.10 -0.16 0.00 -0.47 0.00 0.00 61.79 61.31 1vkm h SER 41 Cb 0.14 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 61.99 1vkm h SER 41 CO -0.03 0.75 -0.45 0.03 -0.87 0.00 0.00 176.83 176.26 1vkm h ARG 42 N 1.03 0.83 -0.36 4.77 3.08 -0.62 -0.19 114.38 122.91 1vkm h ARG 42 Ca 0.26 -0.50 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 1vkm h ARG 42 Cb 0.03 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1vkm h ARG 42 CO -0.04 1.13 0.17 0.93 -1.07 0.00 0.00 179.97 181.09 1vkm h GLU 43 N 0.61 0.52 0.00 0.04 5.08 -0.77 -3.28 114.58 116.78 1vkm h GLU 43 Ca 0.03 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1vkm h GLU 43 Cb 1.05 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.21 1vkm h GLU 43 CO 0.10 0.47 -0.54 1.63 -1.00 0.00 0.00 179.01 179.68 1vkm n LYS 44 N -4.72 0.14 -2.08 2.33 5.02 0.22 -5.00 118.16 114.07 1vkm n LYS 44 Ca -0.01 0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1vkm n LYS 44 Cb 0.11 -1.59 0.00 0.00 -0.02 0.00 0.00 35.03 33.54 1vkm n LYS 44 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1vkm n GLY 45 N 1.42 0.93 3.32 0.72 0.00 -0.14 -4.99 105.19 106.45 1vkm n GLY 45 Ca 0.04 -0.56 -0.17 0.00 0.00 0.00 0.00 46.02 45.34 1vkm n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1vkm s PHE 46 N -2.83 1.51 -0.18 1.61 -0.71 -0.87 -4.51 117.98 112.00 1vkm s PHE 46 Ca 0.00 -0.89 -0.10 0.00 -1.04 0.00 0.00 56.93 54.90 1vkm s PHE 46 Cb 0.00 -0.86 -0.05 0.00 -1.21 0.00 0.00 43.02 40.90 1vkm s PHE 46 CO 0.00 -0.01 0.16 -0.65 -1.34 0.00 0.00 175.22 173.37 1vkm s GLN 47 N -3.84 4.07 -0.40 1.99 -0.21 0.28 -4.34 119.66 117.21 1vkm s GLN 47 Ca 0.26 -0.16 -0.16 0.00 0.02 0.00 0.00 55.36 55.32 1vkm s GLN 47 Cb 0.05 -3.38 0.01 0.00 1.00 0.00 0.00 33.01 30.69 1vkm s GLN 47 CO 0.07 0.37 0.38 -1.17 -2.12 0.00 0.00 175.29 172.83 1vkm s LEU 48 N 0.13 4.85 -0.67 2.90 2.96 -1.26 -1.24 118.68 126.35 1vkm s LEU 48 Ca 0.10 -0.66 -0.09 0.00 -0.22 0.00 0.00 54.13 53.26 1vkm s LEU 48 Cb -0.11 -2.31 0.17 0.00 0.50 0.00 0.00 46.19 44.44 1vkm s LEU 48 CO -0.00 -0.50 0.56 0.00 -1.32 0.00 0.00 176.35 175.08 1vkm s ALA 49 N 1.99 3.75 -0.02 5.97 0.00 0.40 -4.77 121.76 129.08 1vkm s ALA 49 Ca 0.10 -3.10 -0.30 0.00 0.00 0.00 0.00 51.96 48.65 1vkm s ALA 49 Cb -0.17 -3.07 -0.04 0.00 0.00 0.00 0.00 23.12 19.83 1vkm s ALA 49 CO 0.12 -2.13 1.25 0.08 0.00 0.00 0.00 175.76 175.08 1vkm s VAL 50 N 0.40 4.08 -0.17 0.00 1.01 -1.26 -4.28 120.40 120.17 1vkm s VAL 50 Ca 0.14 1.44 -0.05 0.00 0.00 0.00 0.00 61.98 63.51 1vkm s VAL 50 Cb -0.18 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.25 1vkm s VAL 50 CO -0.05 0.02 -0.01 -0.63 0.00 0.00 0.00 175.10 174.43 1vkm s ILE 51 N 2.06 4.08 0.37 2.22 1.01 -1.26 -1.54 121.20 128.14 1vkm s ILE 51 Ca 0.58 -0.28 -0.11 0.00 0.00 0.00 0.00 60.65 60.84 1vkm s ILE 51 Cb -0.27 -2.81 0.05 0.00 0.01 0.00 0.00 42.46 39.43 1vkm s ILE 51 CO 0.24 0.47 0.70 0.61 0.00 0.00 0.00 174.94 176.96 1vkm n GLY 52 N 3.68 1.27 3.09 6.18 0.00 -0.85 -2.93 105.19 115.63 1vkm n GLY 52 Ca -0.17 -1.33 -0.32 0.00 0.00 0.00 0.00 46.02 44.20 1vkm n GLY 52 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vkm s ILE 53 N -2.29 1.90 -0.29 -0.61 1.01 -0.68 -0.49 121.20 119.75 1vkm s ILE 53 Ca 0.18 -0.84 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 1vkm s ILE 53 Cb -0.04 -1.73 0.03 0.00 0.01 0.00 0.00 42.46 40.73 1vkm s ILE 53 CO 0.13 0.51 0.02 -0.76 0.00 0.00 0.00 174.94 174.84 1vkm s LEU 54 N 1.32 3.75 -1.57 2.97 1.43 -0.07 -0.76 118.68 125.75 1vkm s LEU 54 Ca 0.04 -1.02 -0.07 0.00 -1.03 0.00 0.00 54.13 52.06 1vkm s LEU 54 Cb -0.13 -1.76 0.06 0.00 0.03 0.00 0.00 46.19 44.39 1vkm s LEU 54 CO -0.11 -0.22 0.40 0.29 0.23 0.00 0.00 176.35 176.94 1vkm n LYS 55 N 4.72 -2.33 -0.17 1.70 4.76 -1.22 -0.95 118.16 124.67 1vkm n LYS 55 Ca -0.14 0.28 0.00 0.00 -2.87 0.00 0.00 58.31 55.58 1vkm n LYS 55 Cb 0.46 -4.41 0.00 0.00 -1.84 0.00 0.00 35.03 29.23 1vkm n LYS 55 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vkm n GLY 56 N -1.93 1.37 3.69 0.72 0.00 -0.59 -4.41 105.19 104.04 1vkm n GLY 56 Ca -0.18 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1vkm n GLY 56 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vkm s LYS 57 N -0.45 4.12 -0.24 1.61 2.20 -0.12 -4.51 119.74 122.35 1vkm s LYS 57 Ca 0.00 -0.25 -0.29 0.00 -0.36 0.00 0.00 55.97 55.07 1vkm s LYS 57 Cb 0.00 -3.43 0.01 0.00 -1.51 0.00 0.00 37.83 32.90 1vkm s LYS 57 CO 0.00 0.21 1.05 0.42 -0.36 0.00 0.00 175.35 176.67 1vkm s ILE 58 N 0.60 4.66 -0.19 5.43 1.01 -0.71 -0.89 121.20 131.12 1vkm s ILE 58 Ca 0.07 2.00 -0.01 0.00 0.00 0.00 0.00 60.65 62.71 1vkm s ILE 58 Cb -0.12 -4.31 0.00 0.00 0.01 0.00 0.00 42.46 38.04 1vkm s ILE 58 CO 0.00 -0.20 -0.12 -0.69 0.00 0.00 0.00 174.94 173.93 1vkm s VAL 59 N 3.24 2.81 -0.42 2.92 1.01 0.35 0.20 120.40 130.51 1vkm s VAL 59 Ca 0.44 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.64 1vkm s VAL 59 Cb -0.15 -2.23 0.08 0.00 0.00 0.00 0.00 36.38 34.08 1vkm s VAL 59 CO 0.07 0.48 0.26 0.00 0.00 0.00 0.00 175.10 175.91 1vkm s ALA 60 N 1.26 3.29 0.00 5.51 0.00 0.07 -2.00 121.76 129.88 1vkm s ALA 60 Ca 0.03 -2.20 0.00 0.00 0.00 0.00 0.00 51.96 49.79 1vkm s ALA 60 Cb -0.14 -2.65 0.00 0.00 0.00 0.00 0.00 23.12 20.33 1vkm s ALA 60 CO -0.06 -1.67 0.00 0.41 0.00 0.00 0.00 175.76 174.44 1vkm n GLY 61 N 4.90 2.36 3.18 0.00 0.00 -0.59 -0.48 105.19 114.55 1vkm n GLY 61 Ca -0.10 -1.42 -0.11 0.00 0.00 0.00 0.00 46.02 44.39 1vkm n GLY 61 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1vkm s SER 63 N 0.00 0.76 0.22 1.61 1.04 -1.26 -4.80 113.70 111.27 1vkm s SER 63 Ca 0.00 -1.14 -0.08 0.00 0.48 0.00 0.00 55.95 55.21 1vkm s SER 63 Cb 0.00 0.19 0.29 0.00 0.10 0.00 0.00 66.02 66.60 1vkm s SER 63 CO 0.00 -0.62 1.81 -0.08 0.98 0.00 0.00 173.24 175.33 1vkm h GLU 64 N 2.85 0.70 -0.86 4.02 4.81 -2.00 -1.05 114.58 123.06 1vkm h GLU 64 Ca -0.36 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 58.82 1vkm h GLU 64 Cb 1.19 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.37 1vkm h GLU 64 CO 0.62 0.47 0.47 0.93 -0.73 0.00 0.00 179.01 180.77 1vkm h GLU 65 N 0.72 1.19 -0.49 1.92 5.08 -2.03 -1.03 114.58 119.94 1vkm h GLU 65 Ca 0.33 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 58.44 1vkm h GLU 65 Cb 0.23 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1vkm h GLU 65 CO -0.20 0.87 -0.15 0.93 -1.00 0.00 0.00 179.01 179.46 1vkm h GLU 66 N 1.20 0.94 -0.64 2.33 5.08 -1.89 -1.25 114.58 120.36 1vkm h GLU 66 Ca 0.30 -0.36 -0.09 0.00 -1.00 0.00 0.00 59.36 58.22 1vkm h GLU 66 Cb 0.02 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1vkm h GLU 66 CO -0.05 1.02 0.05 1.25 -1.00 0.00 0.00 179.01 180.28 1vkm h LEU 67 N 0.83 1.05 -0.68 1.33 5.85 -0.89 -2.82 115.31 119.98 1vkm h LEU 67 Ca 0.12 -0.28 -0.05 0.00 0.84 0.00 0.00 57.88 58.52 1vkm h LEU 67 Cb 0.69 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1vkm h LEU 67 CO 0.05 1.07 0.22 -0.33 -0.34 0.00 0.00 178.44 179.12 1vkm h GLU 68 N 1.00 1.05 -5.08 1.25 4.39 -1.04 -3.43 114.58 112.73 1vkm h GLU 68 Ca 0.19 -0.22 -0.23 0.00 0.34 0.00 0.00 59.36 59.43 1vkm h GLU 68 Cb 0.50 -0.16 0.04 0.00 -0.10 0.00 0.00 28.75 29.03 1vkm h GLU 68 CO 0.02 0.90 0.63 0.00 -1.16 0.00 0.00 179.01 179.41 1vkm n ALA 69 N -2.42 0.76 0.00 3.43 0.00 -0.49 -4.59 120.51 117.21 1vkm n ALA 69 Ca 0.05 -2.52 0.00 0.00 0.00 0.00 0.00 53.44 50.97 1vkm n ALA 69 Cb 0.21 -3.49 0.00 0.00 0.00 0.00 0.00 19.45 16.17 1vkm n ALA 69 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1vkm n ARG 72 N 8.06 0.00 0.13 0.00 0.63 -1.26 -4.39 116.66 119.82 1vkm n ARG 72 Ca 0.44 0.00 0.02 0.00 -0.92 0.00 0.00 57.85 57.39 1vkm n ARG 72 Cb 0.45 -0.11 0.01 0.00 0.45 0.00 0.00 32.46 33.27 1vkm n ARG 72 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1vkm h GLU 73 N 0.00 0.00 0.00 -0.14 5.08 -1.96 -3.50 114.58 114.06 1vkm h GLU 73 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1vkm h GLU 73 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1vkm h GLU 73 CO 0.00 0.52 0.00 0.41 -1.00 0.00 0.00 179.01 178.94 1vkm n GLY 74 N 1.24 0.49 3.21 -3.84 0.00 -1.26 -5.10 105.19 99.92 1vkm n GLY 74 Ca 0.02 -1.57 -0.13 0.00 0.00 0.00 0.00 46.02 44.34 1vkm n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vkm s ALA 75 N -2.51 -0.83 0.52 4.61 0.00 -1.26 -4.68 121.76 117.61 1vkm s ALA 75 Ca 0.00 1.03 -0.22 0.00 0.00 0.00 0.00 51.96 52.77 1vkm s ALA 75 Cb 0.00 -0.61 -0.05 0.00 0.00 0.00 0.00 23.12 22.45 1vkm s ALA 75 CO 0.00 -0.18 1.32 -0.51 0.00 0.00 0.00 175.76 176.40 1vkm s ASP 76 N 0.47 5.47 -0.13 0.00 1.11 -1.01 -4.64 116.67 117.94 1vkm s ASP 76 Ca -0.02 2.68 -0.26 0.00 0.18 0.00 0.00 52.55 55.13 1vkm s ASP 76 Cb -0.04 -2.63 -0.02 0.00 1.07 0.00 0.00 42.92 41.30 1vkm s ASP 76 CO -0.02 -1.42 0.86 -0.75 1.18 0.00 0.00 175.17 175.01 1vkm s LYS 77 N -2.84 4.36 -0.10 8.23 2.20 -1.26 -0.70 119.74 129.62 1vkm s LYS 77 Ca 0.69 1.10 0.02 0.00 -0.36 0.00 0.00 55.97 57.42 1vkm s LYS 77 Cb -0.38 -3.54 0.01 0.00 -1.51 0.00 0.00 37.83 32.41 1vkm s LYS 77 CO 0.46 -0.25 -0.16 0.14 -0.36 0.00 0.00 175.35 175.17 1vkm s VAL 78 N 1.87 1.52 0.00 4.02 -7.23 -0.38 -4.94 120.40 115.25 1vkm s VAL 78 Ca 0.41 -0.67 0.00 0.00 -1.81 0.00 0.00 61.98 59.91 1vkm s VAL 78 Cb -0.17 -1.38 0.00 0.00 0.56 0.00 0.00 36.38 35.39 1vkm s VAL 78 CO 0.15 0.44 0.00 0.61 -0.31 0.00 0.00 175.10 176.00 1vkm n GLY 79 N 4.09 0.42 0.19 2.32 0.00 -1.26 -1.34 105.19 109.61 1vkm n GLY 79 Ca -0.20 -1.90 -0.03 0.00 0.00 0.00 0.00 46.02 43.89 1vkm n GLY 79 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1vkm h THR 80 N -0.48 0.60 0.00 2.61 2.02 -1.91 -2.32 112.91 113.43 1vkm h THR 80 Ca 0.00 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 67.15 1vkm h THR 80 Cb 0.00 0.53 -0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1vkm h THR 80 CO 0.00 0.01 -0.05 0.08 0.37 0.00 0.00 175.52 175.93 1vkm h ARG 81 N 0.07 0.00 0.00 6.66 0.11 -1.97 -2.22 114.38 117.02 1vkm h ARG 81 Ca 0.23 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.31 1vkm h ARG 81 Cb 0.34 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.42 1vkm h ARG 81 CO -0.42 0.05 -0.37 0.39 0.10 0.00 0.00 179.97 179.73 1vkm n GLU 82 N -3.22 0.10 -0.12 0.08 4.71 -0.88 -4.22 120.64 117.09 1vkm n GLU 82 Ca -0.00 0.04 -0.06 0.00 -0.01 0.00 0.00 57.16 57.13 1vkm n GLU 82 Cb 0.27 -1.58 0.03 0.00 -1.01 0.00 0.00 31.44 29.15 1vkm n GLU 82 CO 0.00 0.00 0.00 0.82 0.09 0.00 0.00 177.13 178.04 1vkm h ILE 83 N 0.00 0.89 -0.52 -3.67 2.04 -1.37 -2.50 117.51 112.38 1vkm h ILE 83 Ca 0.00 -0.11 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 1vkm h ILE 83 Cb 0.59 0.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 1vkm h ILE 83 CO 0.00 0.06 0.10 -0.65 0.00 0.00 0.00 178.15 177.65 1vkm h PRO 84 N 0.31 0.80 -0.29 2.37 0.11 -1.79 -0.98 132.00 132.54 1vkm h PRO 84 Ca 0.18 -0.17 -0.05 0.00 0.11 0.00 0.00 66.00 66.07 1vkm h PRO 84 Cb 0.15 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 31.14 1vkm h PRO 84 CO -0.18 0.75 -0.00 0.82 -0.21 0.00 0.00 178.00 179.18 1vkm h ILE 85 N 0.77 1.26 -0.12 4.15 2.04 -1.76 0.51 117.51 124.36 1vkm h ILE 85 Ca 0.17 -0.94 -0.16 0.00 1.00 0.00 0.00 64.86 64.92 1vkm h ILE 85 Cb 0.33 1.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1vkm h ILE 85 CO 0.00 0.30 -0.62 -0.37 0.00 0.00 0.00 178.15 177.47 1vkm h VAL 86 N 0.30 1.35 0.07 1.67 -1.51 -1.14 -1.34 116.25 115.65 1vkm h VAL 86 Ca 0.08 -1.94 -0.00 0.00 -1.23 0.00 0.00 66.70 63.61 1vkm h VAL 86 Cb 0.44 1.93 0.00 0.00 -2.13 0.00 0.00 31.29 31.52 1vkm h VAL 86 CO 0.02 0.59 -0.04 0.58 -1.23 0.00 0.00 177.57 177.49 1vkm h VAL 87 N 0.32 0.93 -0.93 7.19 2.07 -1.15 -0.80 116.25 123.88 1vkm h VAL 87 Ca -0.01 -0.01 0.01 0.00 0.82 0.00 0.00 66.70 67.51 1vkm h VAL 87 Cb 1.16 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 31.82 1vkm h VAL 87 CO 0.11 0.00 0.62 0.00 0.02 0.00 0.00 177.57 178.32 1vkm h ALA 88 N 0.82 1.18 -0.01 1.67 0.00 -0.72 -2.42 119.26 119.79 1vkm h ALA 88 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1vkm h ALA 88 Cb 0.08 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 17.49 1vkm h ALA 88 CO 0.02 0.57 -0.09 0.39 0.00 0.00 0.00 179.25 180.14 1vkm n GLU 89 N -4.44 1.19 -3.22 0.00 1.02 -0.52 -4.95 120.64 109.72 1vkm n GLU 89 Ca 0.11 -0.60 -0.16 0.00 -0.02 0.00 0.00 57.16 56.48 1vkm n GLU 89 Cb 0.01 -1.49 0.06 0.00 -0.02 0.00 0.00 31.44 30.00 1vkm n GLU 89 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vkm n GLY 90 N 1.22 -0.11 3.89 0.62 0.00 -0.40 -4.95 105.19 105.46 1vkm n GLY 90 Ca 0.17 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 1vkm n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vkm s LYS 91 N -5.73 3.24 0.42 1.61 1.02 -0.63 -3.91 119.74 115.75 1vkm s LYS 91 Ca 0.33 -0.69 -0.24 0.00 0.02 0.00 0.00 55.97 55.39 1vkm s LYS 91 Cb -0.15 -2.85 -0.08 0.00 -0.52 0.00 0.00 37.83 34.23 1vkm s LYS 91 CO 0.52 0.51 1.18 -0.80 -0.92 0.00 0.00 175.35 175.83 1vkm s ASN 92 N -3.15 6.38 -0.16 2.83 0.01 -1.26 -1.55 114.94 118.04 1vkm s ASN 92 Ca 0.33 2.35 -0.13 0.00 -0.71 0.00 0.00 52.86 54.70 1vkm s ASN 92 Cb -0.11 -2.61 0.04 0.00 0.41 0.00 0.00 41.25 38.99 1vkm s ASN 92 CO 0.27 -0.78 0.41 0.00 -1.51 0.00 0.00 177.10 175.49 1vkm s ALA 93 N -1.45 -1.02 -0.22 0.60 0.00 0.06 -2.40 121.76 117.33 1vkm s ALA 93 Ca 0.59 1.24 -0.09 0.00 0.00 0.00 0.00 51.96 53.71 1vkm s ALA 93 Cb -0.30 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 22.04 1vkm s ALA 93 CO 0.38 -0.21 0.11 0.00 0.00 0.00 0.00 175.76 176.03 1vkm s ALA 94 N 0.50 3.47 0.23 0.00 0.00 0.13 -1.68 121.76 124.40 1vkm s ALA 94 Ca -0.02 -0.85 -0.21 0.00 0.00 0.00 0.00 51.96 50.87 1vkm s ALA 94 Cb -0.04 -2.11 -0.08 0.00 0.00 0.00 0.00 23.12 20.88 1vkm s ALA 94 CO -0.03 -0.06 0.77 0.95 0.00 0.00 0.00 175.76 177.39 1vkm s THR 95 N 0.81 4.49 0.53 0.00 -4.23 -1.26 -1.25 115.64 114.73 1vkm s THR 95 Ca 0.05 1.41 -0.02 0.00 -1.18 0.00 0.00 61.69 61.95 1vkm s THR 95 Cb -0.13 -3.91 0.11 0.00 1.34 0.00 0.00 72.50 69.91 1vkm s THR 95 CO 0.02 0.23 0.73 0.35 -0.54 0.00 0.00 174.62 175.41 1vkm n THR 96 N 0.78 0.00 -0.29 3.99 -2.24 -0.45 -1.05 114.28 115.02 1vkm n THR 96 Ca -0.02 -0.99 -0.02 0.00 -2.27 0.00 0.00 64.05 60.75 1vkm n THR 96 Cb 0.51 -1.17 0.10 0.00 -2.10 0.00 0.00 70.33 67.67 1vkm n THR 96 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1vkm h VAL 97 N -0.74 1.10 -0.02 2.28 2.07 -1.96 -0.91 116.25 118.08 1vkm h VAL 97 Ca -0.24 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 66.96 1vkm h VAL 97 Cb 0.83 0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1vkm h VAL 97 CO 0.24 0.18 -0.07 0.77 0.02 0.00 0.00 177.57 178.71 1vkm h SER 98 N 0.97 -0.20 -0.07 0.57 4.64 -1.88 -0.18 113.55 117.39 1vkm h SER 98 Ca 0.33 0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.61 1vkm h SER 98 Cb 0.05 0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 1vkm h SER 98 CO -0.13 -0.10 -0.16 0.00 -0.87 0.00 0.00 176.83 175.58 1vkm h ALA 99 N 0.90 1.27 -0.13 5.18 0.00 -1.73 -1.75 119.26 123.00 1vkm h ALA 99 Ca 0.03 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 1vkm h ALA 99 Cb 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1vkm h ALA 99 CO -0.08 0.48 -0.30 1.15 0.00 0.00 0.00 179.25 180.50 1vkm h THR 100 N 0.39 1.37 -0.27 0.00 2.02 -0.81 -0.90 112.91 114.72 1vkm h THR 100 Ca 0.07 -1.58 -0.00 0.00 0.77 0.00 0.00 66.41 65.67 1vkm h THR 100 Cb 0.51 2.06 -0.01 0.00 -1.74 0.00 0.00 68.15 68.96 1vkm h THR 100 CO 0.03 0.47 0.16 0.40 0.37 0.00 0.00 175.52 176.95 1vkm h ILE 101 N 0.02 1.09 -0.27 3.11 2.04 -0.95 0.50 117.51 123.06 1vkm h ILE 101 Ca -0.00 -0.22 0.06 0.00 1.00 0.00 0.00 64.86 65.70 1vkm h ILE 101 Cb 0.90 0.75 -0.05 0.00 -0.74 0.00 0.00 36.82 37.68 1vkm h ILE 101 CO 0.06 0.09 -0.08 0.15 0.00 0.00 0.00 178.15 178.37 1vkm h PHE 102 N 0.34 -0.19 -0.31 1.37 3.57 -1.24 0.04 116.94 120.53 1vkm h PHE 102 Ca 0.10 0.03 -0.16 0.00 3.53 0.00 0.00 57.97 61.47 1vkm h PHE 102 Cb 0.01 0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.87 1vkm h PHE 102 CO -0.05 -0.14 -0.42 -0.07 -2.23 0.00 0.00 178.31 175.40 1vkm h LEU 103 N -0.03 0.90 -0.81 0.59 3.38 -1.09 -3.03 115.31 115.22 1vkm h LEU 103 Ca 0.13 -0.50 0.11 0.00 0.09 0.00 0.00 57.88 57.71 1vkm h LEU 103 Cb 0.23 -0.26 -0.08 0.00 0.09 0.00 0.00 40.66 40.64 1vkm h LEU 103 CO -0.29 1.22 0.43 0.28 0.09 0.00 0.00 178.44 180.17 1vkm h SER 104 N 0.60 0.57 0.21 -0.43 0.02 -0.56 -0.25 113.55 113.71 1vkm h SER 104 Ca 0.03 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1vkm h SER 104 Cb 1.02 -0.04 -0.00 0.00 0.14 0.00 0.00 62.40 63.52 1vkm h SER 104 CO 0.10 0.30 -0.10 -0.09 -1.14 0.00 0.00 176.83 175.90 1vkm h ARG 105 N 0.69 0.00 0.00 3.45 9.65 -0.88 -1.13 114.38 126.16 1vkm h ARG 105 Ca 0.41 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.29 1vkm h ARG 105 Cb 0.46 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.04 1vkm h ARG 105 CO -0.29 0.10 -0.68 0.54 2.80 0.00 0.00 179.97 182.44 1vkm n ARG 106 N -3.93 0.20 -0.09 0.20 1.74 -0.17 -4.19 116.66 110.42 1vkm n ARG 106 Ca -0.02 0.04 0.04 0.00 -0.77 0.00 0.00 57.85 57.14 1vkm n ARG 106 Cb 0.20 -1.61 0.09 0.00 -1.02 0.00 0.00 32.46 30.12 1vkm n ARG 106 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 1vkm n ILE 107 N -1.89 1.36 -0.84 0.55 -5.35 -0.74 -5.01 119.36 107.44 1vkm n ILE 107 Ca 0.04 -1.42 0.00 0.00 -0.27 0.00 0.00 62.75 61.10 1vkm n ILE 107 Cb 0.41 0.23 0.00 0.00 -1.74 0.00 0.00 39.64 38.54 1vkm n ILE 107 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1vkm n GLY 108 N -0.58 0.48 3.66 3.28 0.00 -0.73 -5.04 105.19 106.26 1vkm n GLY 108 Ca 0.08 -0.90 -0.37 0.00 0.00 0.00 0.00 46.02 44.83 1vkm n GLY 108 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1vkm s ILE 109 N -2.00 5.29 -0.10 -0.61 1.01 -0.51 -4.96 121.20 119.32 1vkm s ILE 109 Ca 0.00 0.40 0.14 0.00 0.00 0.00 0.00 60.65 61.19 1vkm s ILE 109 Cb 0.00 -3.60 -0.21 0.00 0.01 0.00 0.00 42.46 38.66 1vkm s ILE 109 CO 0.00 0.31 0.34 -0.62 0.00 0.00 0.00 174.94 174.97 1vkm n GLU 110 N 4.37 0.70 -4.89 2.79 1.02 -1.26 -4.11 120.64 119.26 1vkm n GLU 110 Ca -0.12 -0.11 -0.33 0.00 -0.02 0.00 0.00 57.16 56.58 1vkm n GLU 110 Cb 0.52 -1.31 -0.16 0.00 -0.02 0.00 0.00 31.44 30.47 1vkm n GLU 110 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1vkm s VAL 111 N -2.89 2.56 0.04 2.62 1.01 -1.26 -0.33 120.40 122.15 1vkm s VAL 111 Ca -0.04 -0.83 0.07 0.00 0.00 0.00 0.00 61.98 61.18 1vkm s VAL 111 Cb 0.09 -2.04 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 1vkm s VAL 111 CO 0.58 0.54 -0.20 -0.69 0.00 0.00 0.00 175.10 175.33 1vkm s VAL 112 N 0.46 1.57 -0.00 2.92 1.01 -0.00 -0.33 120.40 126.03 1vkm s VAL 112 Ca -0.13 -1.14 0.07 0.00 0.00 0.00 0.00 61.98 60.78 1vkm s VAL 112 Cb -0.17 -1.37 -0.02 0.00 0.00 0.00 0.00 36.38 34.82 1vkm s VAL 112 CO 0.05 0.19 -0.22 0.54 0.00 0.00 0.00 175.10 175.66 1vkm s VAL 113 N -0.78 1.78 0.33 2.92 0.11 -0.32 -0.98 120.40 123.45 1vkm s VAL 113 Ca 0.07 -1.03 0.02 0.00 -2.93 0.00 0.00 61.98 58.10 1vkm s VAL 113 Cb -0.09 -1.49 -0.02 0.00 -1.53 0.00 0.00 36.38 33.26 1vkm s VAL 113 CO 0.02 0.44 0.36 0.28 -3.33 0.00 0.00 175.10 172.86 1vkm s THR 114 N -0.60 0.00 -0.08 5.04 -1.32 -0.35 -4.28 115.64 114.05 1vkm s THR 114 Ca 0.09 -1.81 -0.04 0.00 -1.21 0.00 0.00 61.69 58.72 1vkm s THR 114 Cb -0.09 -2.56 -0.01 0.00 -1.51 0.00 0.00 72.50 68.33 1vkm s THR 114 CO -0.00 0.00 -0.08 1.23 -2.21 0.00 0.00 174.62 173.56 1vkm h GLY 115 N 2.16 0.00 -5.21 6.08 0.00 -1.93 -3.40 103.07 100.78 1vkm h GLY 115 Ca -0.27 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 46.87 1vkm h GLY 115 CO 0.39 0.00 -0.61 -0.32 0.00 0.00 0.00 176.54 176.00 1vkm s GLY 116 N -3.42 0.03 0.64 4.60 0.00 -1.26 -0.20 107.32 107.70 1vkm s GLY 116 Ca -0.06 -0.02 -0.10 0.00 0.00 0.00 0.00 44.72 44.53 1vkm s GLY 116 CO 0.09 -0.09 1.02 -0.51 0.00 0.00 0.00 173.10 173.62 1vkm s THR 117 N -0.60 4.05 1.21 0.90 -4.23 -0.59 -4.60 115.64 111.79 1vkm s THR 117 Ca -0.07 0.53 -0.20 0.00 -1.18 0.00 0.00 61.69 60.77 1vkm s THR 117 Cb -0.04 -3.64 0.29 0.00 1.34 0.00 0.00 72.50 70.45 1vkm s THR 117 CO 0.00 -0.81 1.12 -0.83 -0.54 0.00 0.00 174.62 173.57 1vkm s GLY 118 N -4.27 1.59 0.00 3.99 0.00 -1.26 -0.97 107.32 106.40 1vkm s GLY 118 Ca 0.56 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 44.26 1vkm s GLY 118 CO 0.51 -0.11 0.00 0.61 0.00 0.00 0.00 173.10 174.11 1vkm n GLY 119 N -1.06 1.95 3.66 0.20 0.00 -1.26 -4.75 105.19 103.94 1vkm n GLY 119 Ca 0.14 -0.22 -0.40 0.00 0.00 0.00 0.00 46.02 45.55 1vkm n GLY 119 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vkm s VAL 120 N -0.43 5.02 0.59 1.61 1.01 -1.26 -1.21 120.40 125.73 1vkm s VAL 120 Ca 0.00 1.18 -0.09 0.00 0.00 0.00 0.00 61.98 63.07 1vkm s VAL 120 Cb 0.00 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 1vkm s VAL 120 CO 0.00 0.12 0.96 -1.00 0.00 0.00 0.00 175.10 175.18 1vkm s HIS 121 N 1.88 3.54 0.24 5.22 3.76 0.33 -0.10 115.29 130.16 1vkm s HIS 121 Ca 0.29 1.08 -0.30 0.00 -0.15 0.00 0.00 55.06 55.97 1vkm s HIS 121 Cb -0.16 -2.65 -0.14 0.00 1.11 0.00 0.00 32.58 30.74 1vkm s HIS 121 CO 0.10 -0.65 1.17 -2.30 -0.85 0.00 0.00 174.74 172.22 1vkm n PRO 122 N -2.64 1.49 0.00 8.40 -0.02 -1.26 -0.76 135.00 140.21 1vkm n PRO 122 Ca 0.05 0.53 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 1vkm n PRO 122 Cb 0.55 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 1vkm n PRO 122 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1vkm n GLY 123 N 1.69 3.29 2.66 -1.23 0.00 -1.26 -4.67 105.19 105.68 1vkm n GLY 123 Ca 0.12 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 1vkm n GLY 123 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vkm n ARG 124 N -1.16 -1.37 -0.07 1.61 1.74 0.06 -4.82 116.66 112.64 1vkm n ARG 124 Ca 0.00 0.54 -0.16 0.00 -0.77 0.00 0.00 57.85 57.46 1vkm n ARG 124 Cb 0.00 -4.66 -0.14 0.00 -1.02 0.00 0.00 32.46 26.64 1vkm n ARG 124 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1vkm n VAL 125 N -2.34 1.56 -2.84 1.55 0.24 -1.26 -4.88 118.33 110.36 1vkm n VAL 125 Ca -0.04 -0.69 -0.43 0.00 -2.04 0.00 0.00 64.34 61.15 1vkm n VAL 125 Cb 0.40 -1.25 -0.04 0.00 -1.47 0.00 0.00 33.84 31.49 1vkm n VAL 125 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1vkm s ASP 126 N -6.38 6.60 -0.05 -1.34 -1.08 -1.26 -5.03 116.67 108.13 1vkm s ASP 126 Ca -0.22 0.39 0.00 0.00 -0.52 0.00 0.00 52.55 52.20 1vkm s ASP 126 Cb 0.08 -2.45 0.02 0.00 -1.46 0.00 0.00 42.92 39.12 1vkm s ASP 126 CO 0.72 -0.89 -0.02 -0.69 0.52 0.00 0.00 175.17 174.82 1vkm s VAL 127 N 3.47 0.40 0.32 1.11 1.01 -1.26 -0.51 120.40 124.94 1vkm s VAL 127 Ca 0.36 0.00 -0.29 0.00 0.00 0.00 0.00 61.98 62.06 1vkm s VAL 127 Cb -0.12 -0.48 -0.11 0.00 0.00 0.00 0.00 36.38 35.68 1vkm s VAL 127 CO 0.21 0.22 1.44 -0.55 0.00 0.00 0.00 175.10 176.41 1vkm s SER 128 N 1.26 6.55 0.63 3.32 0.15 -0.35 -4.89 113.70 120.36 1vkm s SER 128 Ca -0.06 2.84 0.29 0.00 0.70 0.00 0.00 55.95 59.72 1vkm s SER 128 Cb -0.14 -2.65 1.57 0.00 -1.71 0.00 0.00 66.02 63.10 1vkm s SER 128 CO -0.02 -0.74 1.93 1.56 1.20 0.00 0.00 173.24 177.17 1vkm h GLN 129 N 3.89 0.00 -0.93 5.44 4.20 -1.98 -2.20 115.11 123.53 1vkm h GLN 129 Ca -0.48 0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.35 1vkm h GLN 129 Cb 1.23 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.93 1vkm h GLN 129 CO 0.70 0.00 0.60 -0.44 -0.67 0.00 0.00 178.83 179.02 1vkm h ASP 130 N 0.00 0.80 -0.33 1.46 5.19 -1.91 -0.27 116.42 121.36 1vkm h ASP 130 Ca 0.09 0.04 -0.09 0.00 -0.62 0.00 0.00 57.03 56.44 1vkm h ASP 130 Cb 0.84 -0.12 -0.01 0.00 0.18 0.00 0.00 39.33 40.22 1vkm h ASP 130 CO -0.00 0.43 -0.16 -0.07 -3.12 0.00 0.00 179.24 176.32 1vkm h LEU 131 N 0.86 0.70 -0.58 1.55 3.38 -1.69 -3.13 115.31 116.40 1vkm h LEU 131 Ca 0.46 -0.41 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 1vkm h LEU 131 Cb 0.54 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1vkm h LEU 131 CO -0.22 0.96 0.33 0.74 0.09 0.00 0.00 178.44 180.34 1vkm h THR 132 N 0.45 1.18 0.00 0.22 2.02 -1.54 -1.17 112.91 114.07 1vkm h THR 132 Ca 0.07 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.81 1vkm h THR 132 Cb 0.69 0.42 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 1vkm h THR 132 CO 0.05 0.19 0.00 1.21 0.37 0.00 0.00 175.52 177.34 1vkm n GLU 133 N -4.61 0.28 0.00 6.66 4.07 -0.16 -2.56 120.64 124.32 1vkm n GLU 133 Ca 0.04 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.14 1vkm n GLU 133 Cb 0.07 -1.32 0.00 0.00 -0.06 0.00 0.00 31.44 30.13 1vkm n GLU 133 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1vkm n SER 135 N 0.78 0.00 0.00 4.31 2.88 -0.45 -0.69 113.62 120.45 1vkm n SER 135 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1vkm n SER 135 Cb 0.13 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.59 1vkm n SER 135 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1vkm n SER 136 N 0.00 4.19 -3.99 -3.46 7.64 -1.06 -4.75 113.62 112.19 1vkm n SER 136 Ca 0.00 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.69 1vkm n SER 136 Cb 0.00 0.82 -0.15 0.00 -1.01 0.00 0.00 64.21 63.87 1vkm n SER 136 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1vkm s SER 137 N -1.71 1.06 -0.07 6.43 0.01 0.13 -4.78 113.70 114.78 1vkm s SER 137 Ca 0.00 -0.16 -0.14 0.00 1.31 0.00 0.00 55.95 56.96 1vkm s SER 137 Cb 0.00 -0.23 -0.05 0.00 0.21 0.00 0.00 66.02 65.95 1vkm s SER 137 CO 0.00 0.07 0.36 -0.60 0.41 0.00 0.00 173.24 173.48 1vkm s ARG 138 N 0.08 3.99 -0.08 12.44 3.52 -1.26 -1.90 118.95 135.74 1vkm s ARG 138 Ca -0.01 0.28 -0.32 0.00 -0.13 0.00 0.00 55.73 55.55 1vkm s ARG 138 Cb -0.07 -3.29 0.12 0.00 -1.56 0.00 0.00 34.95 30.15 1vkm s ARG 138 CO 0.00 0.53 1.16 0.00 -0.81 0.00 0.00 175.30 176.18 1vkm s ALA 139 N -0.50 -2.04 -0.30 6.12 0.00 -1.25 -4.83 121.76 118.95 1vkm s ALA 139 Ca 0.21 1.13 -0.11 0.00 0.00 0.00 0.00 51.96 53.20 1vkm s ALA 139 Cb -0.15 0.16 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 1vkm s ALA 139 CO 0.10 -0.77 0.18 0.08 0.00 0.00 0.00 175.76 175.34 1vkm s VAL 140 N -2.61 4.95 -0.22 0.00 1.01 0.55 -0.78 120.40 123.30 1vkm s VAL 140 Ca 0.10 -0.18 -0.05 0.00 0.00 0.00 0.00 61.98 61.85 1vkm s VAL 140 Cb 0.01 -3.46 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1vkm s VAL 140 CO -0.04 0.12 -0.01 -0.22 0.00 0.00 0.00 175.10 174.95 1vkm s LEU 141 N 1.68 3.12 -0.17 3.92 2.96 0.29 -0.82 118.68 129.66 1vkm s LEU 141 Ca 0.06 -0.29 -0.16 0.00 -0.22 0.00 0.00 54.13 53.52 1vkm s LEU 141 Cb -0.17 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.68 1vkm s LEU 141 CO 0.08 0.00 0.39 -0.69 -1.32 0.00 0.00 176.35 174.81 1vkm s VAL 142 N 1.37 5.23 0.27 1.68 1.01 -0.15 -0.42 120.40 129.38 1vkm s VAL 142 Ca 0.04 0.72 -0.15 0.00 0.00 0.00 0.00 61.98 62.59 1vkm s VAL 142 Cb -0.15 -3.72 0.01 0.00 0.00 0.00 0.00 36.38 32.52 1vkm s VAL 142 CO -0.00 0.31 0.57 -0.94 0.00 0.00 0.00 175.10 175.04 1vkm s SER 143 N 0.77 -0.11 -0.71 3.32 1.04 -0.86 -1.21 113.70 115.95 1vkm s SER 143 Ca 0.20 -0.85 -0.01 0.00 0.48 0.00 0.00 55.95 55.76 1vkm s SER 143 Cb -0.14 0.65 0.42 0.00 0.10 0.00 0.00 66.02 67.04 1vkm s SER 143 CO 0.07 -1.24 1.98 -1.20 0.98 0.00 0.00 173.24 173.83 1vkm n SER 144 N -0.49 7.46 0.00 7.02 7.64 0.72 -0.56 113.62 135.41 1vkm n SER 144 Ca -0.03 -3.80 0.00 0.00 1.01 0.00 0.00 58.87 56.05 1vkm n SER 144 Cb 0.61 -0.97 0.00 0.00 -1.01 0.00 0.00 64.21 62.84 1vkm n SER 144 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vkm n GLY 145 N -0.78 0.44 3.64 0.23 0.00 -1.26 -0.04 105.19 107.43 1vkm n GLY 145 Ca 0.59 -1.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 1vkm n GLY 145 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1vkm s ILE 146 N 0.00 3.54 0.35 -0.61 -4.36 -1.25 -1.55 121.20 117.33 1vkm s ILE 146 Ca 0.00 -1.60 -0.28 0.00 -0.26 0.00 0.00 60.65 58.50 1vkm s ILE 146 Cb 0.00 -2.81 -0.11 0.00 1.25 0.00 0.00 42.46 40.79 1vkm s ILE 146 CO 0.00 -0.18 1.41 -0.54 0.24 0.00 0.00 174.94 175.87 1vkm s LYS 147 N -3.12 4.21 0.05 0.37 1.02 -0.15 -3.65 119.74 118.48 1vkm s LYS 147 Ca 0.28 2.42 0.04 0.00 0.02 0.00 0.00 55.97 58.73 1vkm s LYS 147 Cb -0.08 -3.01 0.21 0.00 -0.52 0.00 0.00 37.83 34.43 1vkm s LYS 147 CO 0.18 -0.39 1.13 0.43 -0.92 0.00 0.00 175.35 175.78 1vkm n SER 148 N 0.66 0.09 -0.47 2.83 7.64 -1.26 -2.69 113.62 120.42 1vkm n SER 148 Ca 0.01 0.54 0.14 0.00 1.01 0.00 0.00 58.87 60.56 1vkm n SER 148 Cb 0.40 -0.55 0.53 0.00 -1.01 0.00 0.00 64.21 63.58 1vkm n SER 148 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1vkm n ILE 149 N -1.61 0.02 -2.71 0.44 -5.35 -1.26 -4.92 119.36 103.98 1vkm n ILE 149 Ca 0.00 -0.25 -0.22 0.00 -0.27 0.00 0.00 62.75 62.01 1vkm n ILE 149 Cb 0.02 0.44 0.03 0.00 -1.74 0.00 0.00 39.64 38.39 1vkm n ILE 149 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1vkm s LEU 150 N -1.95 3.35 -0.65 7.28 1.43 -1.10 -4.52 118.68 122.53 1vkm s LEU 150 Ca 0.38 0.08 -0.27 0.00 -1.03 0.00 0.00 54.13 53.28 1vkm s LEU 150 Cb 0.21 -2.95 0.02 0.00 0.03 0.00 0.00 46.19 43.49 1vkm s LEU 150 CO 0.33 -1.05 1.32 -0.62 0.23 0.00 0.00 176.35 176.56 1vkm s ASP 151 N -4.38 6.17 0.02 2.29 -1.08 0.85 -4.74 116.67 115.81 1vkm s ASP 151 Ca 0.55 -0.08 -0.23 0.00 -0.52 0.00 0.00 52.55 52.27 1vkm s ASP 151 Cb -0.10 -2.55 -0.16 0.00 -1.46 0.00 0.00 42.92 38.64 1vkm s ASP 151 CO 0.39 -1.75 1.39 0.58 0.52 0.00 0.00 175.17 176.30 1vkm h VAL 152 N 6.20 1.31 -0.19 1.11 2.07 -1.94 -1.06 116.25 123.74 1vkm h VAL 152 Ca -0.27 -0.97 0.03 0.00 0.82 0.00 0.00 66.70 66.31 1vkm h VAL 152 Cb 1.07 1.82 -0.03 0.00 -1.52 0.00 0.00 31.29 32.63 1vkm h VAL 152 CO 1.23 0.27 -0.01 -0.08 0.02 0.00 0.00 177.57 178.99 1vkm h GLU 153 N -0.22 0.04 -0.63 1.57 4.81 -1.97 -0.14 114.58 118.04 1vkm h GLU 153 Ca 0.02 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1vkm h GLU 153 Cb 0.44 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1vkm h GLU 153 CO 0.01 0.03 0.34 0.00 -0.73 0.00 0.00 179.01 178.65 1vkm h ALA 154 N 1.17 0.81 0.09 2.92 0.00 -1.91 -1.44 119.26 120.90 1vkm h ALA 154 Ca 0.09 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1vkm h ALA 154 Cb 0.12 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1vkm h ALA 154 CO -0.16 0.34 -0.04 1.15 0.00 0.00 0.00 179.25 180.54 1vkm h THR 155 N 0.86 1.05 -0.72 0.00 2.02 -0.98 -3.16 112.91 111.98 1vkm h THR 155 Ca 0.22 -0.53 0.08 0.00 0.77 0.00 0.00 66.41 66.96 1vkm h THR 155 Cb 0.06 1.39 -0.07 0.00 -1.74 0.00 0.00 68.15 67.80 1vkm h THR 155 CO -0.03 0.13 0.39 0.15 0.37 0.00 0.00 175.52 176.52 1vkm h PHE 156 N -0.36 0.70 0.00 3.16 3.57 -0.95 -0.77 116.94 122.29 1vkm h PHE 156 Ca -0.01 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.51 1vkm h PHE 156 Cb 0.31 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.84 1vkm h PHE 156 CO 0.01 0.29 0.00 0.39 -2.23 0.00 0.00 178.31 176.77 1vkm n GLU 157 N -4.81 0.15 0.00 1.11 -0.58 -0.55 -2.98 120.64 112.98 1vkm n GLU 157 Ca 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.85 1vkm n GLU 157 Cb 0.23 -1.29 0.00 0.00 -0.57 0.00 0.00 31.44 29.82 1vkm n GLU 157 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1vkm n LEU 159 N 0.73 0.00 0.03 -4.62 4.77 -0.30 -1.60 117.00 116.01 1vkm n LEU 159 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 1vkm n LEU 159 Cb 0.06 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.06 1vkm n LEU 159 CO 0.00 0.00 0.71 -0.08 -1.33 0.00 0.00 177.39 176.69 1vkm h GLU 160 N 0.00 -0.07 -0.74 3.23 4.81 -1.78 -0.89 114.58 119.14 1vkm h GLU 160 Ca 0.00 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.38 1vkm h GLU 160 Cb 0.00 0.01 -0.10 0.00 0.63 0.00 0.00 28.75 29.30 1vkm h GLU 160 CO 0.00 0.22 0.26 1.15 -0.73 0.00 0.00 179.01 179.91 1vkm h THR 161 N -0.36 0.62 0.00 0.32 2.02 -1.61 -0.74 112.91 113.17 1vkm h THR 161 Ca -0.01 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.04 1vkm h THR 161 Cb 0.32 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1vkm h THR 161 CO 0.01 0.07 0.00 0.18 0.37 0.00 0.00 175.52 176.15 1vkm n LEU 162 N -5.05 0.00 -2.29 2.58 4.77 -1.22 -4.89 117.00 110.91 1vkm n LEU 162 Ca 0.14 0.06 -0.15 0.00 -0.03 0.00 0.00 56.01 56.03 1vkm n LEU 162 Cb 0.42 -0.06 0.04 0.00 -2.33 0.00 0.00 43.42 41.48 1vkm n LEU 162 CO 0.17 -0.01 0.08 -0.62 -1.33 0.00 0.00 177.39 175.67 1vkm n GLU 163 N -1.06 -4.22 -3.19 3.23 1.02 -0.28 -4.75 120.64 111.38 1vkm n GLU 163 Ca 0.17 0.57 -0.43 0.00 -0.02 0.00 0.00 57.16 57.45 1vkm n GLU 163 Cb 0.11 -4.75 -0.07 0.00 -0.02 0.00 0.00 31.44 26.71 1vkm n GLU 163 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1vkm s ILE 164 N -3.08 4.93 0.26 -3.67 1.01 -0.35 -4.90 121.20 115.40 1vkm s ILE 164 Ca 0.29 -0.31 -0.30 0.00 0.00 0.00 0.00 60.65 60.34 1vkm s ILE 164 Cb -0.13 -4.20 -0.09 0.00 0.01 0.00 0.00 42.46 38.05 1vkm s ILE 164 CO 0.36 -0.64 1.26 -2.16 0.00 0.00 0.00 174.94 173.76 1vkm s PRO 165 N 2.52 4.43 -0.05 2.79 0.04 -1.25 -4.59 135.00 138.89 1vkm s PRO 165 Ca 0.16 2.05 0.06 0.00 0.04 0.00 0.00 61.00 63.31 1vkm s PRO 165 Cb -0.17 -3.15 -0.01 0.00 0.04 0.00 0.00 34.50 31.20 1vkm s PRO 165 CO 0.14 -0.13 -0.22 -0.51 0.04 0.00 0.00 177.00 176.32 1vkm s LEU 166 N -0.94 2.01 -0.01 -3.56 1.43 -1.26 -4.50 118.68 111.85 1vkm s LEU 166 Ca 0.51 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 53.19 1vkm s LEU 166 Cb -0.37 -1.20 0.00 0.00 0.03 0.00 0.00 46.19 44.66 1vkm s LEU 166 CO 0.44 0.22 -0.04 0.68 0.23 0.00 0.00 176.35 177.88 1vkm s VAL 167 N -0.14 0.32 0.00 -1.59 -7.23 -1.26 -4.33 120.40 106.17 1vkm s VAL 167 Ca -0.02 -0.13 -0.27 0.00 -1.81 0.00 0.00 61.98 59.74 1vkm s VAL 167 Cb -0.12 -0.30 -0.04 0.00 0.56 0.00 0.00 36.38 36.48 1vkm s VAL 167 CO 0.02 0.11 0.87 -0.83 -0.31 0.00 0.00 175.10 174.97 1vkm s GLY 168 N 0.15 2.82 -0.64 2.32 0.00 0.13 -0.52 107.32 111.60 1vkm s GLY 168 Ca -0.01 0.40 -0.27 0.00 0.00 0.00 0.00 44.72 44.84 1vkm s GLY 168 CO -0.00 1.44 1.16 -0.12 0.00 0.00 0.00 173.10 175.57 1vkm s PHE 169 N 0.69 2.53 -1.39 1.90 5.36 0.15 -1.16 117.98 126.06 1vkm s PHE 169 Ca 0.46 0.09 -0.10 0.00 -0.96 0.00 0.00 56.93 56.42 1vkm s PHE 169 Cb -0.20 -4.46 0.07 0.00 -0.34 0.00 0.00 43.02 38.09 1vkm s PHE 169 CO 0.25 -1.72 0.61 0.54 -1.46 0.00 0.00 175.22 173.43 1vkm n ARG 170 N 8.52 -4.01 -3.67 10.12 1.74 0.32 -4.86 116.66 124.83 1vkm n ARG 170 Ca 0.04 0.57 -0.15 0.00 -0.77 0.00 0.00 57.85 57.54 1vkm n ARG 170 Cb 0.48 -5.33 -0.08 0.00 -1.02 0.00 0.00 32.46 26.51 1vkm n ARG 170 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1vkm s THR 171 N -3.05 0.03 -2.46 0.55 -1.32 -1.25 -5.03 115.64 103.11 1vkm s THR 171 Ca 0.44 -0.27 0.23 0.00 -1.21 0.00 0.00 61.69 60.88 1vkm s THR 171 Cb -0.23 -0.76 0.44 0.00 -1.51 0.00 0.00 72.50 70.43 1vkm s THR 171 CO 0.55 -0.15 1.42 0.59 -2.21 0.00 0.00 174.62 174.82 1vkm n ASN 172 N 1.21 3.36 -4.66 8.08 4.13 -1.26 -3.89 115.26 122.23 1vkm n ASN 172 Ca -0.20 -1.98 -0.37 0.00 1.68 0.00 0.00 54.58 53.71 1vkm n ASN 172 Cb 0.56 -0.25 -0.09 0.00 -1.54 0.00 0.00 39.78 38.47 1vkm n ASN 172 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1vkm s GLU 173 N -1.50 4.11 -0.10 3.52 0.41 -1.26 -0.62 118.70 123.26 1vkm s GLU 173 Ca 0.39 -0.07 -0.29 0.00 -0.41 0.00 0.00 54.97 54.59 1vkm s GLU 173 Cb 0.23 -3.54 -0.06 0.00 -1.78 0.00 0.00 34.13 28.98 1vkm s GLU 173 CO 0.31 0.02 1.88 0.12 -0.49 0.00 0.00 175.26 177.11 1vkm s PHE 174 N 1.17 1.58 0.62 1.61 5.36 0.14 -4.83 117.98 123.63 1vkm s PHE 174 Ca 0.12 0.13 -0.12 0.00 -0.96 0.00 0.00 56.93 56.10 1vkm s PHE 174 Cb -0.14 -4.05 -0.03 0.00 -0.34 0.00 0.00 43.02 38.46 1vkm s PHE 174 CO 0.06 -4.27 1.04 -1.25 -1.46 0.00 0.00 175.22 169.33 1vkm s PRO 175 N 4.88 3.42 -0.45 10.12 0.04 -1.26 -2.47 135.00 149.28 1vkm s PRO 175 Ca 0.84 0.89 0.09 0.00 0.04 0.00 0.00 61.00 62.86 1vkm s PRO 175 Cb -0.34 -2.06 0.33 0.00 0.04 0.00 0.00 34.50 32.48 1vkm s PRO 175 CO 0.35 -0.71 0.79 -0.11 0.04 0.00 0.00 177.00 177.35 1vkm n LEU 176 N -2.62 2.10 0.00 -3.56 7.94 -0.26 -3.97 117.00 116.63 1vkm n LEU 176 Ca 0.07 -5.23 0.00 0.00 -1.11 0.00 0.00 56.01 49.74 1vkm n LEU 176 Cb 0.54 0.23 0.00 0.00 0.53 0.00 0.00 43.42 44.72 1vkm n LEU 176 CO 0.55 2.28 0.00 0.33 -1.11 0.00 0.00 177.39 179.44 1vkm n PHE 177 N 0.23 0.00 0.26 1.96 7.35 0.94 -0.68 117.46 127.52 1vkm n PHE 177 Ca 0.27 0.00 0.11 0.00 -0.76 0.00 0.00 57.45 57.07 1vkm n PHE 177 Cb 0.55 0.00 0.72 0.00 0.35 0.00 0.00 39.48 41.10 1vkm n PHE 177 CO 0.00 0.00 0.00 0.74 -0.76 0.00 0.00 176.76 176.74 1vkm h PHE 178 N 0.00 0.00 -3.44 -5.13 0.04 -1.89 -3.39 116.94 103.13 1vkm h PHE 178 Ca 0.00 0.00 -0.67 0.00 2.80 0.00 0.00 57.97 60.10 1vkm h PHE 178 Cb 0.00 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 38.00 1vkm h PHE 178 CO 0.00 0.09 -0.66 -1.12 -0.60 0.00 0.00 178.31 176.02 1vkm s SER 179 N -6.44 4.99 0.18 2.17 0.01 0.14 -1.05 113.70 113.70 1vkm s SER 179 Ca -0.04 0.01 0.05 0.00 1.31 0.00 0.00 55.95 57.28 1vkm s SER 179 Cb 0.15 -1.30 0.03 0.00 0.21 0.00 0.00 66.02 65.11 1vkm s SER 179 CO 0.61 0.32 1.41 0.03 0.41 0.00 0.00 173.24 176.02 1vkm h ARG 180 N 4.72 0.12 -6.59 12.44 3.08 -1.84 -0.66 114.38 125.64 1vkm h ARG 180 Ca -0.49 -0.13 -0.68 0.00 0.07 0.00 0.00 59.98 58.75 1vkm h ARG 180 Cb 1.18 0.04 -0.21 0.00 0.08 0.00 0.00 29.97 31.05 1vkm h ARG 180 CO 0.55 0.89 -0.80 0.15 -1.07 0.00 0.00 179.97 179.69 1vkm s LYS 181 N -3.20 2.04 -0.00 0.04 1.02 -1.26 -4.07 119.74 114.30 1vkm s LYS 181 Ca -0.02 -1.00 0.07 0.00 0.02 0.00 0.00 55.97 55.04 1vkm s LYS 181 Cb 0.11 -2.19 -0.09 0.00 -0.52 0.00 0.00 37.83 35.14 1vkm s LYS 181 CO 0.81 0.53 0.27 -1.13 -0.92 0.00 0.00 175.35 174.91 1vkm n SER 182 N 1.44 1.18 0.00 2.83 3.41 -1.03 -4.56 113.62 116.88 1vkm n SER 182 Ca -0.16 -0.48 0.00 0.00 -0.26 0.00 0.00 58.87 57.97 1vkm n SER 182 Cb 0.52 1.10 0.00 0.00 -0.26 0.00 0.00 64.21 65.57 1vkm n SER 182 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vkm n GLY 183 N 1.43 0.90 3.55 5.00 0.00 -1.26 -5.06 105.19 109.75 1vkm n GLY 183 Ca 0.01 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.75 1vkm n GLY 183 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vkm s ARG 184 N -0.18 2.01 0.04 1.61 1.81 -1.26 -5.04 118.95 117.94 1vkm s ARG 184 Ca 0.00 -1.20 0.04 0.00 -1.72 0.00 0.00 55.73 52.85 1vkm s ARG 184 Cb 0.00 -2.18 -0.04 0.00 -0.45 0.00 0.00 34.95 32.28 1vkm s ARG 184 CO 0.00 0.46 -0.03 1.03 -0.68 0.00 0.00 175.30 176.08 1vkm s ARG 185 N -2.56 2.59 0.22 3.54 1.81 -1.26 -0.68 118.95 122.61 1vkm s ARG 185 Ca 0.23 -0.75 0.04 0.00 -1.72 0.00 0.00 55.73 53.52 1vkm s ARG 185 Cb -0.10 -2.55 -0.05 0.00 -0.45 0.00 0.00 34.95 31.80 1vkm s ARG 185 CO 0.14 0.58 -0.02 0.14 -0.68 0.00 0.00 175.30 175.46 1vkm s VAL 186 N -1.15 1.07 0.45 3.52 -7.23 0.21 -4.76 120.40 112.50 1vkm s VAL 186 Ca 0.21 -2.04 -0.24 0.00 -1.81 0.00 0.00 61.98 58.10 1vkm s VAL 186 Cb -0.11 -2.28 -0.08 0.00 0.56 0.00 0.00 36.38 34.47 1vkm s VAL 186 CO 0.13 -0.38 1.22 -2.16 -0.31 0.00 0.00 175.10 173.59 1vkm s PRO 187 N -3.84 3.79 -0.03 4.82 0.04 -1.26 -4.44 135.00 134.08 1vkm s PRO 187 Ca 0.27 1.92 -0.00 0.00 0.04 0.00 0.00 61.00 63.23 1vkm s PRO 187 Cb 0.05 -2.52 -0.04 0.00 0.04 0.00 0.00 34.50 32.03 1vkm s PRO 187 CO 0.08 -0.56 0.03 0.50 0.04 0.00 0.00 177.00 177.09 1vkm s ARG 188 N -2.54 2.96 0.27 4.56 3.52 -1.26 0.22 118.95 126.69 1vkm s ARG 188 Ca 0.62 -0.49 0.07 0.00 -0.13 0.00 0.00 55.73 55.80 1vkm s ARG 188 Cb -0.32 -2.79 -0.06 0.00 -1.56 0.00 0.00 34.95 30.22 1vkm s ARG 188 CO 0.40 0.66 -0.08 0.96 -0.81 0.00 0.00 175.30 176.43 1vkm s ILE 189 N -1.07 1.75 -0.06 4.11 -5.25 -0.31 -4.89 121.20 115.48 1vkm s ILE 189 Ca 0.19 -2.16 0.15 0.00 -0.99 0.00 0.00 60.65 57.84 1vkm s ILE 189 Cb -0.12 -2.40 -0.22 0.00 2.95 0.00 0.00 42.46 42.67 1vkm s ILE 189 CO 0.09 -0.34 0.24 -0.62 -1.79 0.00 0.00 174.94 172.52 1vkm n GLU 190 N -0.57 0.88 -3.83 0.37 -0.58 -1.26 -0.52 120.64 115.12 1vkm n GLU 190 Ca -0.06 -0.10 -0.07 0.00 -0.42 0.00 0.00 57.16 56.52 1vkm n GLU 190 Cb 0.63 -1.37 -0.01 0.00 -0.57 0.00 0.00 31.44 30.12 1vkm n GLU 190 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1vkm s ASN 191 N -4.13 -0.18 0.45 1.62 2.20 -1.26 -4.76 114.94 108.88 1vkm s ASN 191 Ca -0.06 -0.69 0.24 0.00 -0.94 0.00 0.00 52.86 51.40 1vkm s ASN 191 Cb 0.08 0.70 1.02 0.00 -2.00 0.00 0.00 41.25 41.05 1vkm s ASN 191 CO 0.63 -1.32 1.88 -0.37 -2.94 0.00 0.00 177.10 174.97 1vkm h VAL 192 N 2.00 0.64 -0.74 3.54 -1.51 -1.97 -2.51 116.25 115.69 1vkm h VAL 192 Ca -0.23 -1.04 -0.06 0.00 -1.23 0.00 0.00 66.70 64.14 1vkm h VAL 192 Cb 1.24 1.68 -0.03 0.00 -2.13 0.00 0.00 31.29 32.05 1vkm h VAL 192 CO 0.28 0.22 0.25 -0.33 -1.23 0.00 0.00 177.57 176.76 1vkm h GLU 193 N 0.00 1.14 -0.24 5.19 3.07 -1.97 -1.63 114.58 120.13 1vkm h GLU 193 Ca -0.00 -0.23 -0.12 0.00 -0.50 0.00 0.00 59.36 58.51 1vkm h GLU 193 Cb 0.66 -0.17 -0.01 0.00 -0.84 0.00 0.00 28.75 28.39 1vkm h GLU 193 CO 0.03 0.96 -0.35 0.93 -1.40 0.00 0.00 179.01 179.18 1vkm h GLU 194 N 1.10 0.53 -0.16 2.33 5.08 -1.87 -1.59 114.58 119.99 1vkm h GLU 194 Ca 0.24 -0.25 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 1vkm h GLU 194 Cb 0.28 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.49 1vkm h GLU 194 CO -0.01 0.81 -0.05 0.28 -1.00 0.00 0.00 179.01 179.04 1vkm h VAL 195 N 0.45 0.82 -0.02 3.13 2.07 -1.27 -2.58 116.25 118.84 1vkm h VAL 195 Ca 0.05 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.47 1vkm h VAL 195 Cb 0.82 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1vkm h VAL 195 CO 0.07 0.00 -0.43 -0.07 0.02 0.00 0.00 177.57 177.16 1vkm h LEU 196 N -0.01 0.05 -0.57 2.57 3.38 -0.86 -1.49 115.31 118.38 1vkm h LEU 196 Ca 0.08 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 1vkm h LEU 196 Cb 0.14 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1vkm h LEU 196 CO -0.18 0.48 0.18 0.50 0.09 0.00 0.00 178.44 179.51 1vkm h LYS 197 N 0.04 0.88 -0.27 1.13 3.64 -1.19 -0.20 116.57 120.60 1vkm h LYS 197 Ca 0.00 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.19 1vkm h LYS 197 Cb 0.78 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.46 1vkm h LYS 197 CO 0.06 0.79 0.15 0.82 -2.27 0.00 0.00 179.45 179.00 1vkm h ILE 198 N 0.79 1.13 -0.21 2.00 2.04 -1.05 -1.37 117.51 120.85 1vkm h ILE 198 Ca 0.18 -0.35 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 1vkm h ILE 198 Cb 0.28 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 1vkm h ILE 198 CO -0.01 0.13 0.12 0.22 0.00 0.00 0.00 178.15 178.61 1vkm h TYR 199 N 0.32 0.29 -0.75 1.37 3.20 -1.12 -2.58 116.97 117.70 1vkm h TYR 199 Ca 0.10 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.94 1vkm h TYR 199 Cb 0.08 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.22 1vkm h TYR 199 CO -0.03 0.26 0.40 0.93 -1.64 0.00 0.00 178.16 178.07 1vkm h GLU 200 N 0.23 1.05 -1.82 1.82 4.39 -1.00 -1.88 114.58 117.37 1vkm h GLU 200 Ca 0.07 -0.12 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1vkm h GLU 200 Cb 0.06 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.51 1vkm h GLU 200 CO -0.01 0.78 0.00 0.43 -1.16 0.00 0.00 179.01 179.05 1vkm n SER 201 N -4.35 0.35 0.00 1.42 7.64 -0.52 -1.52 113.62 116.64 1vkm n SER 201 Ca 0.08 -0.24 0.00 0.00 1.01 0.00 0.00 58.87 59.71 1vkm n SER 201 Cb 0.11 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.25 1vkm n SER 201 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1vkm n LYS 203 N 0.92 0.00 0.00 1.43 5.02 -0.71 -4.64 118.16 120.19 1vkm n LYS 203 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1vkm n LYS 203 Cb 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 1vkm n LYS 203 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1vkm n GLU 204 N 0.00 0.18 -2.39 1.97 1.02 -0.58 -4.68 120.64 116.16 1vkm n GLU 204 Ca 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 57.16 57.11 1vkm n GLU 204 Cb 0.00 -1.32 0.07 0.00 -0.02 0.00 0.00 31.44 30.16 1vkm n GLU 204 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1vkm n GLU 206 N 0.78 0.77 -3.18 3.49 4.71 -1.26 -5.23 120.64 120.72 1vkm n GLU 206 Ca 0.00 -0.94 -0.44 0.00 -0.01 0.00 0.00 57.16 55.76 1vkm n GLU 206 Cb 0.08 0.14 -0.06 0.00 -1.01 0.00 0.00 31.44 30.59 1vkm n GLU 206 CO 0.00 0.00 0.00 -1.17 0.09 0.00 0.00 177.13 176.05 1vkm s LEU 207 N -2.55 5.27 -1.12 -4.62 2.96 -1.26 -5.00 118.68 112.36 1vkm s LEU 207 Ca 0.08 -1.20 -0.14 0.00 -0.22 0.00 0.00 54.13 52.65 1vkm s LEU 207 Cb 0.25 -2.35 0.19 0.00 0.50 0.00 0.00 46.19 44.78 1vkm s LEU 207 CO -0.07 -0.94 1.28 -0.70 -1.32 0.00 0.00 176.35 174.60 1vkm s GLU 208 N 2.48 4.00 0.04 1.98 2.56 -1.26 -4.64 118.70 123.85 1vkm s GLU 208 Ca 0.12 -2.55 -0.08 0.00 0.00 0.00 0.00 54.97 52.46 1vkm s GLU 208 Cb -0.22 -4.90 -0.00 0.00 2.00 0.00 0.00 34.13 31.00 1vkm s GLU 208 CO 0.09 -1.64 0.15 0.15 -0.56 0.00 0.00 175.26 173.44 1vkm s LYS 209 N 1.15 0.64 0.05 4.30 -0.14 -1.26 -3.62 119.74 120.86 1vkm s LYS 209 Ca 0.37 -0.69 -0.30 0.00 -1.36 0.00 0.00 55.97 53.99 1vkm s LYS 209 Cb -0.05 0.26 -0.04 0.00 -1.68 0.00 0.00 37.83 36.32 1vkm s LYS 209 CO -0.04 -0.18 1.00 0.99 -0.76 0.00 0.00 175.35 176.37 1vkm s THR 210 N -2.60 4.63 0.00 2.17 2.01 -0.80 -3.81 115.64 117.25 1vkm s THR 210 Ca -0.05 1.98 0.00 0.00 0.31 0.00 0.00 61.69 63.93 1vkm s THR 210 Cb -0.01 -4.27 0.00 0.00 0.01 0.00 0.00 72.50 68.23 1vkm s THR 210 CO -0.04 0.21 0.00 -0.11 -0.69 0.00 0.00 174.62 173.98 1vkm n LEU 211 N 3.51 0.00 -3.23 4.42 7.94 0.04 -3.87 117.00 125.82 1vkm n LEU 211 Ca 0.05 0.00 0.04 0.00 -1.11 0.00 0.00 56.01 54.99 1vkm n LEU 211 Cb 0.50 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.42 1vkm n LEU 211 CO 0.52 -0.20 0.68 -0.69 -1.11 0.00 0.00 177.39 176.59 1vkm s VAL 213 N 0.39 -0.31 -0.19 1.96 1.01 0.44 -0.55 120.40 123.16 1vkm s VAL 213 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.84 1vkm s VAL 213 Cb 0.00 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.34 1vkm s VAL 213 CO 0.00 0.00 0.30 -0.76 0.00 0.00 0.00 175.10 174.64 1vkm s LEU 214 N 2.60 4.19 -0.21 3.92 1.43 0.33 -2.02 118.68 128.91 1vkm s LEU 214 Ca -0.02 0.44 -0.01 0.00 -1.03 0.00 0.00 54.13 53.51 1vkm s LEU 214 Cb -0.07 -2.37 0.06 0.00 0.03 0.00 0.00 46.19 43.84 1vkm s LEU 214 CO -0.14 0.03 0.00 0.21 0.23 0.00 0.00 176.35 176.69 1vkm s ASN 215 N 0.76 3.33 0.56 2.29 2.47 0.27 -0.68 114.94 123.95 1vkm s ASN 215 Ca 0.16 -0.99 -0.19 0.00 0.42 0.00 0.00 52.86 52.26 1vkm s ASN 215 Cb -0.14 -0.84 -0.05 0.00 -1.45 0.00 0.00 41.25 38.77 1vkm s ASN 215 CO 0.05 -0.28 1.16 -2.16 -3.72 0.00 0.00 177.10 172.16 1vkm s PRO 216 N 1.66 3.19 0.43 0.43 0.04 -1.26 -3.91 135.00 135.58 1vkm s PRO 216 Ca -0.03 1.71 -0.25 0.00 0.04 0.00 0.00 61.00 62.47 1vkm s PRO 216 Cb -0.18 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.29 1vkm s PRO 216 CO -0.08 -1.00 1.25 1.55 0.04 0.00 0.00 177.00 178.77 1vkm n VAL 217 N -1.42 2.66 -1.67 -0.36 3.14 -1.26 -4.93 118.33 114.49 1vkm n VAL 217 Ca 0.12 -0.50 -0.42 0.00 -2.96 0.00 0.00 64.34 60.59 1vkm n VAL 217 Cb 0.50 -1.54 0.00 0.00 -1.06 0.00 0.00 33.84 31.75 1vkm n VAL 217 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 1vkm n PRO 218 N -0.04 1.83 0.10 1.45 -0.02 -1.26 -4.80 135.00 132.26 1vkm n PRO 218 Ca 0.07 0.65 0.06 0.00 -2.02 0.00 0.00 63.50 62.25 1vkm n PRO 218 Cb 0.40 -2.25 0.51 0.00 -0.02 0.00 0.00 33.50 32.14 1vkm n PRO 218 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1vkm h GLU 219 N 2.13 0.32 0.00 -0.52 4.81 -1.98 -1.92 114.58 117.41 1vkm h GLU 219 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 1vkm h GLU 219 Cb 1.30 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1vkm h GLU 219 CO 0.60 0.21 0.00 -0.85 -0.73 0.00 0.00 179.01 178.25 1vkm n GLU 220 N -4.50 0.09 0.00 1.92 0.00 -1.26 -2.73 120.64 114.15 1vkm n GLU 220 Ca 0.01 0.19 0.03 0.00 0.00 0.00 0.00 57.16 57.39 1vkm n GLU 220 Cb 0.07 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 29.98 1vkm n GLU 220 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1vkm n TYR 221 N -1.42 0.00 -1.86 -1.84 4.01 -0.74 -5.07 117.16 110.23 1vkm n TYR 221 Ca 0.05 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.45 1vkm n TYR 221 Cb 0.17 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.24 1vkm n TYR 221 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 1vkm s GLU 222 N -1.54 2.87 -0.10 -0.72 -1.05 -1.11 -4.50 118.70 112.54 1vkm s GLU 222 Ca 0.03 1.54 0.04 0.00 -0.15 0.00 0.00 54.97 56.43 1vkm s GLU 222 Cb 0.05 -1.95 0.00 0.00 -0.44 0.00 0.00 34.13 31.80 1vkm s GLU 222 CO 0.26 -1.22 -0.23 0.42 0.95 0.00 0.00 175.26 175.44 1vkm s ILE 223 N -2.08 1.99 0.34 1.83 1.01 -0.22 -5.01 121.20 119.06 1vkm s ILE 223 Ca 0.70 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 60.09 1vkm s ILE 223 Cb -0.23 -1.73 -0.11 0.00 0.01 0.00 0.00 42.46 40.40 1vkm s ILE 223 CO 0.37 0.54 1.48 -2.84 0.00 0.00 0.00 174.94 174.50 1vkm s PRO 224 N 0.40 4.17 0.36 2.79 0.02 -1.26 -3.79 135.00 137.69 1vkm s PRO 224 Ca -0.18 2.49 0.05 0.00 0.02 0.00 0.00 61.00 63.38 1vkm s PRO 224 Cb -0.18 -3.01 0.72 0.00 0.02 0.00 0.00 34.50 32.05 1vkm s PRO 224 CO 0.08 -0.49 1.97 1.25 -0.33 0.00 0.00 177.00 179.48 1vkm h HIS 225 N 3.69 0.77 -0.45 6.54 2.76 -1.94 -2.16 115.15 124.36 1vkm h HIS 225 Ca -0.49 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 57.69 1vkm h HIS 225 Cb 1.23 -0.26 -0.02 0.00 1.55 0.00 0.00 27.41 29.91 1vkm h HIS 225 CO 0.56 0.43 0.25 0.38 -1.30 0.00 0.00 177.93 178.24 1vkm h ASP 226 N 0.78 0.54 -0.38 3.26 2.03 -1.98 0.16 116.42 120.83 1vkm h ASP 226 Ca 0.29 -0.03 -0.02 0.00 -0.73 0.00 0.00 57.03 56.54 1vkm h ASP 226 Cb 0.17 -0.14 -0.02 0.00 -0.83 0.00 0.00 39.33 38.52 1vkm h ASP 226 CO -0.09 0.44 0.18 -0.33 -1.03 0.00 0.00 179.24 178.41 1vkm h GLU 227 N 0.62 0.56 -0.60 4.15 5.08 -1.76 -1.63 114.58 121.00 1vkm h GLU 227 Ca 0.16 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.39 1vkm h GLU 227 Cb 0.02 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1vkm h GLU 227 CO -0.03 0.50 0.19 0.82 -1.00 0.00 0.00 179.01 179.50 1vkm h ILE 228 N 0.48 1.24 -0.65 3.13 1.08 -1.33 -2.73 117.51 118.73 1vkm h ILE 228 Ca 0.13 -0.82 0.03 0.00 -0.39 0.00 0.00 64.86 63.81 1vkm h ILE 228 Cb 0.14 0.64 -0.04 0.00 -3.07 0.00 0.00 36.82 34.49 1vkm h ILE 228 CO -0.01 0.31 0.40 -0.33 -0.69 0.00 0.00 178.15 177.83 1vkm h GLU 229 N 0.85 0.77 -0.51 2.37 5.08 -0.50 -0.37 114.58 122.27 1vkm h GLU 229 Ca 0.19 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1vkm h GLU 229 Cb 0.28 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 1vkm h GLU 229 CO -0.01 0.51 -0.00 0.00 -1.00 0.00 0.00 179.01 178.51 1vkm h ARG 230 N 0.80 0.87 -0.03 2.33 -0.00 -1.20 -1.99 114.38 115.16 1vkm h ARG 230 Ca 0.26 -0.25 -0.00 0.00 -0.50 0.00 0.00 59.98 59.49 1vkm h ARG 230 Cb 0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 29.97 29.88 1vkm h ARG 230 CO -0.10 0.87 0.01 -0.07 0.00 0.00 0.00 179.97 180.68 1vkm h LEU 231 N 0.80 0.04 -1.64 3.04 3.38 -1.16 -3.01 115.31 116.76 1vkm h LEU 231 Ca 0.15 -0.23 0.11 0.00 0.09 0.00 0.00 57.88 58.00 1vkm h LEU 231 Cb 0.48 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.19 1vkm h LEU 231 CO 0.02 0.26 0.42 -0.07 0.09 0.00 0.00 178.44 179.16 1vkm h LEU 232 N -0.17 0.36 -1.77 1.67 3.38 -0.89 -1.28 115.31 116.61 1vkm h LEU 232 Ca 0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1vkm h LEU 232 Cb 0.23 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1vkm h LEU 232 CO 0.00 0.21 -0.03 -0.33 0.09 0.00 0.00 178.44 178.39 1vkm h GLU 233 N 0.40 0.00 -0.01 1.13 5.08 -1.22 -2.52 114.58 117.44 1vkm h GLU 233 Ca 0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 1vkm h GLU 233 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1vkm h GLU 233 CO -0.08 0.03 -0.11 1.63 -1.00 0.00 0.00 179.01 179.48 1vkm n LYS 234 N -3.15 1.30 -3.54 2.33 5.02 -0.49 -4.88 118.16 114.74 1vkm n LYS 234 Ca -0.00 -0.75 -0.37 0.00 -2.02 0.00 0.00 58.31 55.17 1vkm n LYS 234 Cb 0.26 -1.48 -0.09 0.00 -0.02 0.00 0.00 35.03 33.70 1vkm n LYS 234 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1vkm s ILE 235 N -2.22 5.29 -0.05 -0.18 1.01 -0.95 -5.06 121.20 119.04 1vkm s ILE 235 Ca 0.32 0.42 -0.28 0.00 0.00 0.00 0.00 60.65 61.12 1vkm s ILE 235 Cb 0.20 -3.60 -0.03 0.00 0.01 0.00 0.00 42.46 39.04 1vkm s ILE 235 CO 0.41 0.30 0.89 -0.70 0.00 0.00 0.00 174.94 175.84 1vkm s GLU 236 N 1.17 4.48 -0.55 2.79 2.12 -1.26 -4.99 118.70 122.46 1vkm s GLU 236 Ca 0.13 1.22 -0.25 0.00 0.36 0.00 0.00 54.97 56.42 1vkm s GLU 236 Cb -0.14 -3.48 0.04 0.00 0.26 0.00 0.00 34.13 30.81 1vkm s GLU 236 CO 0.06 -0.08 1.00 -1.17 -0.54 0.00 0.00 175.26 174.53 1vkm s LEU 237 N 1.18 3.94 0.00 2.70 2.96 -1.26 -4.86 118.68 123.34 1vkm s LEU 237 Ca 0.46 -0.20 0.23 0.00 -0.22 0.00 0.00 54.13 54.39 1vkm s LEU 237 Cb -0.19 -2.94 0.52 0.00 0.50 0.00 0.00 46.19 44.07 1vkm s LEU 237 CO 0.22 -1.27 1.46 -0.62 -1.32 0.00 0.00 176.35 174.82 1vkm n GLU 238 N 7.66 2.57 -4.30 1.98 1.02 -1.26 -4.95 120.64 123.35 1vkm n GLU 238 Ca 0.04 -2.39 -0.16 0.00 -0.02 0.00 0.00 57.16 54.63 1vkm n GLU 238 Cb 0.48 -1.53 -0.10 0.00 -0.02 0.00 0.00 31.44 30.26 1vkm n GLU 238 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1vkm s VAL 239 N -1.33 0.61 0.20 2.62 -7.23 -1.26 -5.16 120.40 108.85 1vkm s VAL 239 Ca 0.42 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.59 1vkm s VAL 239 Cb 0.24 -2.49 -0.04 0.00 0.56 0.00 0.00 36.38 34.65 1vkm s VAL 239 CO 0.32 -0.14 0.13 -1.83 -0.31 0.00 0.00 175.10 173.27 1vkm s GLU 240 N -4.00 1.21 6.80 4.82 -1.05 -1.26 -4.77 118.70 120.44 1vkm s GLU 240 Ca 0.34 -1.63 0.00 0.00 -0.15 0.00 0.00 54.97 53.53 1vkm s GLU 240 Cb 0.07 0.27 0.00 0.00 -0.44 0.00 0.00 34.13 34.03 1vkm s GLU 240 CO 0.11 -0.39 0.00 0.41 0.95 0.00 0.00 175.26 176.34 1vkm n GLY 241 N -0.27 3.17 0.25 -3.83 0.00 -1.26 -3.32 105.19 99.93 1vkm n GLY 241 Ca 0.02 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.89 1vkm n GLY 241 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vkm h LYS 242 N 0.00 0.00 0.00 1.61 1.57 -1.98 -2.23 116.57 115.53 1vkm h LYS 242 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1vkm h LYS 242 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 1vkm h LYS 242 CO 0.00 0.15 -0.06 0.93 -0.57 0.00 0.00 179.45 179.90 1vkm h GLU 243 N 0.00 0.00 -0.22 3.15 3.07 -1.96 -3.33 114.58 115.29 1vkm h GLU 243 Ca -0.00 0.00 0.05 0.00 -0.50 0.00 0.00 59.36 58.91 1vkm h GLU 243 Cb 0.41 0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.26 1vkm h GLU 243 CO 0.02 0.06 -0.16 0.28 -1.40 0.00 0.00 179.01 177.81 1vkm h VAL 244 N 0.00 0.55 0.35 3.13 2.07 -1.55 -1.33 116.25 119.47 1vkm h VAL 244 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.50 1vkm h VAL 244 Cb 0.42 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1vkm h VAL 244 CO 0.01 0.00 -0.17 0.74 0.02 0.00 0.00 177.57 178.17 1vkm h THR 245 N -0.16 0.64 -0.08 2.57 2.02 -1.80 -1.74 112.91 114.35 1vkm h THR 245 Ca 0.13 -0.45 -0.05 0.00 0.77 0.00 0.00 66.41 66.81 1vkm h THR 245 Cb 0.35 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1vkm h THR 245 CO -0.31 0.08 -0.16 -0.65 0.37 0.00 0.00 175.52 174.85 1vkm h PRO 246 N -0.74 0.13 0.24 6.66 0.11 -1.76 -0.95 132.00 135.70 1vkm h PRO 246 Ca -0.05 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.03 1vkm h PRO 246 Cb 0.50 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.59 1vkm h PRO 246 CO 0.08 0.30 -0.17 0.35 -0.21 0.00 0.00 178.00 178.35 1vkm h PHE 247 N 0.13 -0.44 -0.39 0.65 3.57 -1.15 -0.86 116.94 118.44 1vkm h PHE 247 Ca 0.03 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.42 1vkm h PHE 247 Cb 0.37 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.25 1vkm h PHE 247 CO 0.00 -0.26 -0.17 -0.07 -2.23 0.00 0.00 178.31 175.58 1vkm h LEU 248 N -0.41 0.73 -0.59 0.59 3.38 -0.95 -0.89 115.31 117.18 1vkm h LEU 248 Ca -0.02 -0.24 -0.11 0.00 0.09 0.00 0.00 57.88 57.60 1vkm h LEU 248 Cb 0.35 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1vkm h LEU 248 CO 0.01 0.91 -0.07 -0.07 0.09 0.00 0.00 178.44 179.30 1vkm h LEU 249 N 0.65 1.04 -0.31 1.67 3.38 -1.14 -1.34 115.31 119.26 1vkm h LEU 249 Ca 0.10 -0.33 -0.05 0.00 0.09 0.00 0.00 57.88 57.69 1vkm h LEU 249 Cb 0.66 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1vkm h LEU 249 CO 0.05 1.13 -0.00 0.50 0.09 0.00 0.00 178.44 180.20 1vkm h LYS 250 N 0.94 0.55 -0.93 1.13 3.64 -0.97 -1.82 116.57 119.10 1vkm h LYS 250 Ca 0.15 -0.18 0.12 0.00 -1.27 0.00 0.00 60.65 59.47 1vkm h LYS 250 Cb 0.64 -0.05 -0.08 0.00 -0.41 0.00 0.00 32.23 32.33 1vkm h LYS 250 CO 0.04 0.69 0.56 0.87 -2.27 0.00 0.00 179.45 179.34 1vkm h LYS 251 N 0.34 0.86 -0.18 1.90 1.79 -0.98 -2.21 116.57 118.10 1vkm h LYS 251 Ca 0.09 -0.05 -0.13 0.00 -2.18 0.00 0.00 60.65 58.38 1vkm h LYS 251 Cb 0.44 -0.19 -0.01 0.00 -1.58 0.00 0.00 32.23 30.89 1vkm h LYS 251 CO 0.02 0.57 -0.43 -0.07 -1.08 0.00 0.00 179.45 178.46 1vkm h LEU 252 N 0.89 0.45 -0.58 2.94 3.38 -0.96 -2.75 115.31 118.68 1vkm h LEU 252 Ca 0.46 -0.20 0.01 0.00 0.09 0.00 0.00 57.88 58.24 1vkm h LEU 252 Cb 0.48 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1vkm h LEU 252 CO -0.27 0.83 0.38 0.58 0.09 0.00 0.00 178.44 180.05 1vkm h VAL 253 N 0.35 1.14 0.00 1.22 2.07 -0.97 -1.10 116.25 118.96 1vkm h VAL 253 Ca 0.03 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1vkm h VAL 253 Cb 0.90 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1vkm h VAL 253 CO 0.08 0.14 0.00 -0.62 0.02 0.00 0.00 177.57 177.19 1vkm n GLU 254 N -4.69 0.36 0.00 1.57 1.02 -0.87 -0.84 120.64 117.19 1vkm n GLU 254 Ca 0.04 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1vkm n GLU 254 Cb 0.03 -1.25 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1vkm n GLU 254 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1vkm n THR 256 N 0.56 0.00 -3.99 2.62 -2.24 -0.42 -4.75 114.28 106.07 1vkm n THR 256 Ca 0.00 0.00 -0.31 0.00 -2.27 0.00 0.00 64.05 61.47 1vkm n THR 256 Cb 0.13 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.37 1vkm n THR 256 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1vkm n ASN 257 N 0.00 -4.07 0.00 3.42 3.02 -0.41 -1.90 115.26 115.33 1vkm n ASN 257 Ca 0.00 -0.85 0.00 0.00 -0.03 0.00 0.00 54.58 53.70 1vkm n ASN 257 Cb 0.00 -3.55 0.00 0.00 -0.61 0.00 0.00 39.78 35.62 1vkm n ASN 257 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vkm n GLY 258 N -1.62 0.76 0.23 7.41 0.00 -0.02 -4.96 105.19 106.99 1vkm n GLY 258 Ca 0.02 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.00 1vkm n GLY 258 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1vkm h ARG 259 N 4.06 0.64 -0.25 1.61 2.43 -1.63 -1.43 114.38 119.81 1vkm h ARG 259 Ca 0.00 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 58.99 1vkm h ARG 259 Cb 0.00 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.40 1vkm h ARG 259 CO 0.00 0.42 -0.42 1.79 -1.51 0.00 0.00 179.97 180.25 1vkm h THR 260 N 0.66 1.30 -0.52 0.20 1.35 -1.84 -2.05 112.91 112.01 1vkm h THR 260 Ca 0.24 -1.60 -0.00 0.00 -0.55 0.00 0.00 66.41 64.49 1vkm h THR 260 Cb 0.06 1.56 -0.02 0.00 -1.73 0.00 0.00 68.15 68.02 1vkm h THR 260 CO -0.12 0.51 0.31 0.25 -0.25 0.00 0.00 175.52 176.22 1vkm h LEU 261 N 0.50 0.62 -0.54 3.87 5.85 -1.82 -0.07 115.31 123.72 1vkm h LEU 261 Ca 0.04 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.62 1vkm h LEU 261 Cb 0.94 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.79 1vkm h LEU 261 CO 0.08 0.50 0.00 0.11 -0.34 0.00 0.00 178.44 178.79 1vkm h LYS 262 N 0.69 0.94 -0.11 1.25 1.57 -1.08 -0.74 116.57 119.09 1vkm h LYS 262 Ca 0.19 -0.30 0.04 0.00 -1.87 0.00 0.00 60.65 58.70 1vkm h LYS 262 Cb -0.01 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 1vkm h LYS 262 CO -0.03 0.96 -0.12 0.00 -0.57 0.00 0.00 179.45 179.68 1vkm h ALA 263 N 0.95 -0.05 -0.83 3.86 0.00 -1.18 -1.80 119.26 120.23 1vkm h ALA 263 Ca 0.15 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.17 1vkm h ALA 263 Cb 0.53 0.26 -0.06 0.00 0.00 0.00 0.00 17.79 18.51 1vkm h ALA 263 CO 0.03 -0.58 0.51 -0.97 0.00 0.00 0.00 179.25 178.23 1vkm h ASN 264 N -0.16 0.79 -0.20 0.00 -0.73 -0.76 -0.98 115.58 113.55 1vkm h ASN 264 Ca 0.08 0.02 -0.16 0.00 1.87 0.00 0.00 56.30 58.11 1vkm h ASN 264 Cb 0.28 -0.15 -0.00 0.00 0.27 0.00 0.00 38.32 38.71 1vkm h ASN 264 CO -0.21 0.51 -0.48 -0.07 -0.37 0.00 0.00 177.43 176.81 1vkm h LEU 265 N 0.93 0.84 -0.09 0.34 3.38 -0.97 -2.02 115.31 117.71 1vkm h LEU 265 Ca 0.36 -0.42 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1vkm h LEU 265 Cb 0.17 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1vkm h LEU 265 CO -0.17 1.18 0.05 0.00 0.09 0.00 0.00 178.44 179.59 1vkm h ALA 266 N 0.85 0.11 -0.22 1.53 0.00 -0.89 -2.24 119.26 118.40 1vkm h ALA 266 Ca 0.03 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1vkm h ALA 266 Cb 1.05 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1vkm h ALA 266 CO 0.10 -0.38 -0.48 1.37 0.00 0.00 0.00 179.25 179.87 1vkm h LEU 267 N 0.09 0.63 -0.77 0.00 8.10 -1.18 -1.96 115.31 120.22 1vkm h LEU 267 Ca 0.03 -0.31 0.03 0.00 0.11 0.00 0.00 57.88 57.75 1vkm h LEU 267 Cb 0.02 -0.18 -0.05 0.00 -0.44 0.00 0.00 40.66 40.02 1vkm h LEU 267 CO -0.01 1.01 0.49 -0.07 -4.11 0.00 0.00 178.44 175.75 1vkm h LEU 268 N 0.46 0.80 -0.20 0.17 3.38 -1.32 -0.05 115.31 118.55 1vkm h LEU 268 Ca 0.03 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.87 1vkm h LEU 268 Cb 1.00 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1vkm h LEU 268 CO 0.09 0.55 -0.35 -0.08 0.09 0.00 0.00 178.44 178.74 1vkm h GLU 269 N 0.94 0.60 -0.38 1.13 4.81 -1.23 -1.77 114.58 118.68 1vkm h GLU 269 Ca 0.31 -0.37 -0.07 0.00 -0.13 0.00 0.00 59.36 59.10 1vkm h GLU 269 Cb 0.03 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 1vkm h GLU 269 CO -0.12 0.98 -0.06 0.93 -0.73 0.00 0.00 179.01 180.01 1vkm h GLU 270 N 0.27 0.64 -0.56 1.92 4.39 -1.25 -2.42 114.58 117.58 1vkm h GLU 270 Ca 0.01 -0.18 -0.11 0.00 0.34 0.00 0.00 59.36 59.42 1vkm h GLU 270 Cb 0.94 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.50 1vkm h GLU 270 CO 0.08 0.71 -0.08 -0.91 -1.16 0.00 0.00 179.01 177.65 1vkm h ASN 271 N 0.60 1.05 -0.68 1.42 2.35 -0.85 -1.71 115.58 117.76 1vkm h ASN 271 Ca 0.11 -0.34 0.06 0.00 -0.55 0.00 0.00 56.30 55.59 1vkm h ASN 271 Cb 0.47 -0.28 -0.06 0.00 0.05 0.00 0.00 38.32 38.50 1vkm h ASN 271 CO 0.02 1.14 0.37 0.58 -1.65 0.00 0.00 177.43 177.90 1vkm h VAL 272 N 0.94 0.95 -0.32 2.81 2.07 -1.14 0.37 116.25 121.93 1vkm h VAL 272 Ca 0.15 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1vkm h VAL 272 Cb 0.65 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.62 1vkm h VAL 272 CO 0.04 0.12 0.20 0.11 0.02 0.00 0.00 177.57 178.07 1vkm h LYS 273 N 0.68 0.42 -0.32 1.57 1.57 -1.01 -1.01 116.57 118.47 1vkm h LYS 273 Ca 0.31 -0.03 -0.11 0.00 -1.87 0.00 0.00 60.65 58.95 1vkm h LYS 273 Cb 0.22 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1vkm h LYS 273 CO -0.20 0.29 -0.21 1.25 -0.57 0.00 0.00 179.45 180.02 1vkm h LEU 274 N 0.42 0.75 -0.77 2.94 5.85 -1.04 -2.07 115.31 121.39 1vkm h LEU 274 Ca 0.12 -0.43 0.05 0.00 0.84 0.00 0.00 57.88 58.46 1vkm h LEU 274 Cb -0.03 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.74 1vkm h LEU 274 CO -0.02 1.02 0.47 0.00 -0.34 0.00 0.00 178.44 179.56 1vkm h ALA 275 N 0.75 1.05 -0.62 1.25 0.00 -0.81 -2.03 119.26 118.85 1vkm h ALA 275 Ca 0.07 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.92 1vkm h ALA 275 Cb 0.76 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1vkm h ALA 275 CO 0.06 0.20 0.18 0.78 0.00 0.00 0.00 179.25 180.47 1vkm h GLY 276 N 0.87 1.02 1.05 0.00 0.00 -0.98 -0.48 103.07 104.55 1vkm h GLY 276 Ca 0.33 -0.59 -0.06 0.00 0.00 0.00 0.00 47.33 47.02 1vkm h GLY 276 CO -0.16 0.55 0.24 0.83 0.00 0.00 0.00 176.54 178.00 1vkm h GLU 277 N 0.92 1.13 -0.26 4.80 4.39 -0.97 -1.27 114.58 123.31 1vkm h GLU 277 Ca 0.20 -0.24 -0.02 0.00 0.34 0.00 0.00 59.36 59.64 1vkm h GLU 277 Cb 0.29 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 1vkm h GLU 277 CO -0.01 0.96 0.07 0.82 -1.16 0.00 0.00 179.01 179.70 1vkm h ILE 278 N 1.08 1.21 -0.88 3.13 2.04 -1.09 -2.64 117.51 120.37 1vkm h ILE 278 Ca 0.24 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.44 1vkm h ILE 278 Cb 0.29 1.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1vkm h ILE 278 CO -0.01 0.22 0.55 0.00 0.00 0.00 0.00 178.15 178.91 1vkm h ALA 279 N 0.90 1.12 -0.28 1.87 0.00 -0.92 0.84 119.26 122.77 1vkm h ALA 279 Ca 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 1vkm h ALA 279 Cb 0.26 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1vkm h ALA 279 CO -0.00 0.55 0.09 0.28 0.00 0.00 0.00 179.25 180.17 1vkm h VAL 280 N 1.20 1.20 -0.05 0.00 2.07 -1.20 -2.35 116.25 117.11 1vkm h VAL 280 Ca 0.32 -0.63 -0.14 0.00 0.82 0.00 0.00 66.70 67.06 1vkm h VAL 280 Cb -0.09 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.75 1vkm h VAL 280 CO -0.06 0.21 -0.61 0.11 0.02 0.00 0.00 177.57 177.24 1vkm h LYS 281 N 0.30 0.18 -0.56 1.57 1.79 -1.18 -3.11 116.57 115.56 1vkm h LYS 281 Ca 0.09 -0.13 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 1vkm h LYS 281 Cb 0.24 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 1vkm h LYS 281 CO -0.00 0.74 0.30 1.25 -1.08 0.00 0.00 179.45 180.65 1vkm h LEU 282 N 0.14 0.71 -1.27 2.94 5.85 -0.73 -2.43 115.31 120.52 1vkm h LEU 282 Ca -0.01 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.61 1vkm h LEU 282 Cb 1.10 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.95 1vkm h LEU 282 CO 0.09 0.61 0.47 0.50 -0.34 0.00 0.00 178.44 179.77 1vkm h LYS 283 N 0.76 0.00 0.00 1.25 1.63 -1.34 -3.51 116.57 115.35 1vkm h LYS 283 Ca 0.20 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.00 1vkm h LYS 283 Cb 0.07 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.70 1vkm h LYS 283 CO -0.03 0.00 0.00 0.54 -3.45 0.00 0.00 179.45 176.51