#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 4.49 0.42 0.58 1.01 -1.26 -5.02 121.20 121.43 1vkm s ILE -6 Ca 0.00 1.79 0.07 0.00 0.00 0.00 0.00 60.65 62.51 1vkm s ILE -6 Cb 0.00 -4.15 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 1vkm s ILE -6 CO 0.00 0.08 0.22 -1.38 0.00 0.00 0.00 174.94 173.86 1vkm s HIS -5 N 1.51 2.58 0.71 3.97 -3.43 -1.26 -5.11 115.29 114.26 1vkm s HIS -5 Ca 0.54 -0.59 -0.12 0.00 -0.80 0.00 0.00 55.06 54.10 1vkm s HIS -5 Cb -0.24 -1.99 0.02 0.00 -1.43 0.00 0.00 32.58 28.94 1vkm s HIS -5 CO 0.25 0.11 1.08 -3.38 -2.00 0.00 0.00 174.74 170.80 1vkm s HIS -4 N -2.59 2.83 -0.20 0.38 -3.43 -1.26 -5.03 115.29 105.99 1vkm s HIS -4 Ca 0.42 1.50 -0.12 0.00 -0.80 0.00 0.00 55.06 56.06 1vkm s HIS -4 Cb 0.03 -3.00 -0.05 0.00 -1.43 0.00 0.00 32.58 28.13 1vkm s HIS -4 CO 0.23 -1.49 0.20 -1.58 -2.00 0.00 0.00 174.74 170.10 1vkm s HIS -3 N -2.82 3.40 0.31 0.38 2.46 -1.26 -5.08 115.29 112.68 1vkm s HIS -3 Ca 0.61 0.40 -0.28 0.00 0.47 0.00 0.00 55.06 56.26 1vkm s HIS -3 Cb -0.16 -2.26 -0.09 0.00 -0.13 0.00 0.00 32.58 29.93 1vkm s HIS -3 CO 0.51 0.20 1.11 -1.01 -2.47 0.00 0.00 174.74 173.09 1vkm s HIS -2 N 0.61 3.46 -0.03 3.88 3.76 -1.26 -4.97 115.29 120.75 1vkm s HIS -2 Ca 0.11 1.67 -0.01 0.00 -0.15 0.00 0.00 55.06 56.67 1vkm s HIS -2 Cb -0.12 -3.29 -0.01 0.00 1.11 0.00 0.00 32.58 30.26 1vkm s HIS -2 CO 0.02 -0.69 -0.04 0.72 -0.85 0.00 0.00 174.74 173.90 1vkm n HIS -1 N 0.90 0.00 0.02 1.40 8.25 -1.26 -4.89 115.22 119.63 1vkm n HIS -1 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 1vkm n HIS -1 Cb 0.45 -0.11 -0.14 0.00 1.12 0.00 0.00 29.99 31.32 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 -0.09 0.14 -3.46 4.41 3.86 -2.02 -3.42 115.15 114.56 1vkm h HIS 0 Ca -0.07 -0.10 -0.73 0.00 -1.16 0.00 0.00 60.37 58.30 1vkm h HIS 0 Cb 1.07 -0.01 -0.30 0.00 1.06 0.00 0.00 27.41 29.24 1vkm h HIS 0 CO -0.01 1.14 -0.27 0.08 0.86 0.00 0.00 177.93 179.73 1vkm s VAL 1 N -2.63 4.45 -0.28 2.45 1.01 -1.26 -4.93 120.40 119.21 1vkm s VAL 1 Ca -0.05 -2.20 -0.18 0.00 0.00 0.00 0.00 61.98 59.55 1vkm s VAL 1 Cb 0.08 -3.87 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 1vkm s VAL 1 CO 0.83 -0.86 0.53 -0.63 0.00 0.00 0.00 175.10 174.96 1vkm s ILE 2 N 0.78 5.04 -0.20 2.22 1.01 -1.26 -4.90 121.20 123.88 1vkm s ILE 2 Ca 0.11 0.78 -0.04 0.00 0.00 0.00 0.00 60.65 61.50 1vkm s ILE 2 Cb -0.22 -3.87 -0.02 0.00 0.01 0.00 0.00 42.46 38.37 1vkm s ILE 2 CO -0.03 0.01 -0.03 -0.63 0.00 0.00 0.00 174.94 174.26 1vkm s ILE 3 N 2.36 3.65 -0.42 2.92 1.09 -1.26 -1.97 121.20 127.57 1vkm s ILE 3 Ca 0.21 -0.41 -0.10 0.00 -1.10 0.00 0.00 60.65 59.25 1vkm s ILE 3 Cb -0.15 -2.65 0.07 0.00 -1.06 0.00 0.00 42.46 38.67 1vkm s ILE 3 CO 0.10 0.43 0.28 -0.70 -0.10 0.00 0.00 174.94 174.95 1vkm s GLU 4 N 1.17 2.69 -0.23 2.79 2.12 0.72 -5.00 118.70 122.96 1vkm s GLU 4 Ca 0.02 -1.40 -0.10 0.00 0.36 0.00 0.00 54.97 53.85 1vkm s GLU 4 Cb -0.14 -3.83 -0.05 0.00 0.26 0.00 0.00 34.13 30.36 1vkm s GLU 4 CO 0.00 -0.94 0.14 0.45 -0.54 0.00 0.00 175.26 174.38 1vkm s SER 5 N 2.14 6.01 -0.25 -1.70 0.15 -1.26 -1.37 113.70 117.42 1vkm s SER 5 Ca 0.03 0.09 0.11 0.00 0.70 0.00 0.00 55.95 56.89 1vkm s SER 5 Cb -0.23 -2.08 0.73 0.00 -1.71 0.00 0.00 66.02 62.73 1vkm s SER 5 CO 0.03 0.07 1.67 0.54 1.20 0.00 0.00 173.24 176.76 1vkm n ARG 6 N 4.23 4.20 -3.48 5.44 3.00 -0.36 -4.94 116.66 124.75 1vkm n ARG 6 Ca -0.15 -2.86 -0.38 0.00 -0.01 0.00 0.00 57.85 54.45 1vkm n ARG 6 Cb 0.52 -2.19 -0.06 0.00 0.00 0.00 0.00 32.46 30.73 1vkm n ARG 6 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1vkm s ILE 7 N -2.68 5.14 -0.39 0.55 1.01 -1.26 -4.98 121.20 118.59 1vkm s ILE 7 Ca 0.50 0.78 -0.28 0.00 0.00 0.00 0.00 60.65 61.65 1vkm s ILE 7 Cb 0.39 -3.71 0.02 0.00 0.01 0.00 0.00 42.46 39.17 1vkm s ILE 7 CO 0.14 0.48 1.07 -0.70 0.00 0.00 0.00 174.94 175.93 1vkm s GLU 8 N -0.37 3.88 0.55 2.79 -6.30 -1.26 -4.98 118.70 113.02 1vkm s GLU 8 Ca 0.22 0.77 0.27 0.00 -2.50 0.00 0.00 54.97 53.74 1vkm s GLU 8 Cb -0.15 -3.82 1.45 0.00 0.00 0.00 0.00 34.13 31.61 1vkm s GLU 8 CO 0.10 -1.10 1.97 1.57 0.02 0.00 0.00 175.26 177.82 1vkm h LYS 9 N 8.61 0.00 -0.16 4.30 2.10 -1.99 -2.03 116.57 127.39 1vkm h LYS 9 Ca -0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.43 1vkm h LYS 9 Cb 1.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.39 1vkm h LYS 9 CO 1.06 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.92 1vkm n GLY 10 N -1.61 0.01 3.29 0.07 0.00 -1.26 -4.89 105.19 100.80 1vkm n GLY 10 Ca 0.10 -0.31 -0.26 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 -1.79 1.36 0.58 1.61 1.02 -0.77 -5.11 119.74 116.65 1vkm s LYS 11 Ca 0.26 -1.09 -0.20 0.00 0.02 0.00 0.00 55.97 54.96 1vkm s LYS 11 Cb 0.14 -1.59 -0.04 0.00 -0.52 0.00 0.00 37.83 35.82 1vkm s LYS 11 CO 0.20 0.39 1.21 -2.30 -0.92 0.00 0.00 175.35 173.93 1vkm n PRO 12 N 1.47 1.28 -3.86 -1.68 -0.02 -1.26 -4.80 135.00 126.12 1vkm n PRO 12 Ca -0.18 0.48 -0.12 0.00 -2.02 0.00 0.00 63.50 61.66 1vkm n PRO 12 Cb 0.53 -2.41 -0.13 0.00 -0.02 0.00 0.00 33.50 31.46 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 -1.38 0.01 -0.13 -1.45 0.11 -1.26 0.02 120.40 116.31 1vkm s VAL 13 Ca 0.75 -0.05 0.01 0.00 -2.93 0.00 0.00 61.98 59.77 1vkm s VAL 13 Cb -0.42 -0.08 0.02 0.00 -1.53 0.00 0.00 36.38 34.37 1vkm s VAL 13 CO 0.46 -0.03 -0.16 -0.69 -3.33 0.00 0.00 175.10 171.36 1vkm s VAL 14 N -0.06 1.66 0.85 2.04 1.01 -0.34 -4.29 120.40 121.27 1vkm s VAL 14 Ca -0.01 -0.71 -0.10 0.00 0.00 0.00 0.00 61.98 61.16 1vkm s VAL 14 Cb -0.01 -1.52 0.16 0.00 0.00 0.00 0.00 36.38 35.01 1vkm s VAL 14 CO 0.00 0.47 1.18 -0.83 0.00 0.00 0.00 175.10 175.92 1vkm s GLY 15 N 1.17 1.76 0.30 4.51 0.00 0.43 -0.19 107.32 115.32 1vkm s GLY 15 Ca -0.01 -1.37 0.09 0.00 0.00 0.00 0.00 44.72 43.43 1vkm s GLY 15 CO -0.06 -0.71 0.02 -1.83 0.00 0.00 0.00 173.10 170.53 1vkm s GLU 17 N -5.57 2.22 -0.05 2.90 -1.05 -1.26 -1.01 118.70 114.89 1vkm s GLU 17 Ca 0.70 -1.55 0.21 0.00 -0.15 0.00 0.00 54.97 54.18 1vkm s GLU 17 Cb -0.05 -2.08 -0.31 0.00 -0.44 0.00 0.00 34.13 31.25 1vkm s GLU 17 CO 0.49 0.25 0.43 0.25 0.95 0.00 0.00 175.26 177.63 1vkm n THR 18 N -0.95 0.31 0.05 1.83 -2.24 -1.12 -4.59 114.28 107.56 1vkm n THR 18 Ca -0.05 -0.57 -0.01 0.00 -2.27 0.00 0.00 64.05 61.14 1vkm n THR 18 Cb 0.60 -0.12 0.27 0.00 -2.10 0.00 0.00 70.33 68.98 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 1.24 -0.87 4.28 1.03 -1.38 -1.30 112.91 115.91 1vkm h THR 19 Ca -0.11 -1.11 0.08 0.00 -0.01 0.00 0.00 66.41 65.26 1vkm h THR 19 Cb 1.25 1.30 -0.07 0.00 -1.07 0.00 0.00 68.15 69.56 1vkm h THR 19 CO 0.01 0.35 0.53 1.62 -0.01 0.00 0.00 175.52 178.02 1vkm h VAL 20 N 0.35 0.99 -0.17 0.00 3.04 -1.82 0.85 116.25 119.50 1vkm h VAL 20 Ca 0.06 -0.32 -0.20 0.00 -1.01 0.00 0.00 66.70 65.23 1vkm h VAL 20 Cb 0.57 -0.02 0.00 0.00 -2.01 0.00 0.00 31.29 29.83 1vkm h VAL 20 CO 0.04 0.17 -0.70 -0.26 -1.01 0.00 0.00 177.57 175.81 1vkm h PHE 21 N 0.93 0.96 0.07 3.17 0.04 -1.55 -2.44 116.94 118.12 1vkm h PHE 21 Ca 0.40 -0.40 -0.36 0.00 2.80 0.00 0.00 57.97 60.41 1vkm h PHE 21 Cb 0.26 -0.16 -0.04 0.00 2.20 0.00 0.00 35.95 38.22 1vkm h PHE 21 CO -0.04 1.21 -2.09 0.28 -0.60 0.00 0.00 178.31 177.08 1vkm n VAL 22 N -3.94 1.67 0.06 -0.55 0.31 -0.63 -4.48 118.33 110.77 1vkm n VAL 22 Ca -0.06 -0.56 0.04 0.00 -0.01 0.00 0.00 64.34 63.75 1vkm n VAL 22 Cb 0.70 -1.69 -0.06 0.00 -0.91 0.00 0.00 33.84 31.88 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 -3.55 0.00 0.94 3.52 8.25 0.28 -4.75 115.22 119.91 1vkm n HIS 23 Ca -0.37 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.19 1vkm n HIS 23 Cb 0.99 -0.17 -0.12 0.00 1.12 0.00 0.00 29.99 31.82 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 1.88 -0.94 3.07 -1.41 0.00 -0.22 -4.86 105.19 102.72 1vkm n GLY 24 Ca -0.01 -0.58 -0.08 0.00 0.00 0.00 0.00 46.02 45.35 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 -3.02 2.17 0.62 0.99 1.43 -0.94 -4.98 118.68 114.96 1vkm s LEU 25 Ca 0.07 -0.72 -0.16 0.00 -1.03 0.00 0.00 54.13 52.29 1vkm s LEU 25 Cb 0.15 0.33 -0.02 0.00 0.03 0.00 0.00 46.19 46.69 1vkm s LEU 25 CO 0.84 -0.50 1.12 -2.84 0.23 0.00 0.00 176.35 175.20 1vkm s PRO 26 N -2.90 2.98 0.19 1.29 0.02 -1.26 -4.75 135.00 130.57 1vkm s PRO 26 Ca -0.03 1.47 -0.15 0.00 0.02 0.00 0.00 61.00 62.31 1vkm s PRO 26 Cb 0.01 -1.97 0.18 0.00 0.02 0.00 0.00 34.50 32.73 1vkm s PRO 26 CO -0.06 -1.12 1.66 -0.09 -0.33 0.00 0.00 177.00 177.06 1vkm h ARG 27 N 0.41 0.03 -0.10 5.54 2.43 -1.95 -0.12 114.38 120.62 1vkm h ARG 27 Ca -0.48 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.68 1vkm h ARG 27 Cb 1.25 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1vkm h ARG 27 CO 0.55 0.02 0.03 -0.22 -1.51 0.00 0.00 179.97 178.84 1vkm h LYS 28 N 0.03 0.16 -0.62 0.20 3.64 -1.98 -1.59 116.57 116.41 1vkm h LYS 28 Ca 0.25 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.55 1vkm h LYS 28 Cb 0.39 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1vkm h LYS 28 CO -0.50 0.32 0.19 0.93 -2.27 0.00 0.00 179.45 178.12 1vkm h GLU 29 N -0.03 0.94 0.12 1.90 3.07 -1.92 -1.77 114.58 116.89 1vkm h GLU 29 Ca 0.03 -0.18 0.00 0.00 -0.50 0.00 0.00 59.36 58.71 1vkm h GLU 29 Cb 0.23 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 1vkm h GLU 29 CO -0.00 0.81 -0.10 0.00 -1.40 0.00 0.00 179.01 178.32 1vkm h ALA 30 N 1.30 -0.21 -0.57 3.43 0.00 -0.79 -1.06 119.26 121.36 1vkm h ALA 30 Ca 0.20 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.05 1vkm h ALA 30 Cb 0.26 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1vkm h ALA 30 CO -0.01 -0.63 0.23 0.82 0.00 0.00 0.00 179.25 179.66 1vkm h ILE 31 N -0.23 1.22 -0.99 0.00 1.08 -1.20 -1.61 117.51 115.78 1vkm h ILE 31 Ca -0.00 -0.70 0.00 0.00 -0.39 0.00 0.00 64.86 63.77 1vkm h ILE 31 Cb 0.21 0.62 -0.05 0.00 -3.07 0.00 0.00 36.82 34.53 1vkm h ILE 31 CO -0.01 0.27 0.64 -0.08 -0.69 0.00 0.00 178.15 178.27 1vkm h GLU 32 N 0.79 1.31 -0.67 2.37 4.57 -1.27 -1.09 114.58 120.59 1vkm h GLU 32 Ca 0.19 -0.09 -0.03 0.00 -1.18 0.00 0.00 59.36 58.25 1vkm h GLU 32 Cb 0.20 -0.29 -0.03 0.00 -0.16 0.00 0.00 28.75 28.47 1vkm h GLU 32 CO -0.02 0.88 0.31 1.25 -1.18 0.00 0.00 179.01 180.26 1vkm h LEU 33 N 1.35 0.89 -0.17 1.64 5.85 -0.95 0.38 115.31 124.29 1vkm h LEU 33 Ca 0.36 -0.14 0.03 0.00 0.84 0.00 0.00 57.88 58.97 1vkm h LEU 33 Cb -0.13 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.65 1vkm h LEU 33 CO -0.07 0.78 -0.03 0.15 -0.34 0.00 0.00 178.44 178.92 1vkm h PHE 34 N 0.93 -0.07 -0.58 1.25 3.57 -0.69 0.34 116.94 121.69 1vkm h PHE 34 Ca 0.23 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.72 1vkm h PHE 34 Cb 0.14 0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.91 1vkm h PHE 34 CO 0.01 -0.06 0.29 0.00 -2.23 0.00 0.00 178.31 176.32 1vkm h ARG 35 N 0.01 0.82 -0.51 1.11 3.08 -0.95 0.68 114.38 118.63 1vkm h ARG 35 Ca 0.08 -0.11 -0.05 0.00 0.07 0.00 0.00 59.98 59.97 1vkm h ARG 35 Cb 0.12 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1vkm h ARG 35 CO -0.16 0.66 0.14 -0.09 -1.07 0.00 0.00 179.97 179.44 1vkm h ARG 36 N 0.78 0.80 -0.49 0.04 9.65 -0.54 -0.09 114.38 124.53 1vkm h ARG 36 Ca 0.20 -0.19 0.01 0.00 -1.10 0.00 0.00 59.98 58.91 1vkm h ARG 36 Cb 0.10 -0.11 -0.03 0.00 -1.39 0.00 0.00 29.97 28.54 1vkm h ARG 36 CO -0.03 0.76 0.31 0.00 2.80 0.00 0.00 179.97 183.81 1vkm h ALA 37 N 1.00 0.62 -0.84 2.80 0.00 -0.00 -0.90 119.26 121.95 1vkm h ALA 37 Ca 0.16 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1vkm h ALA 37 Cb 0.31 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.89 1vkm h ALA 37 CO -0.00 0.03 0.50 0.87 0.00 0.00 0.00 179.25 180.65 1vkm h LYS 38 N 0.63 1.15 -0.32 0.00 1.79 -0.67 -1.51 116.57 117.63 1vkm h LYS 38 Ca 0.19 -0.11 0.06 0.00 -2.18 0.00 0.00 60.65 58.61 1vkm h LYS 38 Cb -0.03 -0.24 -0.06 0.00 -1.58 0.00 0.00 32.23 30.32 1vkm h LYS 38 CO -0.06 0.81 -0.08 0.93 -1.08 0.00 0.00 179.45 179.97 1vkm h GLU 39 N 1.16 0.00 -0.40 3.15 5.08 -0.53 -1.30 114.58 121.73 1vkm h GLU 39 Ca 0.30 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.62 1vkm h GLU 39 Cb -0.03 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 1vkm h GLU 39 CO -0.06 0.00 0.09 0.82 -1.00 0.00 0.00 179.01 178.87 1vkm h ILE 40 N 0.00 1.19 -0.72 3.13 2.04 -0.87 -0.38 117.51 121.90 1vkm h ILE 40 Ca 0.16 -0.67 -0.06 0.00 1.00 0.00 0.00 64.86 65.28 1vkm h ILE 40 Cb 0.24 0.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1vkm h ILE 40 CO -0.33 0.24 0.20 0.77 0.00 0.00 0.00 178.15 179.03 1vkm h SER 41 N 0.59 1.06 0.02 1.72 4.64 -0.71 -1.79 113.55 119.07 1vkm h SER 41 Ca 0.13 -0.21 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1vkm h SER 41 Cb 0.24 -0.28 0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1vkm h SER 41 CO -0.00 1.00 -0.01 0.03 -0.87 0.00 0.00 176.83 176.98 1vkm h ARG 42 N 1.08 -0.02 -0.77 4.77 3.08 -0.61 -0.11 114.38 121.79 1vkm h ARG 42 Ca 0.23 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.33 1vkm h ARG 42 Cb 0.34 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.34 1vkm h ARG 42 CO -0.00 0.12 0.47 1.05 -1.07 0.00 0.00 179.97 180.54 1vkm h GLU 43 N -0.16 0.86 0.00 0.04 4.11 -0.90 -3.17 114.58 115.36 1vkm h GLU 43 Ca -0.00 -0.05 0.00 0.00 0.07 0.00 0.00 59.36 59.38 1vkm h GLU 43 Cb 0.15 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1vkm h GLU 43 CO 0.00 0.57 -0.93 1.63 0.07 0.00 0.00 179.01 180.35 1vkm n LYS 44 N -4.66 0.32 -2.14 1.06 5.02 -0.69 -4.99 118.16 112.07 1vkm n LYS 44 Ca 0.10 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 1vkm n LYS 44 Cb 0.14 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.52 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 1.34 0.94 3.44 0.72 0.00 -0.14 -4.97 105.19 106.51 1vkm n GLY 45 Ca 0.02 -0.58 -0.21 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.86 1.89 -0.23 1.61 -0.71 -0.67 -4.49 117.98 112.51 1vkm s PHE 46 Ca 0.00 -1.02 -0.09 0.00 -1.04 0.00 0.00 56.93 54.78 1vkm s PHE 46 Cb 0.00 -1.22 -0.04 0.00 -1.21 0.00 0.00 43.02 40.55 1vkm s PHE 46 CO 0.00 -0.07 0.12 -0.65 -1.34 0.00 0.00 175.22 173.28 1vkm s GLN 47 N -3.90 3.94 -0.35 1.99 -0.21 0.10 -4.39 119.66 116.85 1vkm s GLN 47 Ca 0.35 -0.34 -0.24 0.00 0.02 0.00 0.00 55.36 55.15 1vkm s GLN 47 Cb 0.08 -3.43 0.01 0.00 1.00 0.00 0.00 33.01 30.67 1vkm s GLN 47 CO 0.15 0.03 0.84 -1.17 -2.12 0.00 0.00 175.29 173.02 1vkm s LEU 48 N 1.09 4.07 -0.71 2.90 2.96 -1.26 -1.19 118.68 126.54 1vkm s LEU 48 Ca 0.06 0.51 -0.07 0.00 -0.22 0.00 0.00 54.13 54.41 1vkm s LEU 48 Cb -0.14 -3.13 0.19 0.00 0.50 0.00 0.00 46.19 43.60 1vkm s LEU 48 CO 0.04 -0.76 0.58 0.00 -1.32 0.00 0.00 176.35 174.89 1vkm s ALA 49 N 3.22 3.79 -0.00 5.97 0.00 0.74 -4.73 121.76 130.74 1vkm s ALA 49 Ca 0.34 -3.30 -0.30 0.00 0.00 0.00 0.00 51.96 48.71 1vkm s ALA 49 Cb -0.13 -3.01 -0.05 0.00 0.00 0.00 0.00 23.12 19.93 1vkm s ALA 49 CO 0.17 -2.18 1.26 0.08 0.00 0.00 0.00 175.76 175.09 1vkm s VAL 50 N 0.01 4.01 -0.17 0.00 1.01 -1.26 -4.31 120.40 119.69 1vkm s VAL 50 Ca 0.17 1.39 -0.05 0.00 0.00 0.00 0.00 61.98 63.49 1vkm s VAL 50 Cb -0.16 -3.89 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 1vkm s VAL 50 CO -0.06 0.03 0.00 -0.63 0.00 0.00 0.00 175.10 174.45 1vkm s ILE 51 N 1.94 4.26 0.34 2.22 1.01 -1.26 -0.39 121.20 129.32 1vkm s ILE 51 Ca 0.59 -0.22 -0.08 0.00 0.00 0.00 0.00 60.65 60.93 1vkm s ILE 51 Cb -0.28 -2.89 0.02 0.00 0.01 0.00 0.00 42.46 39.31 1vkm s ILE 51 CO 0.25 0.48 0.57 -0.83 0.00 0.00 0.00 174.94 175.41 1vkm s GLY 52 N 0.36 0.99 -0.17 6.18 0.00 -0.55 -3.12 107.32 111.01 1vkm s GLY 52 Ca -0.01 -1.18 0.00 0.00 0.00 0.00 0.00 44.72 43.53 1vkm s GLY 52 CO 0.02 -0.73 -0.16 -0.42 0.00 0.00 0.00 173.10 171.81 1vkm s ILE 53 N -3.00 2.52 -0.29 0.90 1.01 -0.67 -0.52 121.20 121.14 1vkm s ILE 53 Ca 0.25 -0.80 -0.02 0.00 0.00 0.00 0.00 60.65 60.07 1vkm s ILE 53 Cb -0.02 -2.07 0.04 0.00 0.01 0.00 0.00 42.46 40.42 1vkm s ILE 53 CO 0.16 0.51 0.00 -0.76 0.00 0.00 0.00 174.94 174.85 1vkm s LEU 54 N 1.08 3.81 -1.52 2.97 1.43 0.27 -1.02 118.68 125.71 1vkm s LEU 54 Ca -0.00 -1.17 -0.03 0.00 -1.03 0.00 0.00 54.13 51.90 1vkm s LEU 54 Cb -0.14 -1.72 0.00 0.00 0.03 0.00 0.00 46.19 44.36 1vkm s LEU 54 CO -0.05 -0.24 0.06 0.29 0.23 0.00 0.00 176.35 176.64 1vkm n LYS 55 N 4.66 -0.93 -0.17 1.70 4.76 -1.22 -1.09 118.16 125.86 1vkm n LYS 55 Ca -0.14 0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1vkm n LYS 55 Cb 0.44 -3.51 0.00 0.00 -1.84 0.00 0.00 35.03 30.12 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 -2.54 1.86 3.73 0.72 0.00 -0.18 -4.47 105.19 104.32 1vkm n GLY 56 Ca -0.31 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.34 1vkm n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vkm s LYS 57 N -0.28 4.24 -0.16 1.61 1.02 -0.25 -4.56 119.74 121.36 1vkm s LYS 57 Ca 0.00 0.17 -0.27 0.00 0.02 0.00 0.00 55.97 55.89 1vkm s LYS 57 Cb 0.00 -3.41 -0.01 0.00 -0.52 0.00 0.00 37.83 33.88 1vkm s LYS 57 CO 0.00 0.25 0.90 0.42 -0.92 0.00 0.00 175.35 176.01 1vkm s ILE 58 N 0.40 4.83 -0.16 2.17 1.01 -0.83 -0.56 121.20 128.06 1vkm s ILE 58 Ca 0.18 1.79 0.01 0.00 0.00 0.00 0.00 60.65 62.64 1vkm s ILE 58 Cb -0.13 -4.21 0.02 0.00 0.01 0.00 0.00 42.46 38.15 1vkm s ILE 58 CO 0.05 -0.01 -0.19 -0.69 0.00 0.00 0.00 174.94 174.10 1vkm s VAL 59 N 2.26 1.95 -0.35 2.92 1.01 0.32 -0.20 120.40 128.30 1vkm s VAL 59 Ca 0.42 -0.89 -0.09 0.00 0.00 0.00 0.00 61.98 61.42 1vkm s VAL 59 Cb -0.17 -1.76 0.03 0.00 0.00 0.00 0.00 36.38 34.48 1vkm s VAL 59 CO 0.13 0.52 0.16 0.00 0.00 0.00 0.00 175.10 175.92 1vkm s ALA 60 N 1.17 3.19 0.00 5.51 0.00 -0.47 -1.49 121.76 129.67 1vkm s ALA 60 Ca 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 51.96 50.28 1vkm s ALA 60 Cb -0.14 -2.46 0.00 0.00 0.00 0.00 0.00 23.12 20.53 1vkm s ALA 60 CO -0.09 -1.31 0.00 0.41 0.00 0.00 0.00 175.76 174.77 1vkm n GLY 61 N 4.93 1.79 3.37 0.00 0.00 0.48 -1.22 105.19 114.54 1vkm n GLY 61 Ca -0.12 -1.35 -0.19 0.00 0.00 0.00 0.00 46.02 44.36 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 1.95 0.21 1.61 1.04 -1.26 -4.78 113.70 112.47 1vkm s SER 63 Ca 0.00 -1.30 -0.10 0.00 0.48 0.00 0.00 55.95 55.03 1vkm s SER 63 Cb 0.00 -0.00 0.15 0.00 0.10 0.00 0.00 66.02 66.26 1vkm s SER 63 CO 0.00 -0.57 1.86 -0.08 0.98 0.00 0.00 173.24 175.42 1vkm h GLU 64 N 2.32 1.00 -0.51 4.02 4.81 -2.00 -1.24 114.58 122.98 1vkm h GLU 64 Ca -0.39 -0.08 0.03 0.00 -0.13 0.00 0.00 59.36 58.78 1vkm h GLU 64 Cb 1.23 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 30.37 1vkm h GLU 64 CO 0.66 0.69 0.30 1.49 -0.73 0.00 0.00 179.01 181.42 1vkm h GLU 65 N 1.01 0.58 -0.57 1.92 4.81 -2.04 0.02 114.58 120.31 1vkm h GLU 65 Ca 0.27 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.42 1vkm h GLU 65 Cb -0.06 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.16 1vkm h GLU 65 CO -0.05 0.38 0.18 0.93 -0.73 0.00 0.00 179.01 179.72 1vkm h GLU 66 N 0.60 0.89 -0.47 1.92 5.08 -1.92 -1.02 114.58 119.66 1vkm h GLU 66 Ca 0.21 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1vkm h GLU 66 Cb 0.03 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1vkm h GLU 66 CO -0.10 0.80 0.23 1.25 -1.00 0.00 0.00 179.01 180.19 1vkm h LEU 67 N 0.80 0.61 -0.73 1.33 5.85 -0.89 -2.34 115.31 119.95 1vkm h LEU 67 Ca 0.19 -0.13 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1vkm h LEU 67 Cb 0.28 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.09 1vkm h LEU 67 CO -0.01 0.57 0.41 -0.33 -0.34 0.00 0.00 178.44 178.74 1vkm h GLU 68 N 0.61 0.71 -5.29 1.25 4.39 -0.85 -3.43 114.58 111.97 1vkm h GLU 68 Ca 0.16 -0.04 -0.19 0.00 0.34 0.00 0.00 59.36 59.63 1vkm h GLU 68 Cb 0.12 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 1vkm h GLU 68 CO -0.02 0.47 0.62 0.00 -1.16 0.00 0.00 179.01 178.92 1vkm n ALA 69 N -2.36 1.12 0.00 3.43 0.00 -0.40 -4.68 120.51 117.61 1vkm n ALA 69 Ca 0.10 -2.68 0.00 0.00 0.00 0.00 0.00 53.44 50.86 1vkm n ALA 69 Cb 0.20 -3.42 0.00 0.00 0.00 0.00 0.00 19.45 16.23 1vkm n ALA 69 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1vkm n ARG 72 N 8.20 0.00 0.18 0.00 1.85 -1.26 -4.38 116.66 121.25 1vkm n ARG 72 Ca 0.43 0.00 0.07 0.00 -1.00 0.00 0.00 57.85 57.35 1vkm n ARG 72 Cb 0.47 -0.67 0.11 0.00 -1.05 0.00 0.00 32.46 31.32 1vkm n ARG 72 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 1vkm h GLU 73 N 0.00 0.00 0.00 2.89 5.08 -1.96 -3.50 114.58 117.09 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 0.30 0.00 0.41 -1.00 0.00 0.00 179.01 178.72 1vkm n GLY 74 N 1.11 -0.04 3.41 -3.84 0.00 -1.26 -5.09 105.19 99.48 1vkm n GLY 74 Ca 0.03 -1.61 -0.14 0.00 0.00 0.00 0.00 46.02 44.30 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 -2.96 -1.29 0.49 4.61 0.00 -1.26 -4.73 121.76 116.62 1vkm s ALA 75 Ca 0.00 1.38 -0.23 0.00 0.00 0.00 0.00 51.96 53.11 1vkm s ALA 75 Cb 0.00 -0.74 -0.07 0.00 0.00 0.00 0.00 23.12 22.32 1vkm s ALA 75 CO 0.00 -0.26 1.28 -0.51 0.00 0.00 0.00 175.76 176.27 1vkm s ASP 76 N 0.07 5.81 -0.09 0.00 1.11 -1.14 -4.67 116.67 117.76 1vkm s ASP 76 Ca -0.02 2.58 -0.27 0.00 0.18 0.00 0.00 52.55 55.03 1vkm s ASP 76 Cb -0.04 -2.62 -0.02 0.00 1.07 0.00 0.00 42.92 41.31 1vkm s ASP 76 CO 0.02 -1.19 0.86 -0.75 1.18 0.00 0.00 175.17 175.29 1vkm s LYS 77 N -2.70 4.42 -0.06 8.23 2.20 -1.26 -0.37 119.74 130.20 1vkm s LYS 77 Ca 0.66 1.14 0.01 0.00 -0.36 0.00 0.00 55.97 57.41 1vkm s LYS 77 Cb -0.36 -3.51 0.02 0.00 -1.51 0.00 0.00 37.83 32.48 1vkm s LYS 77 CO 0.43 -0.15 -0.06 0.14 -0.36 0.00 0.00 175.35 175.36 1vkm s VAL 78 N 1.47 0.68 0.00 4.02 -7.23 -0.30 -4.94 120.40 114.11 1vkm s VAL 78 Ca 0.43 -0.18 0.00 0.00 -1.81 0.00 0.00 61.98 60.42 1vkm s VAL 78 Cb -0.18 -0.70 0.00 0.00 0.56 0.00 0.00 36.38 36.06 1vkm s VAL 78 CO 0.19 0.27 0.00 0.61 -0.31 0.00 0.00 175.10 175.86 1vkm n GLY 79 N 4.21 0.63 0.18 2.32 0.00 -1.26 -1.82 105.19 109.46 1vkm n GLY 79 Ca -0.21 -1.91 -0.03 0.00 0.00 0.00 0.00 46.02 43.87 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 -0.32 0.68 0.00 2.61 2.02 -1.91 -1.91 112.91 114.08 1vkm h THR 80 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.13 1vkm h THR 80 Cb 0.00 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1vkm h THR 80 CO 0.00 0.03 0.00 0.08 0.37 0.00 0.00 175.52 176.00 1vkm h ARG 81 N 0.14 0.00 0.00 6.66 0.11 -1.98 -2.42 114.38 116.89 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 0.32 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.40 1vkm h ARG 81 CO -0.35 0.00 -0.57 0.39 0.10 0.00 0.00 179.97 179.54 1vkm n GLU 82 N -2.56 0.18 -0.11 0.08 4.71 -0.72 -4.32 120.64 117.90 1vkm n GLU 82 Ca 0.02 0.05 -0.05 0.00 -0.01 0.00 0.00 57.16 57.18 1vkm n GLU 82 Cb 0.31 -1.61 0.02 0.00 -1.01 0.00 0.00 31.44 29.16 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 0.75 -0.53 -3.67 2.04 -1.39 -2.66 117.51 112.05 1vkm h ILE 83 Ca 0.00 -0.05 0.05 0.00 1.00 0.00 0.00 64.86 65.86 1vkm h ILE 83 Cb 0.65 0.60 -0.05 0.00 -0.74 0.00 0.00 36.82 37.28 1vkm h ILE 83 CO 0.00 0.03 0.25 -0.65 0.00 0.00 0.00 178.15 177.78 1vkm h PRO 84 N 0.15 0.47 -0.42 2.37 0.11 -1.78 -1.44 132.00 131.46 1vkm h PRO 84 Ca 0.19 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 66.13 1vkm h PRO 84 Cb 0.24 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.24 1vkm h PRO 84 CO -0.28 0.31 -0.27 0.97 -0.21 0.00 0.00 178.00 178.53 1vkm h ILE 85 N 0.49 1.27 -0.34 4.15 6.09 -1.79 0.50 117.51 127.88 1vkm h ILE 85 Ca 0.24 -1.43 -0.09 0.00 -1.37 0.00 0.00 64.86 62.21 1vkm h ILE 85 Cb 0.18 1.28 -0.02 0.00 0.47 0.00 0.00 36.82 38.73 1vkm h ILE 85 CO -0.19 0.48 -0.16 -0.37 -3.07 0.00 0.00 178.15 174.84 1vkm h VAL 86 N 0.74 1.25 -0.05 2.19 -1.51 -1.31 -0.36 116.25 117.21 1vkm h VAL 86 Ca 0.08 -1.18 -0.01 0.00 -1.23 0.00 0.00 66.70 64.37 1vkm h VAL 86 Cb 0.85 1.17 -0.00 0.00 -2.13 0.00 0.00 31.29 31.18 1vkm h VAL 86 CO 0.07 0.39 0.01 0.58 -1.23 0.00 0.00 177.57 177.39 1vkm h VAL 87 N 0.56 1.21 -0.68 7.19 2.07 -1.00 -0.84 116.25 124.77 1vkm h VAL 87 Ca 0.09 -0.65 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 1vkm h VAL 87 Cb 0.60 1.56 -0.03 0.00 -1.52 0.00 0.00 31.29 31.90 1vkm h VAL 87 CO 0.04 0.18 0.28 0.00 0.02 0.00 0.00 177.57 178.08 1vkm h ALA 88 N 0.76 1.21 -0.00 1.67 0.00 -0.77 -2.79 119.26 119.34 1vkm h ALA 88 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1vkm h ALA 88 Cb 0.28 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1vkm h ALA 88 CO 0.00 0.58 -0.23 0.39 0.00 0.00 0.00 179.25 179.99 1vkm n GLU 89 N -4.31 0.53 -3.18 0.00 1.02 -0.16 -4.96 120.64 109.59 1vkm n GLU 89 Ca 0.06 -0.25 -0.15 0.00 -0.02 0.00 0.00 57.16 56.80 1vkm n GLU 89 Cb 0.17 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.15 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 1.37 0.01 3.92 0.62 0.00 -0.40 -4.95 105.19 105.75 1vkm n GLY 90 Ca 0.11 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 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 -5.79 3.56 0.39 1.61 1.02 -0.70 -3.86 119.74 115.98 1vkm s LYS 91 Ca 0.35 -0.23 -0.26 0.00 0.02 0.00 0.00 55.97 55.85 1vkm s LYS 91 Cb -0.16 -2.83 -0.09 0.00 -0.52 0.00 0.00 37.83 34.24 1vkm s LYS 91 CO 0.46 0.41 1.29 -0.80 -0.92 0.00 0.00 175.35 175.78 1vkm s ASN 92 N -2.93 6.41 -0.16 2.83 0.01 -1.26 -1.01 114.94 118.83 1vkm s ASN 92 Ca 0.40 2.63 -0.15 0.00 -0.71 0.00 0.00 52.86 55.03 1vkm s ASN 92 Cb -0.11 -2.64 0.04 0.00 0.41 0.00 0.00 41.25 38.95 1vkm s ASN 92 CO 0.28 -0.78 0.43 0.00 -1.51 0.00 0.00 177.10 175.52 1vkm s ALA 93 N -1.25 -1.07 -0.22 0.60 0.00 -0.19 -2.87 121.76 116.76 1vkm s ALA 93 Ca 0.55 1.22 -0.10 0.00 0.00 0.00 0.00 51.96 53.63 1vkm s ALA 93 Cb -0.38 -0.71 -0.05 0.00 0.00 0.00 0.00 23.12 21.99 1vkm s ALA 93 CO 0.49 -0.20 0.14 0.00 0.00 0.00 0.00 175.76 176.18 1vkm s ALA 94 N 0.23 3.64 0.27 0.00 0.00 0.50 -1.67 121.76 124.72 1vkm s ALA 94 Ca -0.00 -0.78 -0.21 0.00 0.00 0.00 0.00 51.96 50.97 1vkm s ALA 94 Cb -0.03 -2.23 -0.09 0.00 0.00 0.00 0.00 23.12 20.77 1vkm s ALA 94 CO 0.01 0.00 0.79 0.95 0.00 0.00 0.00 175.76 177.50 1vkm s THR 95 N 0.67 4.49 0.24 0.00 -4.23 -1.26 -1.15 115.64 114.40 1vkm s THR 95 Ca 0.08 1.38 -0.01 0.00 -1.18 0.00 0.00 61.69 61.96 1vkm s THR 95 Cb -0.12 -3.86 0.05 0.00 1.34 0.00 0.00 72.50 69.91 1vkm s THR 95 CO 0.01 0.13 0.33 0.35 -0.54 0.00 0.00 174.62 174.89 1vkm n THR 96 N 0.51 0.00 -0.17 3.99 -2.24 -0.75 -1.20 114.28 114.42 1vkm n THR 96 Ca -0.00 -0.46 -0.08 0.00 -2.27 0.00 0.00 64.05 61.24 1vkm n THR 96 Cb 0.51 -1.33 0.01 0.00 -2.10 0.00 0.00 70.33 67.42 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 -0.58 1.17 0.00 2.28 2.07 -1.96 -1.69 116.25 117.55 1vkm h VAL 97 Ca -0.11 -0.45 0.02 0.00 0.82 0.00 0.00 66.70 66.99 1vkm h VAL 97 Cb 0.38 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 1vkm h VAL 97 CO 0.11 0.18 -0.15 0.77 0.02 0.00 0.00 177.57 178.50 1vkm h SER 98 N 0.64 -0.45 -0.54 0.57 4.64 -1.88 -0.37 113.55 116.17 1vkm h SER 98 Ca 0.17 0.07 -0.06 0.00 -0.47 0.00 0.00 61.79 61.50 1vkm h SER 98 Cb 0.06 0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.31 1vkm h SER 98 CO -0.03 -0.21 0.13 0.00 -0.87 0.00 0.00 176.83 175.85 1vkm h ALA 99 N 0.68 1.13 -0.30 5.18 0.00 -1.79 -0.38 119.26 123.78 1vkm h ALA 99 Ca 0.05 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 1vkm h ALA 99 Cb 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1vkm h ALA 99 CO -0.15 0.58 -0.03 1.15 0.00 0.00 0.00 179.25 180.80 1vkm h THR 100 N 0.87 1.27 -0.33 0.00 2.02 -0.89 -0.35 112.91 115.49 1vkm h THR 100 Ca 0.19 -1.02 -0.03 0.00 0.77 0.00 0.00 66.41 66.32 1vkm h THR 100 Cb 0.33 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.05 1vkm h THR 100 CO 0.00 0.33 0.10 0.40 0.37 0.00 0.00 175.52 176.72 1vkm h ILE 101 N 0.34 1.21 -0.05 3.11 2.04 -0.83 0.47 117.51 123.80 1vkm h ILE 101 Ca 0.08 -0.67 0.04 0.00 1.00 0.00 0.00 64.86 65.31 1vkm h ILE 101 Cb 0.49 1.02 -0.05 0.00 -0.74 0.00 0.00 36.82 37.55 1vkm h ILE 101 CO 0.02 0.23 -0.21 0.15 0.00 0.00 0.00 178.15 178.34 1vkm h PHE 102 N 0.38 -0.57 -0.44 1.37 3.57 -0.99 -1.02 116.94 119.25 1vkm h PHE 102 Ca 0.11 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.52 1vkm h PHE 102 Cb 0.25 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.24 1vkm h PHE 102 CO 0.01 -0.30 -0.14 -0.07 -2.23 0.00 0.00 178.31 175.58 1vkm h LEU 103 N -0.31 0.88 -0.75 0.59 3.38 -1.04 -3.05 115.31 115.01 1vkm h LEU 103 Ca 0.07 -0.38 0.10 0.00 0.09 0.00 0.00 57.88 57.77 1vkm h LEU 103 Cb 0.42 -0.24 -0.08 0.00 0.09 0.00 0.00 40.66 40.85 1vkm h LEU 103 CO -0.23 1.06 0.37 0.28 0.09 0.00 0.00 178.44 180.01 1vkm h SER 104 N 0.69 0.48 0.08 -0.43 0.02 -0.58 -1.34 113.55 112.47 1vkm h SER 104 Ca 0.11 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 1vkm h SER 104 Cb 0.69 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.22 1vkm h SER 104 CO 0.05 0.26 -0.07 -0.09 -1.14 0.00 0.00 176.83 175.84 1vkm h ARG 105 N 0.61 0.00 -0.00 3.45 9.65 -1.11 -1.01 114.38 125.97 1vkm h ARG 105 Ca 0.38 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.26 1vkm h ARG 105 Cb 0.43 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.01 1vkm h ARG 105 CO -0.29 0.07 -0.31 0.54 2.80 0.00 0.00 179.97 182.77 1vkm n ARG 106 N -4.37 0.39 -0.03 0.20 1.74 -0.54 -4.07 116.66 109.98 1vkm n ARG 106 Ca -0.03 -0.20 0.02 0.00 -0.77 0.00 0.00 57.85 56.87 1vkm n ARG 106 Cb 0.15 -1.50 0.03 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 -1.13 1.00 -0.62 0.55 -5.35 -0.70 -5.00 119.36 108.11 1vkm n ILE 107 Ca 0.09 -1.07 0.00 0.00 -0.27 0.00 0.00 62.75 61.50 1vkm n ILE 107 Cb 0.33 0.43 0.00 0.00 -1.74 0.00 0.00 39.64 38.66 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 -0.59 0.64 3.64 3.28 0.00 -0.66 -5.04 105.19 106.47 1vkm n GLY 108 Ca 0.03 -0.41 -0.39 0.00 0.00 0.00 0.00 46.02 45.25 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 5.10 -0.13 -0.61 1.01 -0.47 -4.97 121.20 119.13 1vkm s ILE 109 Ca 0.00 0.90 0.17 0.00 0.00 0.00 0.00 60.65 61.73 1vkm s ILE 109 Cb 0.00 -3.83 -0.25 0.00 0.01 0.00 0.00 42.46 38.39 1vkm s ILE 109 CO 0.00 0.15 0.19 -0.62 0.00 0.00 0.00 174.94 174.66 1vkm n GLU 110 N 5.06 0.89 -4.26 2.79 1.02 -1.26 -4.05 120.64 120.82 1vkm n GLU 110 Ca -0.05 -0.07 -0.34 0.00 -0.02 0.00 0.00 57.16 56.69 1vkm n GLU 110 Cb 0.50 -1.46 -0.11 0.00 -0.02 0.00 0.00 31.44 30.35 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 -2.75 4.22 0.02 2.62 1.01 -1.26 0.01 120.40 124.26 1vkm s VAL 111 Ca -0.08 -0.24 0.05 0.00 0.00 0.00 0.00 61.98 61.70 1vkm s VAL 111 Cb 0.08 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.57 1vkm s VAL 111 CO 0.76 0.48 -0.14 -0.69 0.00 0.00 0.00 175.10 175.51 1vkm s VAL 112 N 0.34 1.14 0.05 2.92 1.01 0.38 -0.43 120.40 125.81 1vkm s VAL 112 Ca -0.02 -0.87 0.09 0.00 0.00 0.00 0.00 61.98 61.18 1vkm s VAL 112 Cb -0.13 -1.00 -0.03 0.00 0.00 0.00 0.00 36.38 35.22 1vkm s VAL 112 CO 0.02 0.12 -0.25 0.54 0.00 0.00 0.00 175.10 175.53 1vkm s VAL 113 N -0.67 2.02 0.21 2.92 0.11 -0.18 -0.80 120.40 124.02 1vkm s VAL 113 Ca 0.03 -1.36 0.01 0.00 -2.93 0.00 0.00 61.98 57.72 1vkm s VAL 113 Cb -0.07 -1.73 -0.00 0.00 -1.53 0.00 0.00 36.38 33.04 1vkm s VAL 113 CO 0.01 0.30 0.27 1.07 -3.33 0.00 0.00 175.10 173.42 1vkm n THR 114 N 1.74 0.00 -0.02 5.04 5.66 -0.35 -4.25 114.28 122.10 1vkm n THR 114 Ca -0.17 -1.21 -0.02 0.00 -3.05 0.00 0.00 64.05 59.60 1vkm n THR 114 Cb 0.52 0.70 -0.01 0.00 -1.55 0.00 0.00 70.33 70.00 1vkm n THR 114 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 1vkm h GLY 115 N 1.23 0.00 -4.81 1.09 0.00 -1.93 -3.40 103.07 95.26 1vkm h GLY 115 Ca -0.16 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.02 1vkm h GLY 115 CO 0.22 0.00 -0.45 -0.32 0.00 0.00 0.00 176.54 175.99 1vkm s GLY 116 N -3.08 -0.02 0.71 4.60 0.00 -1.26 0.13 107.32 108.39 1vkm s GLY 116 Ca -0.05 0.06 -0.11 0.00 0.00 0.00 0.00 44.72 44.61 1vkm s GLY 116 CO 0.07 -0.09 1.09 -0.51 0.00 0.00 0.00 173.10 173.67 1vkm s THR 117 N -1.15 3.52 1.12 0.90 -4.23 -0.77 -4.56 115.64 110.46 1vkm s THR 117 Ca -0.12 0.49 -0.19 0.00 -1.18 0.00 0.00 61.69 60.69 1vkm s THR 117 Cb -0.06 -3.47 0.27 0.00 1.34 0.00 0.00 72.50 70.57 1vkm s THR 117 CO 0.02 -0.64 1.24 0.61 -0.54 0.00 0.00 174.62 175.30 1vkm n GLY 118 N -2.94 -2.13 0.00 3.99 0.00 -1.26 -1.48 105.19 101.37 1vkm n GLY 118 Ca 0.07 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1vkm n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1vkm n GLY 119 N -4.35 1.85 3.69 -0.02 0.00 -1.26 -4.73 105.19 100.37 1vkm n GLY 119 Ca 0.16 -0.35 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.07 5.06 0.51 1.61 1.01 -1.26 -0.39 120.40 125.87 1vkm s VAL 120 Ca 0.00 1.22 -0.09 0.00 0.00 0.00 0.00 61.98 63.11 1vkm s VAL 120 Cb 0.00 -3.95 -0.05 0.00 0.00 0.00 0.00 36.38 32.38 1vkm s VAL 120 CO 0.00 0.20 0.88 -1.00 0.00 0.00 0.00 175.10 175.18 1vkm s HIS 121 N 1.28 3.55 0.26 5.22 3.76 0.23 -0.23 115.29 129.36 1vkm s HIS 121 Ca 0.31 1.08 -0.28 0.00 -0.15 0.00 0.00 55.06 56.01 1vkm s HIS 121 Cb -0.16 -2.51 -0.15 0.00 1.11 0.00 0.00 32.58 30.87 1vkm s HIS 121 CO 0.13 -0.38 0.92 -2.30 -0.85 0.00 0.00 174.74 172.26 1vkm n PRO 122 N -2.14 1.04 0.00 8.40 -0.02 -1.26 -0.82 135.00 140.21 1vkm n PRO 122 Ca 0.03 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 61.88 1vkm n PRO 122 Cb 0.54 -1.67 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 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 1.45 3.39 3.25 -1.23 0.00 -1.26 -4.69 105.19 106.10 1vkm n GLY 123 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.83 -0.34 -0.03 1.61 1.74 0.00 -4.81 116.66 113.01 1vkm n ARG 124 Ca 0.00 0.09 -0.18 0.00 -0.77 0.00 0.00 57.85 56.99 1vkm n ARG 124 Cb 0.00 -3.77 -0.14 0.00 -1.02 0.00 0.00 32.46 27.53 1vkm n ARG 124 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1vkm n VAL 125 N -2.14 1.68 -3.04 1.55 0.31 -1.26 -4.82 118.33 110.62 1vkm n VAL 125 Ca 0.00 -0.68 -0.43 0.00 -0.01 0.00 0.00 64.34 63.22 1vkm n VAL 125 Cb 0.09 -1.48 -0.06 0.00 -0.91 0.00 0.00 33.84 31.48 1vkm n VAL 125 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1vkm s ASP 126 N -6.69 6.37 -0.08 4.52 -1.08 -1.26 -5.03 116.67 113.42 1vkm s ASP 126 Ca -0.20 -0.20 0.01 0.00 -0.52 0.00 0.00 52.55 51.63 1vkm s ASP 126 Cb 0.07 -2.35 0.02 0.00 -1.46 0.00 0.00 42.92 39.20 1vkm s ASP 126 CO 0.75 -0.83 -0.09 -0.69 0.52 0.00 0.00 175.17 174.83 1vkm s VAL 127 N 3.04 0.95 0.41 1.11 1.01 -1.26 -0.60 120.40 125.06 1vkm s VAL 127 Ca 0.26 -0.32 -0.27 0.00 0.00 0.00 0.00 61.98 61.65 1vkm s VAL 127 Cb -0.13 -0.93 -0.09 0.00 0.00 0.00 0.00 36.38 35.22 1vkm s VAL 127 CO 0.20 0.33 1.45 -0.55 0.00 0.00 0.00 175.10 176.53 1vkm s SER 128 N 1.12 6.11 0.61 3.32 0.15 0.48 -4.89 113.70 120.59 1vkm s SER 128 Ca -0.07 2.97 0.30 0.00 0.70 0.00 0.00 55.95 59.85 1vkm s SER 128 Cb -0.14 -2.66 1.61 0.00 -1.71 0.00 0.00 66.02 63.12 1vkm s SER 128 CO -0.01 -1.02 1.99 1.56 1.20 0.00 0.00 173.24 176.95 1vkm h GLN 129 N 2.65 0.00 -0.96 5.44 4.20 -1.98 -2.49 115.11 121.98 1vkm h GLN 129 Ca -0.51 0.00 0.11 0.00 0.06 0.00 0.00 58.65 58.31 1vkm h GLN 129 Cb 1.25 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.96 1vkm h GLN 129 CO 0.63 0.00 0.61 -0.44 -0.67 0.00 0.00 178.83 178.96 1vkm h ASP 130 N 0.00 0.88 -0.25 1.46 5.19 -1.91 0.52 116.42 122.32 1vkm h ASP 130 Ca 0.11 0.03 -0.07 0.00 -0.62 0.00 0.00 57.03 56.48 1vkm h ASP 130 Cb 0.78 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 40.14 1vkm h ASP 130 CO -0.00 0.50 -0.12 -0.07 -3.12 0.00 0.00 179.24 176.43 1vkm h LEU 131 N 0.96 0.53 -0.78 1.55 3.38 -1.73 -2.96 115.31 116.26 1vkm h LEU 131 Ca 0.45 -0.41 0.06 0.00 0.09 0.00 0.00 57.88 58.07 1vkm h LEU 131 Cb 0.43 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 1vkm h LEU 131 CO -0.21 0.82 0.47 0.74 0.09 0.00 0.00 178.44 180.35 1vkm h THR 132 N 0.24 1.03 0.00 0.22 2.02 -1.56 -2.20 112.91 112.66 1vkm h THR 132 Ca 0.05 -0.30 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1vkm h THR 132 Cb 0.62 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1vkm h THR 132 CO 0.04 0.16 0.00 1.21 0.37 0.00 0.00 175.52 177.30 1vkm n GLU 133 N -4.67 0.32 0.00 6.66 4.07 0.13 -2.38 120.64 124.77 1vkm n GLU 133 Ca 0.10 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.20 1vkm n GLU 133 Cb 0.16 -1.28 0.00 0.00 -0.06 0.00 0.00 31.44 30.26 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 0.66 0.00 -0.00 4.31 2.88 -0.83 -0.87 113.62 119.77 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 -0.01 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 4.76 -3.96 -3.46 7.64 -1.00 -4.76 113.62 112.85 1vkm n SER 136 Ca 0.00 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.71 1vkm n SER 136 Cb 0.00 0.83 -0.15 0.00 -1.01 0.00 0.00 64.21 63.89 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 -2.53 0.78 -0.10 6.43 0.01 -0.05 -4.79 113.70 113.46 1vkm s SER 137 Ca -0.00 -0.12 -0.15 0.00 1.31 0.00 0.00 55.95 56.99 1vkm s SER 137 Cb 0.01 -0.15 -0.05 0.00 0.21 0.00 0.00 66.02 66.03 1vkm s SER 137 CO 0.04 0.05 0.37 -0.60 0.41 0.00 0.00 173.24 173.52 1vkm s ARG 138 N 0.07 4.16 0.05 12.44 3.52 -1.26 -2.02 118.95 135.91 1vkm s ARG 138 Ca -0.00 0.28 -0.28 0.00 -0.13 0.00 0.00 55.73 55.60 1vkm s ARG 138 Cb -0.05 -3.36 0.09 0.00 -1.56 0.00 0.00 34.95 30.07 1vkm s ARG 138 CO -0.00 0.36 1.05 0.00 -0.81 0.00 0.00 175.30 175.90 1vkm s ALA 139 N 0.04 -1.87 -0.27 6.12 0.00 -1.25 -4.84 121.76 119.69 1vkm s ALA 139 Ca 0.21 0.58 -0.09 0.00 0.00 0.00 0.00 51.96 52.66 1vkm s ALA 139 Cb -0.15 0.45 -0.03 0.00 0.00 0.00 0.00 23.12 23.40 1vkm s ALA 139 CO 0.08 -0.93 0.13 0.08 0.00 0.00 0.00 175.76 175.12 1vkm s VAL 140 N -2.95 4.77 -0.22 0.00 1.01 0.10 -1.03 120.40 122.08 1vkm s VAL 140 Ca 0.11 -0.09 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 1vkm s VAL 140 Cb 0.00 -3.29 -0.01 0.00 0.00 0.00 0.00 36.38 33.08 1vkm s VAL 140 CO -0.02 0.25 -0.02 -0.22 0.00 0.00 0.00 175.10 175.08 1vkm s LEU 141 N 1.67 3.00 -0.23 3.92 2.96 -0.01 -0.47 118.68 129.52 1vkm s LEU 141 Ca 0.06 -0.35 -0.17 0.00 -0.22 0.00 0.00 54.13 53.45 1vkm s LEU 141 Cb -0.16 -1.77 -0.03 0.00 0.50 0.00 0.00 46.19 44.73 1vkm s LEU 141 CO 0.07 -0.02 0.48 -0.69 -1.32 0.00 0.00 176.35 174.87 1vkm s VAL 142 N 1.47 5.12 0.12 1.68 1.01 0.02 -0.55 120.40 129.26 1vkm s VAL 142 Ca 0.06 0.84 -0.10 0.00 0.00 0.00 0.00 61.98 62.77 1vkm s VAL 142 Cb -0.14 -3.80 0.00 0.00 0.00 0.00 0.00 36.38 32.44 1vkm s VAL 142 CO -0.02 0.16 0.26 -0.94 0.00 0.00 0.00 175.10 174.56 1vkm s SER 143 N 1.31 0.02 -0.41 3.32 1.04 -0.75 -1.21 113.70 117.04 1vkm s SER 143 Ca 0.21 -0.64 -0.02 0.00 0.48 0.00 0.00 55.95 55.98 1vkm s SER 143 Cb -0.15 0.40 0.19 0.00 0.10 0.00 0.00 66.02 66.55 1vkm s SER 143 CO 0.09 -0.80 2.27 -1.20 0.98 0.00 0.00 173.24 174.58 1vkm n SER 144 N -0.14 6.62 0.00 7.02 7.64 0.12 -0.75 113.62 134.13 1vkm n SER 144 Ca -0.13 -3.20 0.00 0.00 1.01 0.00 0.00 58.87 56.55 1vkm n SER 144 Cb 0.63 -1.11 0.00 0.00 -1.01 0.00 0.00 64.21 62.72 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 0.38 0.40 3.51 0.23 0.00 -1.26 -0.26 105.19 108.20 1vkm n GLY 145 Ca 0.40 -0.94 -0.27 0.00 0.00 0.00 0.00 46.02 45.21 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 2.89 0.40 -0.61 -4.36 -1.25 -1.85 121.20 116.42 1vkm s ILE 146 Ca 0.00 -1.73 -0.27 0.00 -0.26 0.00 0.00 60.65 58.39 1vkm s ILE 146 Cb 0.00 -2.40 -0.10 0.00 1.25 0.00 0.00 42.46 41.21 1vkm s ILE 146 CO 0.00 -0.07 1.43 0.29 0.24 0.00 0.00 174.94 176.83 1vkm n LYS 147 N 0.26 2.41 0.19 0.37 5.02 -0.55 -3.54 118.16 122.32 1vkm n LYS 147 Ca -0.12 0.85 0.13 0.00 -2.02 0.00 0.00 58.31 57.15 1vkm n LYS 147 Cb 0.55 -2.59 0.68 0.00 -0.02 0.00 0.00 35.03 33.65 1vkm n LYS 147 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1vkm h SER 148 N 2.61 0.00 0.08 4.39 0.02 -1.92 -2.88 113.55 115.85 1vkm h SER 148 Ca -0.50 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.45 1vkm h SER 148 Cb 1.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.80 1vkm h SER 148 CO 0.62 0.00 -0.02 2.30 -1.14 0.00 0.00 176.83 178.59 1vkm n ILE 149 N -2.43 0.00 -2.60 3.27 -5.35 -1.26 -4.89 119.36 106.09 1vkm n ILE 149 Ca -0.01 -0.10 -0.23 0.00 -0.27 0.00 0.00 62.75 62.15 1vkm n ILE 149 Cb 0.09 -0.07 0.04 0.00 -1.74 0.00 0.00 39.64 37.96 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 -2.11 3.26 -0.68 7.28 1.43 -1.09 -4.55 118.68 122.21 1vkm s LEU 150 Ca 0.40 0.18 -0.27 0.00 -1.03 0.00 0.00 54.13 53.41 1vkm s LEU 150 Cb 0.21 -3.02 0.03 0.00 0.03 0.00 0.00 46.19 43.44 1vkm s LEU 150 CO 0.38 -1.14 1.31 -0.62 0.23 0.00 0.00 176.35 176.51 1vkm s ASP 151 N -4.39 6.17 0.04 2.29 -1.08 0.68 -4.72 116.67 115.65 1vkm s ASP 151 Ca 0.56 -0.23 -0.20 0.00 -0.52 0.00 0.00 52.55 52.16 1vkm s ASP 151 Cb -0.10 -2.56 -0.15 0.00 -1.46 0.00 0.00 42.92 38.65 1vkm s ASP 151 CO 0.40 -1.78 1.32 0.58 0.52 0.00 0.00 175.17 176.21 1vkm h VAL 152 N 6.13 1.36 -0.04 1.11 2.07 -1.94 -0.77 116.25 124.17 1vkm h VAL 152 Ca -0.27 -1.39 0.03 0.00 0.82 0.00 0.00 66.70 65.89 1vkm h VAL 152 Cb 1.06 1.93 -0.04 0.00 -1.52 0.00 0.00 31.29 32.72 1vkm h VAL 152 CO 1.25 0.41 -0.19 -0.08 0.02 0.00 0.00 177.57 178.98 1vkm h GLU 153 N -0.01 -0.28 -0.74 1.57 4.81 -1.97 0.72 114.58 118.69 1vkm h GLU 153 Ca 0.02 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1vkm h GLU 153 Cb 0.74 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 30.14 1vkm h GLU 153 CO 0.04 -0.19 0.48 0.00 -0.73 0.00 0.00 179.01 178.62 1vkm h ALA 154 N 0.65 0.95 -0.13 2.92 0.00 -1.91 -0.55 119.26 121.18 1vkm h ALA 154 Ca 0.07 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1vkm h ALA 154 Cb 0.39 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1vkm h ALA 154 CO -0.21 0.32 -0.06 1.15 0.00 0.00 0.00 179.25 180.45 1vkm h THR 155 N 0.97 1.32 -0.65 0.00 2.02 -0.82 -3.13 112.91 112.61 1vkm h THR 155 Ca 0.28 -1.10 0.01 0.00 0.77 0.00 0.00 66.41 66.37 1vkm h THR 155 Cb -0.07 1.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.08 1vkm h THR 155 CO -0.08 0.32 0.42 0.15 0.37 0.00 0.00 175.52 176.70 1vkm h PHE 156 N -0.07 0.82 0.00 3.16 3.57 -0.71 -0.63 116.94 123.08 1vkm h PHE 156 Ca 0.03 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.55 1vkm h PHE 156 Cb 0.53 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.99 1vkm h PHE 156 CO 0.07 0.52 0.00 0.39 -2.23 0.00 0.00 178.31 177.06 1vkm n GLU 157 N -4.63 0.07 0.00 1.11 -0.58 -0.23 -3.05 120.64 113.33 1vkm n GLU 157 Ca 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 1vkm n GLU 157 Cb 0.02 -1.30 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 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 0.77 0.00 0.17 -4.62 4.77 -0.24 -1.80 117.00 116.04 1vkm n LEU 159 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 1vkm n LEU 159 Cb 0.03 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.04 1vkm n LEU 159 CO 0.00 0.00 0.73 -0.08 -1.33 0.00 0.00 177.39 176.71 1vkm h GLU 160 N 0.00 -0.35 -0.73 3.23 4.81 -1.79 -0.91 114.58 118.83 1vkm h GLU 160 Ca 0.00 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.36 1vkm h GLU 160 Cb 0.00 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.38 1vkm h GLU 160 CO 0.00 -0.18 0.35 1.15 -0.73 0.00 0.00 179.01 179.60 1vkm h THR 161 N -0.45 0.81 0.00 0.32 2.02 -1.67 0.40 112.91 114.34 1vkm h THR 161 Ca -0.04 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1vkm h THR 161 Cb 0.34 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.93 1vkm h THR 161 CO 0.06 0.11 0.00 0.18 0.37 0.00 0.00 175.52 176.24 1vkm n LEU 162 N -4.88 0.00 -2.42 2.58 4.77 -1.22 -4.88 117.00 110.94 1vkm n LEU 162 Ca 0.12 0.00 -0.16 0.00 -0.03 0.00 0.00 56.01 55.94 1vkm n LEU 162 Cb 0.31 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.44 1vkm n LEU 162 CO 0.23 0.00 0.09 -0.62 -1.33 0.00 0.00 177.39 175.76 1vkm n GLU 163 N -0.91 -4.53 -3.21 3.23 1.02 0.13 -4.74 120.64 111.63 1vkm n GLU 163 Ca 0.17 0.61 -0.43 0.00 -0.02 0.00 0.00 57.16 57.49 1vkm n GLU 163 Cb 0.08 -4.89 -0.08 0.00 -0.02 0.00 0.00 31.44 26.53 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 -3.11 4.95 0.19 -3.67 1.01 -0.36 -4.91 121.20 115.29 1vkm s ILE 164 Ca 0.31 -0.11 -0.30 0.00 0.00 0.00 0.00 60.65 60.55 1vkm s ILE 164 Cb -0.14 -4.13 -0.08 0.00 0.01 0.00 0.00 42.46 38.12 1vkm s ILE 164 CO 0.39 -0.52 1.19 -2.16 0.00 0.00 0.00 174.94 173.84 1vkm s PRO 165 N 2.50 4.50 -0.04 2.79 0.04 -1.25 -4.61 135.00 138.92 1vkm s PRO 165 Ca 0.18 1.87 0.06 0.00 0.04 0.00 0.00 61.00 63.14 1vkm s PRO 165 Cb -0.15 -3.24 -0.01 0.00 0.04 0.00 0.00 34.50 31.14 1vkm s PRO 165 CO 0.16 -0.08 -0.22 -0.51 0.04 0.00 0.00 177.00 176.40 1vkm s LEU 166 N -0.27 2.02 -0.01 -3.56 1.43 -1.26 -4.45 118.68 112.58 1vkm s LEU 166 Ca 0.52 -0.44 0.02 0.00 -1.03 0.00 0.00 54.13 53.20 1vkm s LEU 166 Cb -0.32 -1.20 -0.00 0.00 0.03 0.00 0.00 46.19 44.69 1vkm s LEU 166 CO 0.37 0.23 -0.06 0.68 0.23 0.00 0.00 176.35 177.79 1vkm s VAL 167 N -0.19 0.47 -0.19 -1.59 -7.23 -1.26 -4.44 120.40 105.97 1vkm s VAL 167 Ca -0.01 -0.25 -0.26 0.00 -1.81 0.00 0.00 61.98 59.65 1vkm s VAL 167 Cb -0.12 -0.40 -0.01 0.00 0.56 0.00 0.00 36.38 36.41 1vkm s VAL 167 CO 0.02 0.14 0.86 -0.83 -0.31 0.00 0.00 175.10 174.98 1vkm s GLY 168 N -0.11 2.01 -0.64 2.32 0.00 0.61 -0.64 107.32 110.88 1vkm s GLY 168 Ca 0.02 0.04 -0.27 0.00 0.00 0.00 0.00 44.72 44.51 1vkm s GLY 168 CO -0.00 1.76 1.57 -0.12 0.00 0.00 0.00 173.10 176.31 1vkm s PHE 169 N 2.37 2.00 -1.49 1.90 5.36 0.32 -0.71 117.98 127.73 1vkm s PHE 169 Ca 0.39 0.43 -0.05 0.00 -0.96 0.00 0.00 56.93 56.74 1vkm s PHE 169 Cb -0.16 -4.34 0.02 0.00 -0.34 0.00 0.00 43.02 38.20 1vkm s PHE 169 CO 0.11 -2.18 0.47 0.54 -1.46 0.00 0.00 175.22 172.70 1vkm n ARG 170 N 9.12 -4.03 -3.60 10.12 1.74 0.32 -4.81 116.66 125.52 1vkm n ARG 170 Ca 0.13 0.81 -0.15 0.00 -0.77 0.00 0.00 57.85 57.87 1vkm n ARG 170 Cb 0.50 -5.60 -0.06 0.00 -1.02 0.00 0.00 32.46 26.28 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 -3.07 0.03 -1.50 0.55 -1.32 -1.24 -5.02 115.64 104.06 1vkm s THR 171 Ca 0.27 -0.22 0.16 0.00 -1.21 0.00 0.00 61.69 60.69 1vkm s THR 171 Cb -0.13 -0.91 0.40 0.00 -1.51 0.00 0.00 72.50 70.35 1vkm s THR 171 CO 0.33 -0.12 1.31 0.59 -2.21 0.00 0.00 174.62 174.52 1vkm n ASN 172 N 0.73 3.19 -4.43 8.08 4.13 -1.26 -3.96 115.26 121.74 1vkm n ASN 172 Ca -0.19 -1.94 -0.35 0.00 1.68 0.00 0.00 54.58 53.78 1vkm n ASN 172 Cb 0.58 -0.28 -0.13 0.00 -1.54 0.00 0.00 39.78 38.41 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 -1.07 3.58 -0.05 3.52 2.02 -1.26 -1.33 118.70 124.11 1vkm s GLU 173 Ca 0.32 -0.54 -0.29 0.00 0.02 0.00 0.00 54.97 54.47 1vkm s GLU 173 Cb 0.17 -3.03 -0.07 0.00 0.10 0.00 0.00 34.13 31.30 1vkm s GLU 173 CO 0.23 0.02 1.90 0.12 0.02 0.00 0.00 175.26 177.55 1vkm s PHE 174 N 0.96 1.50 0.62 1.61 5.36 -0.35 -4.88 117.98 122.79 1vkm s PHE 174 Ca 0.01 -0.05 -0.12 0.00 -0.96 0.00 0.00 56.93 55.81 1vkm s PHE 174 Cb -0.14 -4.10 -0.03 0.00 -0.34 0.00 0.00 43.02 38.40 1vkm s PHE 174 CO 0.01 -4.69 1.03 -1.25 -1.46 0.00 0.00 175.22 168.87 1vkm s PRO 175 N 4.70 3.48 -0.49 10.12 0.04 -1.26 -3.58 135.00 148.02 1vkm s PRO 175 Ca 0.85 0.85 0.08 0.00 0.04 0.00 0.00 61.00 62.82 1vkm s PRO 175 Cb -0.37 -2.06 0.33 0.00 0.04 0.00 0.00 34.50 32.43 1vkm s PRO 175 CO 0.37 -0.66 0.80 -0.11 0.04 0.00 0.00 177.00 177.44 1vkm n LEU 176 N -2.65 2.61 0.00 -3.56 7.94 -0.46 -3.84 117.00 117.04 1vkm n LEU 176 Ca 0.07 -5.31 0.00 0.00 -1.11 0.00 0.00 56.01 49.66 1vkm n LEU 176 Cb 0.54 0.03 0.00 0.00 0.53 0.00 0.00 43.42 44.52 1vkm n LEU 176 CO 0.55 2.27 0.00 0.33 -1.11 0.00 0.00 177.39 179.44 1vkm n PHE 177 N 0.23 0.00 0.29 1.96 7.35 0.64 -0.95 117.46 126.98 1vkm n PHE 177 Ca 0.28 0.00 0.15 0.00 -0.76 0.00 0.00 57.45 57.12 1vkm n PHE 177 Cb 0.51 0.00 0.86 0.00 0.35 0.00 0.00 39.48 41.20 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 -3.80 -5.13 0.04 -1.89 -3.39 116.94 102.77 1vkm h PHE 178 Ca 0.00 0.00 -0.68 0.00 2.80 0.00 0.00 57.97 60.09 1vkm h PHE 178 Cb 0.00 0.00 -0.20 0.00 2.20 0.00 0.00 35.95 37.95 1vkm h PHE 178 CO 0.00 0.05 -0.75 -1.12 -0.60 0.00 0.00 178.31 175.89 1vkm s SER 179 N -6.06 4.21 0.05 2.17 0.01 -0.13 -0.76 113.70 113.19 1vkm s SER 179 Ca -0.04 -0.27 -0.06 0.00 1.31 0.00 0.00 55.95 56.88 1vkm s SER 179 Cb 0.14 -0.85 -0.30 0.00 0.21 0.00 0.00 66.02 65.22 1vkm s SER 179 CO 0.55 0.27 1.04 0.03 0.41 0.00 0.00 173.24 175.55 1vkm h ARG 180 N 4.58 0.32 -5.62 12.44 3.08 -1.85 -1.21 114.38 126.12 1vkm h ARG 180 Ca -0.48 -0.54 -0.65 0.00 0.07 0.00 0.00 59.98 58.38 1vkm h ARG 180 Cb 1.16 0.20 -0.13 0.00 0.08 0.00 0.00 29.97 31.28 1vkm h ARG 180 CO 0.51 1.24 -0.56 0.15 -1.07 0.00 0.00 179.97 180.23 1vkm s LYS 181 N -2.64 3.49 0.00 0.04 1.02 -1.26 -4.28 119.74 116.11 1vkm s LYS 181 Ca -0.06 -0.32 0.00 0.00 0.02 0.00 0.00 55.97 55.61 1vkm s LYS 181 Cb 0.06 -3.05 0.00 0.00 -0.52 0.00 0.00 37.83 34.32 1vkm s LYS 181 CO 0.89 0.55 0.00 -1.13 -0.92 0.00 0.00 175.35 174.74 1vkm n SER 182 N 2.65 2.38 -1.05 2.83 3.41 -1.23 -4.65 113.62 117.96 1vkm n SER 182 Ca -0.18 -0.20 -0.13 0.00 -0.26 0.00 0.00 58.87 58.10 1vkm n SER 182 Cb 0.53 0.87 -0.05 0.00 -0.26 0.00 0.00 64.21 65.30 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 1.58 1.23 3.19 5.00 0.00 -1.26 -5.02 105.19 109.91 1vkm n GLY 183 Ca 0.00 -0.41 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 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 -3.26 2.91 0.09 1.61 0.52 -1.26 -5.06 118.95 114.50 1vkm s ARG 184 Ca 0.00 -0.83 -0.21 0.00 -0.52 0.00 0.00 55.73 54.17 1vkm s ARG 184 Cb 0.00 -2.23 -0.07 0.00 0.52 0.00 0.00 34.95 33.18 1vkm s ARG 184 CO 0.00 0.14 0.62 0.50 0.02 0.00 0.00 175.30 176.59 1vkm s ARG 185 N 0.43 4.30 0.20 3.54 3.52 -1.26 -1.21 118.95 128.46 1vkm s ARG 185 Ca -0.17 0.84 0.08 0.00 -0.13 0.00 0.00 55.73 56.35 1vkm s ARG 185 Cb -0.18 -3.25 -0.05 0.00 -1.56 0.00 0.00 34.95 29.92 1vkm s ARG 185 CO 0.07 0.61 -0.16 0.14 -0.81 0.00 0.00 175.30 175.15 1vkm s VAL 186 N -1.06 1.81 0.46 7.11 -7.23 -0.44 -4.82 120.40 116.23 1vkm s VAL 186 Ca 0.31 -2.16 -0.24 0.00 -1.81 0.00 0.00 61.98 58.08 1vkm s VAL 186 Cb -0.20 -2.01 -0.07 0.00 0.56 0.00 0.00 36.38 34.65 1vkm s VAL 186 CO 0.21 -0.52 1.29 -2.16 -0.31 0.00 0.00 175.10 173.61 1vkm s PRO 187 N -3.43 3.66 -0.08 4.82 0.04 -1.26 -4.42 135.00 134.33 1vkm s PRO 187 Ca 0.21 2.09 -0.03 0.00 0.04 0.00 0.00 61.00 63.32 1vkm s PRO 187 Cb -0.02 -2.51 -0.04 0.00 0.04 0.00 0.00 34.50 31.97 1vkm s PRO 187 CO 0.07 -0.72 0.04 0.50 0.04 0.00 0.00 177.00 176.93 1vkm s ARG 188 N -2.57 3.07 0.33 4.56 3.52 -1.26 -0.28 118.95 126.32 1vkm s ARG 188 Ca 0.63 -0.37 0.10 0.00 -0.13 0.00 0.00 55.73 55.96 1vkm s ARG 188 Cb -0.36 -2.87 -0.06 0.00 -1.56 0.00 0.00 34.95 30.09 1vkm s ARG 188 CO 0.45 0.71 -0.12 0.96 -0.81 0.00 0.00 175.30 176.49 1vkm s ILE 189 N -0.96 2.25 -0.04 4.11 -5.25 0.11 -4.89 121.20 116.54 1vkm s ILE 189 Ca 0.15 -2.24 0.16 0.00 -0.99 0.00 0.00 60.65 57.73 1vkm s ILE 189 Cb -0.12 -2.55 -0.25 0.00 2.95 0.00 0.00 42.46 42.49 1vkm s ILE 189 CO 0.04 -0.25 0.33 -0.62 -1.79 0.00 0.00 174.94 172.65 1vkm n GLU 190 N -0.74 0.61 -3.74 0.37 -0.58 -1.26 -0.52 120.64 114.78 1vkm n GLU 190 Ca -0.05 -0.14 -0.08 0.00 -0.42 0.00 0.00 57.16 56.47 1vkm n GLU 190 Cb 0.63 -1.39 -0.02 0.00 -0.57 0.00 0.00 31.44 30.08 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 -4.02 -0.34 0.41 1.62 2.20 -1.26 -4.77 114.94 108.78 1vkm s ASN 191 Ca -0.06 -0.44 0.17 0.00 -0.94 0.00 0.00 52.86 51.59 1vkm s ASN 191 Cb 0.10 0.68 0.87 0.00 -2.00 0.00 0.00 41.25 40.90 1vkm s ASN 191 CO 0.68 -1.22 1.86 -0.37 -2.94 0.00 0.00 177.10 175.11 1vkm h VAL 192 N 2.00 1.04 -0.96 3.54 -1.51 -1.97 -2.49 116.25 115.91 1vkm h VAL 192 Ca -0.23 -1.15 0.07 0.00 -1.23 0.00 0.00 66.70 64.16 1vkm h VAL 192 Cb 1.26 1.66 -0.07 0.00 -2.13 0.00 0.00 31.29 32.01 1vkm h VAL 192 CO 0.27 0.31 0.62 -0.33 -1.23 0.00 0.00 177.57 177.21 1vkm h GLU 193 N 0.00 1.05 -0.53 5.19 3.07 -1.97 -0.76 114.58 120.62 1vkm h GLU 193 Ca -0.00 -0.06 -0.08 0.00 -0.50 0.00 0.00 59.36 58.71 1vkm h GLU 193 Cb 0.63 -0.24 -0.02 0.00 -0.84 0.00 0.00 28.75 28.28 1vkm h GLU 193 CO 0.04 0.69 0.02 0.93 -1.40 0.00 0.00 179.01 179.29 1vkm h GLU 194 N 1.08 0.93 -0.64 2.33 5.08 -1.87 -1.60 114.58 119.89 1vkm h GLU 194 Ca 0.42 -0.29 0.07 0.00 -1.00 0.00 0.00 59.36 58.57 1vkm h GLU 194 Cb 0.23 -0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.33 1vkm h GLU 194 CO -0.17 0.94 0.31 0.28 -1.00 0.00 0.00 179.01 179.37 1vkm h VAL 195 N 0.80 0.88 -0.03 3.13 2.07 -1.21 -2.48 116.25 119.41 1vkm h VAL 195 Ca 0.15 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.36 1vkm h VAL 195 Cb 0.51 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1vkm h VAL 195 CO 0.02 0.10 -0.54 -0.07 0.02 0.00 0.00 177.57 177.11 1vkm h LEU 196 N 0.56 0.09 -0.52 2.57 3.38 -0.77 -1.24 115.31 119.38 1vkm h LEU 196 Ca 0.30 -0.04 -0.14 0.00 0.09 0.00 0.00 57.88 58.09 1vkm h LEU 196 Cb 0.28 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1vkm h LEU 196 CO -0.23 0.61 -0.27 0.50 0.09 0.00 0.00 178.44 179.13 1vkm h LYS 197 N 0.06 0.91 -0.00 1.13 3.64 -1.08 -0.82 116.57 120.41 1vkm h LYS 197 Ca -0.00 -0.41 -0.00 0.00 -1.27 0.00 0.00 60.65 58.96 1vkm h LYS 197 Cb 0.97 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.77 1vkm h LYS 197 CO 0.07 1.07 0.00 0.82 -2.27 0.00 0.00 179.45 179.14 1vkm h ILE 198 N 0.78 1.05 -0.65 2.00 2.04 -1.30 -1.95 117.51 119.47 1vkm h ILE 198 Ca 0.09 -0.13 -0.07 0.00 1.00 0.00 0.00 64.86 65.75 1vkm h ILE 198 Cb 0.84 1.13 -0.03 0.00 -0.74 0.00 0.00 36.82 38.03 1vkm h ILE 198 CO 0.07 0.04 0.13 0.22 0.00 0.00 0.00 178.15 178.60 1vkm h TYR 199 N -0.05 1.12 -0.58 1.37 3.20 -1.14 -2.79 116.97 118.10 1vkm h TYR 199 Ca 0.00 -0.15 -0.06 0.00 3.14 0.00 0.00 58.73 61.66 1vkm h TYR 199 Cb 0.06 -0.31 -0.03 0.00 1.54 0.00 0.00 36.73 37.99 1vkm h TYR 199 CO -0.06 0.94 0.10 0.93 -1.64 0.00 0.00 178.16 178.43 1vkm h GLU 200 N 0.98 0.92 -1.65 1.82 4.39 -1.19 -2.45 114.58 117.40 1vkm h GLU 200 Ca 0.20 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1vkm h GLU 200 Cb 0.41 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 1vkm h GLU 200 CO 0.01 0.85 0.00 0.43 -1.16 0.00 0.00 179.01 179.14 1vkm n SER 201 N -4.24 0.17 0.00 1.42 7.64 -0.74 -1.84 113.62 116.04 1vkm n SER 201 Ca 0.04 -0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.79 1vkm n SER 201 Cb 0.26 -0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 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 0.89 0.00 0.00 1.43 5.02 -0.92 -4.67 118.16 119.91 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 0.03 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.04 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 0.30 -2.69 1.97 1.02 -0.77 -4.62 120.64 115.85 1vkm n GLU 204 Ca 0.00 0.00 -0.06 0.00 -0.02 0.00 0.00 57.16 57.08 1vkm n GLU 204 Cb 0.00 -1.34 0.12 0.00 -0.02 0.00 0.00 31.44 30.20 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 0.82 1.25 -3.21 3.49 4.71 -1.26 -5.23 120.64 121.21 1vkm n GLU 206 Ca 0.00 -1.70 -0.44 0.00 -0.01 0.00 0.00 57.16 55.01 1vkm n GLU 206 Cb 0.14 0.05 -0.06 0.00 -1.01 0.00 0.00 31.44 30.56 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 -3.45 5.13 -1.07 -4.62 2.96 -1.26 -4.99 118.68 111.37 1vkm s LEU 207 Ca 0.19 -1.02 -0.12 0.00 -0.22 0.00 0.00 54.13 52.95 1vkm s LEU 207 Cb 0.41 -2.38 0.23 0.00 0.50 0.00 0.00 46.19 44.95 1vkm s LEU 207 CO -0.10 -0.84 1.13 -0.70 -1.32 0.00 0.00 176.35 174.52 1vkm s GLU 208 N 2.40 4.02 0.02 1.98 2.56 -1.26 -4.65 118.70 123.78 1vkm s GLU 208 Ca 0.12 -2.81 -0.10 0.00 0.00 0.00 0.00 54.97 52.18 1vkm s GLU 208 Cb -0.21 -4.69 0.01 0.00 2.00 0.00 0.00 34.13 31.24 1vkm s GLU 208 CO 0.10 -1.42 0.21 0.15 -0.56 0.00 0.00 175.26 173.74 1vkm s LYS 209 N -0.00 0.66 0.06 4.30 -0.14 -1.26 -3.75 119.74 119.60 1vkm s LYS 209 Ca 0.32 -0.51 -0.30 0.00 -1.36 0.00 0.00 55.97 54.12 1vkm s LYS 209 Cb -0.08 0.28 -0.05 0.00 -1.68 0.00 0.00 37.83 36.30 1vkm s LYS 209 CO -0.06 -0.19 0.99 0.99 -0.76 0.00 0.00 175.35 176.32 1vkm s THR 210 N -2.14 4.63 0.00 2.17 2.01 -0.85 -3.81 115.64 117.65 1vkm s THR 210 Ca -0.08 2.02 0.00 0.00 0.31 0.00 0.00 61.69 63.94 1vkm s THR 210 Cb -0.03 -4.29 0.00 0.00 0.01 0.00 0.00 72.50 68.19 1vkm s THR 210 CO -0.01 0.23 0.00 -0.11 -0.69 0.00 0.00 174.62 174.04 1vkm n LEU 211 N 3.35 0.00 -3.19 4.42 7.94 -0.20 -3.91 117.00 125.42 1vkm n LEU 211 Ca 0.04 0.00 0.05 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 -0.23 0.72 -0.69 -1.11 0.00 0.00 177.39 176.60 1vkm s VAL 213 N 0.34 -0.22 -0.26 1.96 1.01 0.29 -0.83 120.40 122.69 1vkm s VAL 213 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 61.98 61.85 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 0.29 -0.76 0.00 0.00 0.00 175.10 174.63 1vkm s LEU 214 N 2.69 4.05 -0.26 3.92 1.43 0.19 -1.80 118.68 128.89 1vkm s LEU 214 Ca -0.03 0.19 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 1vkm s LEU 214 Cb -0.07 -2.30 0.07 0.00 0.03 0.00 0.00 46.19 43.92 1vkm s LEU 214 CO -0.12 -0.11 -0.01 0.21 0.23 0.00 0.00 176.35 176.55 1vkm s ASN 215 N 1.57 4.00 0.66 2.29 2.47 0.07 -0.52 114.94 125.48 1vkm s ASN 215 Ca 0.12 -1.39 -0.17 0.00 0.42 0.00 0.00 52.86 51.84 1vkm s ASN 215 Cb -0.16 -1.19 -0.00 0.00 -1.45 0.00 0.00 41.25 38.45 1vkm s ASN 215 CO 0.10 -0.29 1.20 -2.16 -3.72 0.00 0.00 177.10 172.23 1vkm s PRO 216 N 1.36 2.61 0.43 0.43 0.04 -1.26 -3.92 135.00 134.69 1vkm s PRO 216 Ca -0.01 1.75 -0.26 0.00 0.04 0.00 0.00 61.00 62.52 1vkm s PRO 216 Cb -0.19 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.37 1vkm s PRO 216 CO -0.09 -1.47 1.40 1.55 0.04 0.00 0.00 177.00 178.43 1vkm n VAL 217 N -2.15 2.59 -1.69 -0.36 3.14 -1.26 -4.95 118.33 113.64 1vkm n VAL 217 Ca 0.13 -0.50 -0.40 0.00 -2.96 0.00 0.00 64.34 60.61 1vkm n VAL 217 Cb 0.50 -1.80 0.03 0.00 -1.06 0.00 0.00 33.84 31.51 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 -0.01 1.65 -0.24 1.45 -0.02 -1.26 -4.80 135.00 131.77 1vkm n PRO 218 Ca 0.05 0.60 0.09 0.00 -2.02 0.00 0.00 63.50 62.21 1vkm n PRO 218 Cb 0.40 -2.38 0.35 0.00 -0.02 0.00 0.00 33.50 31.85 1vkm n PRO 218 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 1vkm h GLU 219 N 1.59 0.74 -0.53 -0.52 5.08 -1.98 -1.98 114.58 116.98 1vkm h GLU 219 Ca -0.49 -0.04 0.16 0.00 -1.00 0.00 0.00 59.36 57.99 1vkm h GLU 219 Cb 1.31 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 1vkm h GLU 219 CO 0.57 0.49 0.41 1.49 -1.00 0.00 0.00 179.01 180.97 1vkm h GLU 220 N 0.76 0.00 -0.00 2.33 4.81 -2.03 -2.87 114.58 117.58 1vkm h GLU 220 Ca 0.39 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.62 1vkm h GLU 220 Cb 0.47 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1vkm h GLU 220 CO -0.16 0.00 -0.24 0.66 -0.73 0.00 0.00 179.01 178.55 1vkm n TYR 221 N -4.23 0.00 -1.32 0.92 4.01 -0.76 -5.05 117.16 110.73 1vkm n TYR 221 Ca 0.10 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.53 1vkm n TYR 221 Cb 0.63 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.75 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 -1.39 2.32 -0.08 -0.72 4.04 -1.09 -4.43 118.70 117.36 1vkm s GLU 222 Ca 0.06 1.20 0.01 0.00 0.04 0.00 0.00 54.97 56.27 1vkm s GLU 222 Cb 0.07 -1.90 0.02 0.00 0.02 0.00 0.00 34.13 32.33 1vkm s GLU 222 CO 0.25 -1.60 -0.09 0.42 -1.84 0.00 0.00 175.26 172.40 1vkm s ILE 223 N -2.84 0.97 0.35 1.83 1.01 0.06 -5.00 121.20 117.59 1vkm s ILE 223 Ca 0.62 -0.32 -0.28 0.00 0.00 0.00 0.00 60.65 60.67 1vkm s ILE 223 Cb -0.18 -0.95 -0.12 0.00 0.01 0.00 0.00 42.46 41.23 1vkm s ILE 223 CO 0.54 0.34 1.38 -2.65 0.00 0.00 0.00 174.94 174.55 1vkm n PRO 224 N 4.40 2.37 0.24 2.79 -0.02 -1.26 -3.55 135.00 139.96 1vkm n PRO 224 Ca -0.18 0.83 0.07 0.00 -2.02 0.00 0.00 63.50 62.20 1vkm n PRO 224 Cb 0.51 -2.48 0.57 0.00 -0.02 0.00 0.00 33.50 32.07 1vkm n PRO 224 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1vkm h HIS 225 N 2.80 0.00 -0.12 6.00 2.76 -1.93 -2.42 115.15 122.24 1vkm h HIS 225 Ca -0.48 0.00 -0.07 0.00 -2.20 0.00 0.00 60.37 57.62 1vkm h HIS 225 Cb 1.26 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.21 1vkm h HIS 225 CO 0.52 0.15 -0.23 0.38 -1.30 0.00 0.00 177.93 177.44 1vkm h ASP 226 N 0.00 0.20 -0.29 3.26 2.03 -1.94 0.65 116.42 120.32 1vkm h ASP 226 Ca -0.00 -0.05 -0.10 0.00 -0.73 0.00 0.00 57.03 56.15 1vkm h ASP 226 Cb 0.28 -0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 38.72 1vkm h ASP 226 CO 0.02 0.44 -0.20 -0.33 -1.03 0.00 0.00 179.24 178.15 1vkm h GLU 227 N 0.19 0.65 -0.29 4.15 5.08 -1.80 -2.12 114.58 120.43 1vkm h GLU 227 Ca 0.03 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1vkm h GLU 227 Cb 0.52 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1vkm h GLU 227 CO 0.04 0.90 0.16 0.82 -1.00 0.00 0.00 179.01 179.93 1vkm h ILE 228 N 0.39 1.11 -0.98 3.13 2.04 -1.33 -1.06 117.51 120.81 1vkm h ILE 228 Ca 0.06 -0.29 0.09 0.00 1.00 0.00 0.00 64.86 65.72 1vkm h ILE 228 Cb 0.74 0.79 -0.07 0.00 -0.74 0.00 0.00 36.82 37.54 1vkm h ILE 228 CO 0.05 0.11 0.62 -0.33 0.00 0.00 0.00 178.15 178.61 1vkm h GLU 229 N 0.35 1.04 -0.22 2.37 5.08 -0.88 0.79 114.58 123.11 1vkm h GLU 229 Ca 0.10 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1vkm h GLU 229 Cb 0.04 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 1vkm h GLU 229 CO -0.02 0.69 0.14 -0.09 -1.00 0.00 0.00 179.01 178.73 1vkm h ARG 230 N 1.07 0.29 -0.34 2.33 2.43 -0.87 -1.28 114.38 118.02 1vkm h ARG 230 Ca 0.45 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.58 1vkm h ARG 230 Cb 0.30 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 1vkm h ARG 230 CO -0.21 0.21 0.15 -0.07 -1.51 0.00 0.00 179.97 178.53 1vkm h LEU 231 N 0.29 0.46 -1.77 3.80 3.38 -0.44 -2.97 115.31 118.06 1vkm h LEU 231 Ca 0.08 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1vkm h LEU 231 Cb -0.02 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1vkm h LEU 231 CO -0.02 0.48 0.03 -0.07 0.09 0.00 0.00 178.44 178.95 1vkm h LEU 232 N 0.40 0.15 -1.91 1.67 3.38 -0.60 -1.79 115.31 116.61 1vkm h LEU 232 Ca 0.11 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1vkm h LEU 232 Cb 0.16 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 1vkm h LEU 232 CO -0.01 0.16 -0.08 -0.08 0.09 0.00 0.00 178.44 178.52 1vkm h GLU 233 N 0.17 0.00 0.00 1.13 4.57 -1.07 -2.24 114.58 117.15 1vkm h GLU 233 Ca 0.04 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.22 1vkm h GLU 233 Cb 0.07 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.66 1vkm h GLU 233 CO -0.00 0.08 0.00 1.63 -1.18 0.00 0.00 179.01 179.54 1vkm n LYS 234 N -4.29 0.24 -3.57 1.92 5.02 -0.67 -4.85 118.16 111.95 1vkm n LYS 234 Ca -0.03 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.89 1vkm n LYS 234 Cb 0.16 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.57 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 -2.76 5.30 0.15 -0.18 1.01 -0.85 -5.06 121.20 118.82 1vkm s ILE 235 Ca 0.22 0.26 -0.30 0.00 0.00 0.00 0.00 60.65 60.83 1vkm s ILE 235 Cb 0.20 -3.55 -0.07 0.00 0.01 0.00 0.00 42.46 39.04 1vkm s ILE 235 CO 0.49 0.27 1.19 -0.70 0.00 0.00 0.00 174.94 176.19 1vkm s GLU 236 N 1.53 4.49 -0.44 2.79 2.56 -1.26 -4.97 118.70 123.39 1vkm s GLU 236 Ca 0.09 1.83 -0.24 0.00 0.00 0.00 0.00 54.97 56.65 1vkm s GLU 236 Cb -0.15 -3.27 0.02 0.00 2.00 0.00 0.00 34.13 32.73 1vkm s GLU 236 CO 0.08 -0.12 0.85 -1.17 -0.56 0.00 0.00 175.26 174.34 1vkm s LEU 237 N 0.13 4.13 0.00 2.70 2.96 -1.26 -4.88 118.68 122.46 1vkm s LEU 237 Ca 0.54 0.06 0.27 0.00 -0.22 0.00 0.00 54.13 54.78 1vkm s LEU 237 Cb -0.31 -3.07 0.79 0.00 0.50 0.00 0.00 46.19 44.10 1vkm s LEU 237 CO 0.34 -0.95 1.60 -0.62 -1.32 0.00 0.00 176.35 175.41 1vkm n GLU 238 N 6.86 0.36 -4.34 1.98 1.02 -1.26 -4.97 120.64 120.30 1vkm n GLU 238 Ca 0.04 -0.18 -0.18 0.00 -0.02 0.00 0.00 57.16 56.82 1vkm n GLU 238 Cb 0.48 -1.50 -0.09 0.00 -0.02 0.00 0.00 31.44 30.31 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 -2.76 0.41 0.20 2.62 -7.23 -1.26 -5.16 120.40 107.21 1vkm s VAL 239 Ca 0.18 -2.00 -0.05 0.00 -1.81 0.00 0.00 61.98 58.30 1vkm s VAL 239 Cb 0.19 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.56 1vkm s VAL 239 CO 0.59 0.00 0.23 -1.83 -0.31 0.00 0.00 175.10 173.78 1vkm s GLU 240 N -3.87 1.26 4.90 4.82 -1.05 -1.26 -4.79 118.70 118.71 1vkm s GLU 240 Ca 0.36 -1.46 0.00 0.00 -0.15 0.00 0.00 54.97 53.71 1vkm s GLU 240 Cb 0.06 0.33 0.00 0.00 -0.44 0.00 0.00 34.13 34.08 1vkm s GLU 240 CO 0.16 -0.45 0.00 0.41 0.95 0.00 0.00 175.26 176.34 1vkm n GLY 241 N -0.28 1.78 0.32 -3.83 0.00 -1.26 -3.33 105.19 98.59 1vkm n GLY 241 Ca -0.01 -0.58 0.21 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.99 -2.39 116.57 115.37 1vkm h LYS 242 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 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 0.00 0.00 0.93 -0.57 0.00 0.00 179.45 179.81 1vkm h GLU 243 N 0.00 0.00 0.02 3.15 3.07 -1.96 -3.35 114.58 115.51 1vkm h GLU 243 Ca -0.00 0.00 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1vkm h GLU 243 Cb 0.19 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.08 1vkm h GLU 243 CO 0.00 0.00 -0.09 0.28 -1.40 0.00 0.00 179.01 177.80 1vkm h VAL 244 N 0.00 0.77 0.93 3.13 2.07 -1.59 -1.83 116.25 119.74 1vkm h VAL 244 Ca 0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 1vkm h VAL 244 Cb 0.54 0.77 0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1vkm h VAL 244 CO 0.00 0.00 -0.45 0.74 0.02 0.00 0.00 177.57 177.88 1vkm h THR 245 N -0.17 0.00 -0.95 2.57 2.02 -1.82 -1.91 112.91 112.66 1vkm h THR 245 Ca 0.03 -0.05 0.11 0.00 0.77 0.00 0.00 66.41 67.26 1vkm h THR 245 Cb 0.20 0.00 -0.07 0.00 -1.74 0.00 0.00 68.15 66.54 1vkm h THR 245 CO -0.08 0.00 0.61 -0.65 0.37 0.00 0.00 175.52 175.77 1vkm h PRO 246 N -1.30 0.90 -0.35 6.66 0.10 -1.78 -1.16 132.00 135.07 1vkm h PRO 246 Ca -0.13 -0.05 0.03 0.00 0.10 0.00 0.00 66.00 65.95 1vkm h PRO 246 Cb 0.96 -0.20 -0.03 0.00 0.10 0.00 0.00 31.00 31.82 1vkm h PRO 246 CO 0.21 0.60 0.16 0.35 0.10 0.00 0.00 178.00 179.42 1vkm h PHE 247 N 0.93 0.30 -0.07 0.65 3.57 -1.21 -1.11 116.94 120.00 1vkm h PHE 247 Ca 0.45 0.01 -0.22 0.00 3.53 0.00 0.00 57.97 61.75 1vkm h PHE 247 Cb 0.46 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.12 1vkm h PHE 247 CO -0.00 0.16 -0.84 -0.07 -2.23 0.00 0.00 178.31 175.32 1vkm h LEU 248 N 0.34 0.69 -0.71 0.59 3.38 -0.90 -2.61 115.31 116.09 1vkm h LEU 248 Ca 0.15 -0.49 -0.07 0.00 0.09 0.00 0.00 57.88 57.56 1vkm h LEU 248 Cb 0.07 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.59 1vkm h LEU 248 CO -0.11 1.27 0.16 -0.07 0.09 0.00 0.00 178.44 179.78 1vkm h LEU 249 N 0.36 1.09 -0.52 1.67 3.38 -1.15 -1.29 115.31 118.84 1vkm h LEU 249 Ca -0.06 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.60 1vkm h LEU 249 Cb 1.46 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.90 1vkm h LEU 249 CO 0.16 1.05 0.04 0.50 0.09 0.00 0.00 178.44 180.27 1vkm h LYS 250 N 1.08 0.89 -1.00 1.13 3.64 -1.21 -2.28 116.57 118.82 1vkm h LYS 250 Ca 0.22 -0.26 0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1vkm h LYS 250 Cb 0.39 -0.09 -0.05 0.00 -0.41 0.00 0.00 32.23 32.07 1vkm h LYS 250 CO 0.00 0.89 0.66 0.87 -2.27 0.00 0.00 179.45 179.61 1vkm h LYS 251 N 0.76 1.30 -0.52 1.90 1.79 -1.20 -2.50 116.57 118.11 1vkm h LYS 251 Ca 0.15 -0.08 -0.09 0.00 -2.18 0.00 0.00 60.65 58.46 1vkm h LYS 251 Cb 0.46 -0.29 -0.02 0.00 -1.58 0.00 0.00 32.23 30.80 1vkm h LYS 251 CO 0.02 0.86 -0.02 -0.07 -1.08 0.00 0.00 179.45 179.16 1vkm h LEU 252 N 1.34 0.91 -0.73 2.94 3.38 -1.00 -2.75 115.31 119.39 1vkm h LEU 252 Ca 0.37 -0.31 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1vkm h LEU 252 Cb -0.13 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.32 1vkm h LEU 252 CO -0.09 1.00 0.40 0.58 0.09 0.00 0.00 178.44 180.43 1vkm h VAL 253 N 0.79 0.93 0.00 1.22 2.07 -1.25 0.98 116.25 120.99 1vkm h VAL 253 Ca 0.15 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1vkm h VAL 253 Cb 0.55 0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1vkm h VAL 253 CO 0.03 0.13 0.00 -0.62 0.02 0.00 0.00 177.57 177.13 1vkm n GLU 254 N -4.79 0.09 0.00 1.57 1.02 -0.95 -0.98 120.64 116.60 1vkm n GLU 254 Ca 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 1vkm n GLU 254 Cb 0.22 -1.03 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 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 0.02 0.00 -3.96 2.62 -2.24 0.34 -4.63 114.28 106.42 1vkm n THR 256 Ca 0.00 0.00 -0.30 0.00 -2.27 0.00 0.00 64.05 61.48 1vkm n THR 256 Cb 0.01 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.25 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 -3.43 0.00 3.42 4.13 -0.86 -1.82 115.26 116.70 1vkm n ASN 257 Ca 0.00 -0.87 0.00 0.00 1.68 0.00 0.00 54.58 55.39 1vkm n ASN 257 Cb 0.00 -3.55 0.00 0.00 -1.54 0.00 0.00 39.78 34.69 1vkm n ASN 257 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1vkm n GLY 258 N -1.65 1.13 0.33 7.41 0.00 -0.15 -4.94 105.19 107.32 1vkm n GLY 258 Ca -0.04 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.97 1vkm n GLY 258 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1vkm h ARG 259 N 3.47 1.05 -0.22 1.61 3.08 -1.61 -1.84 114.38 119.93 1vkm h ARG 259 Ca 0.00 -0.06 -0.11 0.00 0.07 0.00 0.00 59.98 59.88 1vkm h ARG 259 Cb 0.00 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 29.80 1vkm h ARG 259 CO 0.00 0.69 -0.34 1.79 -1.07 0.00 0.00 179.97 181.05 1vkm h THR 260 N 1.08 1.29 -0.64 2.04 1.35 -1.85 -1.45 112.91 114.73 1vkm h THR 260 Ca 0.35 -1.43 -0.06 0.00 -0.55 0.00 0.00 66.41 64.72 1vkm h THR 260 Cb 0.02 1.49 -0.03 0.00 -1.73 0.00 0.00 68.15 67.91 1vkm h THR 260 CO -0.12 0.45 0.15 0.25 -0.25 0.00 0.00 175.52 175.99 1vkm h LEU 261 N 0.39 0.98 -0.61 3.87 5.85 -1.80 -0.16 115.31 123.82 1vkm h LEU 261 Ca 0.05 -0.24 -0.06 0.00 0.84 0.00 0.00 57.88 58.47 1vkm h LEU 261 Cb 0.78 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.53 1vkm h LEU 261 CO 0.06 0.96 0.15 0.11 -0.34 0.00 0.00 178.44 179.38 1vkm h LYS 262 N 0.95 0.98 -0.69 1.25 6.56 -0.96 -0.93 116.57 123.73 1vkm h LYS 262 Ca 0.20 -0.24 -0.05 0.00 -1.06 0.00 0.00 60.65 59.50 1vkm h LYS 262 Cb 0.37 -0.13 -0.03 0.00 -0.57 0.00 0.00 32.23 31.87 1vkm h LYS 262 CO 0.00 0.90 0.23 0.00 -2.06 0.00 0.00 179.45 178.52 1vkm h ALA 263 N 1.04 0.90 -0.30 3.86 0.00 -1.07 -1.93 119.26 121.76 1vkm h ALA 263 Ca 0.19 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1vkm h ALA 263 Cb 0.35 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1vkm h ALA 263 CO 0.00 0.56 0.05 -0.97 0.00 0.00 0.00 179.25 178.89 1vkm h ASN 264 N 1.00 0.48 -0.77 0.00 -0.73 -0.74 -0.92 115.58 113.90 1vkm h ASN 264 Ca 0.22 -0.26 -0.04 0.00 1.87 0.00 0.00 56.30 58.10 1vkm h ASN 264 Cb 0.27 -0.13 -0.03 0.00 0.27 0.00 0.00 38.32 38.70 1vkm h ASN 264 CO -0.01 0.61 0.34 -0.07 -0.37 0.00 0.00 177.43 177.93 1vkm h LEU 265 N 0.32 1.03 -0.39 0.34 3.38 -1.14 -1.28 115.31 117.56 1vkm h LEU 265 Ca 0.09 -0.15 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 1vkm h LEU 265 Cb 0.34 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1vkm h LEU 265 CO 0.01 0.90 0.00 0.00 0.09 0.00 0.00 178.44 179.43 1vkm h ALA 266 N 1.17 0.53 -0.24 1.53 0.00 -1.06 -2.34 119.26 118.85 1vkm h ALA 266 Ca 0.26 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1vkm h ALA 266 Cb 0.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1vkm h ALA 266 CO -0.03 0.31 -0.44 1.37 0.00 0.00 0.00 179.25 180.46 1vkm h LEU 267 N 0.52 0.64 -0.31 0.00 8.10 -1.06 -1.58 115.31 121.62 1vkm h LEU 267 Ca 0.11 -0.30 -0.00 0.00 0.11 0.00 0.00 57.88 57.80 1vkm h LEU 267 Cb 0.47 -0.18 -0.01 0.00 -0.44 0.00 0.00 40.66 40.50 1vkm h LEU 267 CO 0.02 0.99 0.18 -0.07 -4.11 0.00 0.00 178.44 175.45 1vkm h LEU 268 N 0.48 0.38 -0.36 0.17 3.38 -1.17 0.10 115.31 118.29 1vkm h LEU 268 Ca 0.03 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1vkm h LEU 268 Cb 0.96 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.60 1vkm h LEU 268 CO 0.09 0.34 0.11 -0.08 0.09 0.00 0.00 178.44 178.99 1vkm h GLU 269 N 0.39 0.57 -0.84 1.13 4.81 -1.25 -1.24 114.58 118.15 1vkm h GLU 269 Ca 0.11 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1vkm h GLU 269 Cb 0.03 -0.08 -0.04 0.00 0.63 0.00 0.00 28.75 29.29 1vkm h GLU 269 CO -0.02 0.58 0.43 0.93 -0.73 0.00 0.00 179.01 180.21 1vkm h GLU 270 N 0.44 1.18 -0.68 1.92 4.39 -1.10 -2.21 114.58 118.52 1vkm h GLU 270 Ca 0.12 -0.15 -0.03 0.00 0.34 0.00 0.00 59.36 59.64 1vkm h GLU 270 Cb 0.25 -0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 28.65 1vkm h GLU 270 CO -0.00 0.89 0.32 -0.91 -1.16 0.00 0.00 179.01 178.14 1vkm h ASN 271 N 1.18 0.90 -0.64 1.42 2.35 -0.56 -1.96 115.58 118.26 1vkm h ASN 271 Ca 0.29 -0.14 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1vkm h ASN 271 Cb 0.07 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.18 1vkm h ASN 271 CO -0.04 0.79 0.40 0.58 -1.65 0.00 0.00 177.43 177.51 1vkm h VAL 272 N 0.95 1.18 -0.08 2.81 2.07 -0.96 0.17 116.25 122.38 1vkm h VAL 272 Ca 0.23 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.42 1vkm h VAL 272 Cb 0.14 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 30.14 1vkm h VAL 272 CO -0.03 0.18 -0.13 0.11 0.02 0.00 0.00 177.57 177.72 1vkm h LYS 273 N 0.87 -0.18 -0.37 1.57 1.57 -1.07 -0.09 116.57 118.87 1vkm h LYS 273 Ca 0.23 0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.95 1vkm h LYS 273 Cb -0.06 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.28 1vkm h LYS 273 CO -0.05 -0.12 -0.06 1.25 -0.57 0.00 0.00 179.45 179.90 1vkm h LEU 274 N -0.19 0.69 -0.66 2.94 5.85 -1.14 -1.95 115.31 120.86 1vkm h LEU 274 Ca 0.07 -0.35 0.06 0.00 0.84 0.00 0.00 57.88 58.50 1vkm h LEU 274 Cb 0.29 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.08 1vkm h LEU 274 CO -0.19 0.87 0.36 0.00 -0.34 0.00 0.00 178.44 179.15 1vkm h ALA 275 N 0.84 0.88 -0.59 1.25 0.00 -0.85 -1.59 119.26 119.19 1vkm h ALA 275 Ca 0.10 0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.08 1vkm h ALA 275 Cb 0.56 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 1vkm h ALA 275 CO 0.03 0.03 0.32 0.78 0.00 0.00 0.00 179.25 180.41 1vkm h GLY 276 N 0.66 0.85 1.01 0.00 0.00 -0.73 -0.44 103.07 104.42 1vkm h GLY 276 Ca 0.29 -0.22 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 1vkm h GLY 276 CO -0.19 0.14 0.37 0.83 0.00 0.00 0.00 176.54 177.69 1vkm h GLU 277 N 0.60 1.02 0.03 4.80 4.39 -0.81 -1.58 114.58 123.03 1vkm h GLU 277 Ca 0.26 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.82 1vkm h GLU 277 Cb 0.15 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1vkm h GLU 277 CO -0.17 0.79 -0.01 0.82 -1.16 0.00 0.00 179.01 179.28 1vkm h ILE 278 N 1.00 1.07 -0.85 3.13 2.04 -1.00 -2.37 117.51 120.53 1vkm h ILE 278 Ca 0.25 -0.28 0.06 0.00 1.00 0.00 0.00 64.86 65.89 1vkm h ILE 278 Cb 0.09 1.25 -0.06 0.00 -0.74 0.00 0.00 36.82 37.36 1vkm h ILE 278 CO -0.04 0.07 0.52 0.00 0.00 0.00 0.00 178.15 178.71 1vkm h ALA 279 N 0.81 1.17 -0.26 1.87 0.00 -0.92 0.15 119.26 122.09 1vkm h ALA 279 Ca -0.00 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1vkm h ALA 279 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1vkm h ALA 279 CO 0.01 0.26 -0.15 0.28 0.00 0.00 0.00 179.25 179.64 1vkm h VAL 280 N 0.95 1.30 0.00 0.00 2.07 -1.22 -3.03 116.25 116.32 1vkm h VAL 280 Ca 0.37 -1.26 -0.13 0.00 0.82 0.00 0.00 66.70 66.50 1vkm h VAL 280 Cb 0.19 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 1vkm h VAL 280 CO -0.18 0.40 -0.63 0.11 0.02 0.00 0.00 177.57 177.29 1vkm h LYS 281 N 0.29 0.00 -1.00 1.57 1.57 -1.09 -3.14 116.57 114.77 1vkm h LYS 281 Ca 0.05 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 58.88 1vkm h LYS 281 Cb 0.68 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.93 1vkm h LYS 281 CO 0.04 0.63 0.65 1.25 -0.57 0.00 0.00 179.45 181.46 1vkm h LEU 282 N 0.00 1.08 -1.74 2.94 5.85 -0.62 -1.64 115.31 121.19 1vkm h LEU 282 Ca -0.01 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.67 1vkm h LEU 282 Cb 1.13 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.91 1vkm h LEU 282 CO 0.08 0.73 -0.16 0.11 -0.34 0.00 0.00 178.44 178.86 1vkm h LYS 283 N 1.25 0.00 -0.03 1.25 1.79 -1.48 -3.51 116.57 115.84 1vkm h LYS 283 Ca 0.40 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.87 1vkm h LYS 283 Cb 0.03 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.68 1vkm h LYS 283 CO -0.13 0.16 0.00 0.54 -1.08 0.00 0.00 179.45 178.94