#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i9r s VAL 2 N 0.00 4.46 0.06 5.09 0.11 -1.26 -4.02 120.40 124.85 1i9r s VAL 2 Ca 0.00 1.11 0.02 0.00 -2.93 0.00 0.00 61.98 60.17 1i9r s VAL 2 Cb 0.00 -4.43 -0.03 0.00 -1.53 0.00 0.00 36.38 30.39 1i9r s VAL 2 CO 0.00 -0.72 -0.07 0.00 -3.33 0.00 0.00 175.10 170.98 1i9r s GLN 3 N 3.78 0.65 -0.19 1.54 -2.07 0.29 -4.95 119.66 118.71 1i9r s GLN 3 Ca 0.40 -1.01 0.01 0.00 -1.82 0.00 0.00 55.36 52.94 1i9r s GLN 3 Cb -0.10 -0.22 0.04 0.00 -1.09 0.00 0.00 33.01 31.63 1i9r s GLN 3 CO 0.24 0.01 -0.12 -0.51 -1.32 0.00 0.00 175.29 173.59 1i9r s LEU 4 N -2.23 2.19 -0.41 2.60 1.43 -1.26 -0.47 118.68 120.52 1i9r s LEU 4 Ca -0.01 -0.80 -0.07 0.00 -1.03 0.00 0.00 54.13 52.22 1i9r s LEU 4 Cb -0.03 -1.25 0.09 0.00 0.03 0.00 0.00 46.19 45.03 1i9r s LEU 4 CO -0.02 -0.12 0.24 -0.69 0.23 0.00 0.00 176.35 175.99 1i9r s VAL 5 N 1.40 3.83 0.93 -1.59 1.01 -0.10 -3.94 120.40 121.93 1i9r s VAL 5 Ca 0.00 -1.67 -0.12 0.00 0.00 0.00 0.00 61.98 60.20 1i9r s VAL 5 Cb -0.15 -3.45 0.15 0.00 0.00 0.00 0.00 36.38 32.93 1i9r s VAL 5 CO -0.09 -0.58 1.09 -1.58 0.00 0.00 0.00 175.10 173.95 1i9r s GLN 6 N 1.31 1.02 0.82 2.72 0.74 -1.26 -2.11 119.66 122.91 1i9r s GLN 6 Ca 0.04 0.79 -0.11 0.00 0.05 0.00 0.00 55.36 56.13 1i9r s GLN 6 Cb -0.23 -1.78 0.11 0.00 1.10 0.00 0.00 33.01 32.21 1i9r s GLN 6 CO -0.01 -2.40 1.17 -1.54 -0.55 0.00 0.00 175.29 171.97 1i9r s SER 7 N -3.37 4.15 0.74 6.67 1.04 -1.00 -4.88 113.70 117.05 1i9r s SER 7 Ca 0.64 0.48 -0.14 0.00 0.48 0.00 0.00 55.95 57.41 1i9r s SER 7 Cb -0.18 -0.87 0.05 0.00 0.10 0.00 0.00 66.02 65.11 1i9r s SER 7 CO 0.57 -2.08 1.16 -0.83 0.98 0.00 0.00 173.24 173.05 1i9r s GLY 8 N -4.67 2.14 0.74 7.32 0.00 -1.26 -4.73 107.32 106.86 1i9r s GLY 8 Ca 0.65 0.70 -0.15 0.00 0.00 0.00 0.00 44.72 45.92 1i9r s GLY 8 CO 0.49 1.09 1.24 0.00 0.00 0.00 0.00 173.10 175.91 1i9r n ALA 9 N -2.93 0.49 -3.19 3.20 0.00 -1.26 -4.82 120.51 112.00 1i9r n ALA 9 Ca 0.12 -0.18 -0.19 0.00 0.00 0.00 0.00 53.44 53.19 1i9r n ALA 9 Cb 0.51 -2.28 -0.16 0.00 0.00 0.00 0.00 19.45 17.53 1i9r n ALA 9 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1i9r s GLU 10 N -3.76 0.80 -0.17 0.00 8.01 -0.41 -4.97 118.70 118.19 1i9r s GLU 10 Ca 0.78 -0.21 0.00 0.00 0.01 0.00 0.00 54.97 55.55 1i9r s GLU 10 Cb -0.33 -0.77 0.01 0.00 -4.31 0.00 0.00 34.13 28.73 1i9r s GLU 10 CO 0.46 0.05 -0.16 0.08 0.01 0.00 0.00 175.26 175.69 1i9r s VAL 11 N 0.38 2.44 0.00 2.63 1.01 -1.26 -1.00 120.40 124.60 1i9r s VAL 11 Ca -0.05 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.08 1i9r s VAL 11 Cb -0.09 -2.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.24 1i9r s VAL 11 CO 0.00 0.51 0.03 0.54 0.00 0.00 0.00 175.10 176.19 1i9r s VAL 12 N 1.14 0.06 0.46 2.92 0.11 -0.50 -4.99 120.40 119.60 1i9r s VAL 12 Ca 0.01 -0.50 -0.22 0.00 -2.93 0.00 0.00 61.98 58.34 1i9r s VAL 12 Cb -0.14 -0.22 -0.08 0.00 -1.53 0.00 0.00 36.38 34.41 1i9r s VAL 12 CO -0.06 -0.27 1.08 -1.59 -3.33 0.00 0.00 175.10 170.92 1i9r s LYS 13 N -0.84 3.83 0.98 1.54 0.00 -1.24 -0.60 119.74 123.41 1i9r s LYS 13 Ca -0.09 1.53 -0.15 0.00 0.00 0.00 0.00 55.97 57.26 1i9r s LYS 13 Cb -0.06 -2.28 -0.02 0.00 0.00 0.00 0.00 37.83 35.48 1i9r s LYS 13 CO -0.00 -0.43 -0.02 -2.30 0.00 0.00 0.00 175.35 172.59 1i9r n PRO 14 N -0.65 -0.32 0.00 1.78 -0.02 -1.26 -2.07 135.00 132.46 1i9r n PRO 14 Ca 0.08 -0.07 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1i9r n PRO 14 Cb 0.50 -1.58 0.00 0.00 -0.02 0.00 0.00 33.50 32.40 1i9r n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i9r n GLY 15 N 2.15 1.83 0.12 -1.23 0.00 0.21 -4.84 105.19 103.42 1i9r n GLY 15 Ca 0.04 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.04 1i9r n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i9r n ALA 16 N 0.06 -0.15 -3.09 4.61 0.00 -0.88 -3.61 120.51 117.45 1i9r n ALA 16 Ca 0.00 -0.06 -0.12 0.00 0.00 0.00 0.00 53.44 53.27 1i9r n ALA 16 Cb 0.00 -0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1i9r n ALA 16 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1i9r s SER 17 N -1.81 -0.05 0.07 0.00 0.01 -1.26 -1.70 113.70 108.96 1i9r s SER 17 Ca 0.02 0.00 0.05 0.00 1.31 0.00 0.00 55.95 57.34 1i9r s SER 17 Cb -0.00 0.26 -0.03 0.00 0.21 0.00 0.00 66.02 66.46 1i9r s SER 17 CO 0.02 -0.25 -0.14 0.54 0.41 0.00 0.00 173.24 173.82 1i9r s VAL 18 N -0.82 1.11 -0.45 3.43 0.11 -0.37 -5.00 120.40 118.40 1i9r s VAL 18 Ca -0.09 -1.34 0.04 0.00 -2.93 0.00 0.00 61.98 57.66 1i9r s VAL 18 Cb -0.05 -1.10 0.12 0.00 -1.53 0.00 0.00 36.38 33.82 1i9r s VAL 18 CO 0.01 -0.25 0.18 -0.75 -3.33 0.00 0.00 175.10 170.96 1i9r s LYS 19 N -1.83 1.78 0.33 1.54 2.20 -1.26 -1.31 119.74 121.19 1i9r s LYS 19 Ca -0.01 -2.33 -0.28 0.00 -0.36 0.00 0.00 55.97 52.99 1i9r s LYS 19 Cb -0.09 -3.25 -0.09 0.00 -1.51 0.00 0.00 37.83 32.88 1i9r s LYS 19 CO 0.02 -1.05 1.19 -0.51 -0.36 0.00 0.00 175.35 174.64 1i9r s LEU 20 N 0.17 4.40 0.25 5.43 1.02 0.37 -4.79 118.68 125.52 1i9r s LEU 20 Ca 0.15 2.43 0.10 0.00 0.02 0.00 0.00 54.13 56.83 1i9r s LEU 20 Cb -0.23 -3.76 -0.05 0.00 0.02 0.00 0.00 46.19 42.17 1i9r s LEU 20 CO -0.03 -0.43 -0.17 -0.94 0.02 0.00 0.00 176.35 174.80 1i9r s SER 21 N -0.83 3.13 -0.18 2.29 1.04 -1.26 0.60 113.70 118.48 1i9r s SER 21 Ca 0.50 -1.04 -0.05 0.00 0.48 0.00 0.00 55.95 55.84 1i9r s SER 21 Cb -0.34 -0.23 0.09 0.00 0.10 0.00 0.00 66.02 65.64 1i9r s SER 21 CO 0.44 -0.07 0.34 0.00 0.98 0.00 0.00 173.24 174.93 1i9r s LYS 23 N 2.51 2.97 0.80 0.00 2.20 -0.90 -0.45 119.74 126.88 1i9r s LYS 23 Ca 0.02 -1.00 -0.10 0.00 -0.36 0.00 0.00 55.97 54.52 1i9r s LYS 23 Cb -0.13 -3.88 0.10 0.00 -1.51 0.00 0.00 37.83 32.41 1i9r s LYS 23 CO -0.11 -0.70 1.14 0.00 -0.36 0.00 0.00 175.35 175.31 1i9r s ALA 24 N 1.64 2.80 0.00 3.13 0.00 -0.64 -0.93 121.76 127.76 1i9r s ALA 24 Ca 0.04 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1i9r s ALA 24 Cb -0.19 -2.74 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1i9r s ALA 24 CO 0.09 -1.70 0.00 -1.13 0.00 0.00 0.00 175.76 173.02 1i9r n SER 25 N -3.25 0.00 0.00 0.00 3.41 0.38 -4.86 113.62 109.30 1i9r n SER 25 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 1i9r n SER 25 Cb 0.60 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 1i9r n SER 25 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i9r n GLY 26 N -0.17 0.48 3.83 5.00 0.00 -1.26 0.10 105.19 113.18 1i9r n GLY 26 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 1i9r n GLY 26 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1i9r s TYR 27 N -2.10 -0.01 -0.38 1.61 1.13 -1.26 -4.28 117.35 112.06 1i9r s TYR 27 Ca 0.00 -0.54 -0.29 0.00 -1.41 0.00 0.00 57.07 54.83 1i9r s TYR 27 Cb 0.00 0.77 0.02 0.00 -1.10 0.00 0.00 41.96 41.65 1i9r s TYR 27 CO 0.00 -1.35 1.21 0.42 -2.51 0.00 0.00 175.55 173.32 1i9r s ILE 28 N -2.93 4.22 0.14 -3.49 1.01 -1.26 -4.91 121.20 113.97 1i9r s ILE 28 Ca 0.14 1.32 -0.25 0.00 0.00 0.00 0.00 60.65 61.86 1i9r s ILE 28 Cb -0.05 -4.39 -0.01 0.00 0.01 0.00 0.00 42.46 38.03 1i9r s ILE 28 CO 0.09 -0.71 1.61 0.15 0.00 0.00 0.00 174.94 176.08 1i9r h PHE 29 N 9.19 -0.85 0.00 3.97 3.57 -1.96 -2.73 116.94 128.13 1i9r h PHE 29 Ca -0.24 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.30 1i9r h PHE 29 Cb 1.08 0.40 0.00 0.00 2.79 0.00 0.00 35.95 40.22 1i9r h PHE 29 CO 0.92 -0.39 0.00 0.25 -2.23 0.00 0.00 178.31 176.86 1i9r n THR 30 N -5.40 1.17 0.41 4.41 -2.24 -1.26 -2.48 114.28 108.89 1i9r n THR 30 Ca -0.02 0.40 0.07 0.00 -2.27 0.00 0.00 64.05 62.23 1i9r n THR 30 Cb 0.32 -1.32 0.21 0.00 -2.10 0.00 0.00 70.33 67.45 1i9r n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1i9r n SER 31 N -1.89 2.73 -3.83 3.42 7.64 -1.03 -4.08 113.62 116.58 1i9r n SER 31 Ca 0.01 -2.11 -0.18 0.00 1.01 0.00 0.00 58.87 57.61 1i9r n SER 31 Cb 0.12 -0.36 -0.16 0.00 -1.01 0.00 0.00 64.21 62.80 1i9r n SER 31 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1i9r s TYR 32 N -1.52 0.38 0.10 1.43 2.02 -1.03 -4.90 117.35 113.83 1i9r s TYR 32 Ca 0.31 -0.03 -0.31 0.00 -0.37 0.00 0.00 57.07 56.67 1i9r s TYR 32 Cb 0.18 -0.45 -0.07 0.00 -0.40 0.00 0.00 41.96 41.22 1i9r s TYR 32 CO 0.19 -0.14 1.25 0.71 -1.57 0.00 0.00 175.55 175.98 1i9r s TYR 33 N 1.03 3.39 -0.19 2.71 1.51 -1.25 -4.32 117.35 120.22 1i9r s TYR 33 Ca -0.10 1.23 -0.15 0.00 -1.01 0.00 0.00 57.07 57.05 1i9r s TYR 33 Cb -0.14 -3.49 -0.04 0.00 -0.11 0.00 0.00 41.96 38.18 1i9r s TYR 33 CO -0.02 -1.55 0.35 1.41 -1.11 0.00 0.00 175.55 174.64 1i9r s MET 34 N 0.85 4.19 0.50 -0.62 1.75 -0.65 -0.52 119.30 124.79 1i9r s MET 34 Ca 0.59 0.14 0.05 0.00 -1.25 0.00 0.00 55.69 55.22 1i9r s MET 34 Cb -0.32 -3.51 0.09 0.00 2.84 0.00 0.00 34.83 33.93 1i9r s MET 34 CO 0.31 0.05 0.69 0.66 -0.65 0.00 0.00 175.02 176.07 1i9r n TYR 35 N 4.20 -2.64 -3.71 4.11 4.02 0.15 -1.76 117.16 121.52 1i9r n TYR 35 Ca -0.10 -1.58 -0.12 0.00 -0.01 0.00 0.00 57.90 56.10 1i9r n TYR 35 Cb 0.51 -0.48 -0.12 0.00 -0.02 0.00 0.00 39.34 39.23 1i9r n TYR 35 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 176.86 174.27 1i9r s TRP 36 N -2.03 -0.41 -0.02 -0.72 0.52 -1.08 -2.87 118.94 112.33 1i9r s TRP 36 Ca 0.50 0.94 0.05 0.00 0.02 0.00 0.00 56.10 57.60 1i9r s TRP 36 Cb -0.04 0.10 -0.01 0.00 -1.15 0.00 0.00 33.47 32.37 1i9r s TRP 36 CO 0.32 -0.27 -0.18 0.08 0.02 0.00 0.00 176.95 176.92 1i9r s VAL 37 N 1.40 1.44 0.05 4.03 1.01 -0.50 -0.25 120.40 127.58 1i9r s VAL 37 Ca -0.09 -0.77 0.04 0.00 0.00 0.00 0.00 61.98 61.16 1i9r s VAL 37 Cb -0.10 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 1i9r s VAL 37 CO -0.10 0.41 -0.02 -0.75 0.00 0.00 0.00 175.10 174.64 1i9r s LYS 38 N -0.33 2.59 -0.15 2.72 2.20 0.14 -0.44 119.74 126.47 1i9r s LYS 38 Ca 0.05 -0.77 -0.04 0.00 -0.36 0.00 0.00 55.97 54.85 1i9r s LYS 38 Cb -0.08 -2.55 0.07 0.00 -1.51 0.00 0.00 37.83 33.76 1i9r s LYS 38 CO -0.00 0.57 0.22 -1.14 -0.36 0.00 0.00 175.35 174.64 1i9r s GLN 39 N -1.93 0.14 0.04 4.03 0.74 -0.20 -0.19 119.66 122.29 1i9r s GLN 39 Ca 0.22 0.46 0.01 0.00 0.05 0.00 0.00 55.36 56.10 1i9r s GLN 39 Cb -0.11 -0.62 -0.04 0.00 1.10 0.00 0.00 33.01 33.34 1i9r s GLN 39 CO 0.14 -0.46 0.12 0.00 -0.55 0.00 0.00 175.29 174.54 1i9r s ALA 40 N 2.35 3.73 -0.31 1.58 0.00 -1.22 -0.50 121.76 127.39 1i9r s ALA 40 Ca 0.04 -0.90 -0.28 0.00 0.00 0.00 0.00 51.96 50.82 1i9r s ALA 40 Cb -0.14 -1.62 -0.12 0.00 0.00 0.00 0.00 23.12 21.24 1i9r s ALA 40 CO -0.09 0.75 1.15 -2.30 0.00 0.00 0.00 175.76 175.27 1i9r n PRO 41 N 0.66 0.00 0.00 0.00 -0.02 -1.26 0.35 135.00 134.74 1i9r n PRO 41 Ca -0.09 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.39 1i9r n PRO 41 Cb 0.52 -0.93 0.00 0.00 -0.02 0.00 0.00 33.50 33.07 1i9r n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1i9r n GLY 42 N 3.50 1.14 3.75 -1.23 0.00 -1.26 -4.91 105.19 106.18 1i9r n GLY 42 Ca 0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.93 1i9r n GLY 42 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1i9r s GLN 43 N 0.00 2.73 0.00 1.61 2.00 1.10 -5.03 119.66 122.07 1i9r s GLN 43 Ca 0.00 1.70 0.00 0.00 -2.00 0.00 0.00 55.36 55.06 1i9r s GLN 43 Cb 0.00 -1.91 0.00 0.00 0.80 0.00 0.00 33.01 31.90 1i9r s GLN 43 CO 0.00 -1.37 0.00 0.41 -0.50 0.00 0.00 175.29 173.83 1i9r n GLY 44 N 0.24 -0.98 3.64 2.59 0.00 -1.26 -3.42 105.19 106.01 1i9r n GLY 44 Ca 0.13 -1.60 -0.40 0.00 0.00 0.00 0.00 46.02 44.14 1i9r n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i9r s LEU 45 N 0.00 4.10 -0.06 0.99 1.02 -1.26 -3.55 118.68 119.92 1i9r s LEU 45 Ca 0.00 0.72 0.04 0.00 0.02 0.00 0.00 54.13 54.91 1i9r s LEU 45 Cb 0.00 -2.82 -0.00 0.00 0.02 0.00 0.00 46.19 43.39 1i9r s LEU 45 CO 0.00 -0.31 -0.19 -1.61 0.02 0.00 0.00 176.35 174.27 1i9r s GLU 46 N 2.19 2.10 -0.08 1.70 2.02 0.73 -4.96 118.70 122.40 1i9r s GLU 46 Ca 0.26 -0.67 -0.23 0.00 0.02 0.00 0.00 54.97 54.36 1i9r s GLU 46 Cb -0.16 -1.75 -0.04 0.00 0.10 0.00 0.00 34.13 32.29 1i9r s GLU 46 CO 0.09 0.22 0.68 -0.46 0.02 0.00 0.00 175.26 175.81 1i9r s TRP 47 N 0.17 3.56 -0.15 1.61 -0.00 -1.26 0.27 118.94 123.13 1i9r s TRP 47 Ca -0.08 1.19 -0.11 0.00 -0.00 0.00 0.00 56.10 57.10 1i9r s TRP 47 Cb -0.14 -2.78 -0.05 0.00 -0.00 0.00 0.00 33.47 30.50 1i9r s TRP 47 CO 0.04 0.07 -0.14 -0.89 -0.00 0.00 0.00 176.95 176.04 1i9r n ILE 48 N 3.84 1.43 -3.39 5.86 5.41 0.65 -4.63 119.36 128.53 1i9r n ILE 48 Ca -0.02 0.18 0.00 0.00 1.00 0.00 0.00 62.75 63.92 1i9r n ILE 48 Cb 0.51 -2.35 0.00 0.00 -0.71 0.00 0.00 39.64 37.10 1i9r n ILE 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1i9r n GLY 49 N 1.59 1.30 3.09 7.39 0.00 -1.24 0.30 105.19 117.62 1i9r n GLY 49 Ca -0.11 -0.90 -0.08 0.00 0.00 0.00 0.00 46.02 44.94 1i9r n GLY 49 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1i9r s GLU 50 N -1.79 0.60 -0.09 1.61 -1.05 0.12 -2.64 118.70 115.45 1i9r s GLU 50 Ca 0.00 -1.04 -0.06 0.00 -0.15 0.00 0.00 54.97 53.72 1i9r s GLU 50 Cb 0.00 0.22 0.03 0.00 -0.44 0.00 0.00 34.13 33.94 1i9r s GLU 50 CO 0.00 -0.13 0.23 -1.50 0.95 0.00 0.00 175.26 174.81 1i9r s ILE 51 N -3.40 -0.02 -0.20 1.83 2.07 -0.72 -1.45 121.20 119.31 1i9r s ILE 51 Ca 0.02 0.08 -0.18 0.00 -1.41 0.00 0.00 60.65 59.16 1i9r s ILE 51 Cb 0.04 -0.34 -0.03 0.00 0.13 0.00 0.00 42.46 42.25 1i9r s ILE 51 CO -0.08 0.03 0.49 0.21 -1.91 0.00 0.00 174.94 173.68 1i9r s ASN 52 N 0.71 6.54 0.35 4.50 3.84 -0.09 -1.64 114.94 129.15 1i9r s ASN 52 Ca -0.05 0.65 0.19 0.00 0.21 0.00 0.00 52.86 53.85 1i9r s ASN 52 Cb -0.06 -2.28 0.34 0.00 -0.55 0.00 0.00 41.25 38.70 1i9r s ASN 52 CO -0.04 -0.16 1.57 1.55 -2.79 0.00 0.00 177.10 177.24 1i9r h PRO 53 N 7.43 0.00 -0.54 0.43 0.13 -1.82 -1.23 132.00 136.41 1i9r h PRO 53 Ca -0.34 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.81 1i9r h PRO 53 Cb 1.16 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.25 1i9r h PRO 53 CO 0.73 0.35 0.32 1.03 -0.23 0.00 0.00 178.00 180.21 1i9r h SER 54 N 0.00 0.53 0.16 1.44 0.87 -1.88 -3.35 113.55 111.32 1i9r h SER 54 Ca -0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1i9r h SER 54 Cb 1.15 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 63.00 1i9r h SER 54 CO 0.05 0.37 -0.08 -1.13 -0.53 0.00 0.00 176.83 175.51 1i9r h ASN 55 N 0.65 -0.18 0.00 6.23 -0.73 -1.88 -3.48 115.58 116.19 1i9r h ASN 55 Ca 0.21 0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.39 1i9r h ASN 55 Cb 0.01 0.05 0.00 0.00 0.27 0.00 0.00 38.32 38.65 1i9r h ASN 55 CO -0.09 0.14 0.00 0.61 -0.37 0.00 0.00 177.43 177.72 1i9r n GLY 56 N 1.10 1.61 3.57 1.57 0.00 -0.47 -5.06 105.19 107.51 1i9r n GLY 56 Ca -0.03 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.53 1i9r n GLY 56 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1i9r n ASP 57 N 0.00 1.08 -4.26 1.61 4.64 -1.25 -4.69 116.55 113.68 1i9r n ASP 57 Ca 0.00 1.16 -0.21 0.00 -1.38 0.00 0.00 54.79 54.36 1i9r n ASP 57 Cb 0.00 -1.23 -0.10 0.00 -1.04 0.00 0.00 41.12 38.75 1i9r n ASP 57 CO 0.00 0.00 0.00 0.42 -0.82 0.00 0.00 177.20 176.80 1i9r s THR 58 N -0.74 0.76 -0.27 5.18 -4.23 -1.26 -0.91 115.64 114.17 1i9r s THR 58 Ca 0.64 -2.00 -0.07 0.00 -1.18 0.00 0.00 61.69 59.08 1i9r s THR 58 Cb -0.78 -2.59 0.13 0.00 1.34 0.00 0.00 72.50 70.61 1i9r s THR 58 CO 0.57 0.00 0.57 0.20 -0.54 0.00 0.00 174.62 175.42 1i9r s ASN 59 N -3.47 -0.90 0.31 3.99 0.01 -0.53 -4.97 114.94 109.38 1i9r s ASN 59 Ca 0.33 1.22 0.08 0.00 -0.71 0.00 0.00 52.86 53.77 1i9r s ASN 59 Cb 0.06 1.99 -0.03 0.00 0.41 0.00 0.00 41.25 43.68 1i9r s ASN 59 CO 0.15 -0.24 0.21 -0.36 -1.51 0.00 0.00 177.10 175.35 1i9r s PHE 60 N 2.80 2.88 -0.21 2.20 0.40 -1.26 0.14 117.98 124.93 1i9r s PHE 60 Ca 0.02 -0.27 -0.22 0.00 -0.60 0.00 0.00 56.93 55.85 1i9r s PHE 60 Cb -0.13 -1.62 -0.02 0.00 0.51 0.00 0.00 43.02 41.77 1i9r s PHE 60 CO -0.18 0.33 0.72 1.21 0.70 0.00 0.00 175.22 178.00 1i9r s ASN 61 N -3.90 6.76 0.24 1.36 3.84 0.15 -4.90 114.94 118.49 1i9r s ASN 61 Ca 0.38 0.93 -0.07 0.00 0.21 0.00 0.00 52.86 54.30 1i9r s ASN 61 Cb -0.05 -2.39 0.40 0.00 -0.55 0.00 0.00 41.25 38.65 1i9r s ASN 61 CO 0.25 -0.37 1.37 1.21 -2.79 0.00 0.00 177.10 176.77 1i9r n GLU 62 N 5.40 -0.08 0.03 0.43 4.07 -1.26 0.13 120.64 129.34 1i9r n GLU 62 Ca 0.01 1.37 0.01 0.00 -0.06 0.00 0.00 57.16 58.49 1i9r n GLU 62 Cb 0.49 -2.04 0.04 0.00 -0.06 0.00 0.00 31.44 29.87 1i9r n GLU 62 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1i9r n LYS 63 N -5.42 0.01 0.00 5.31 3.00 -1.26 -0.82 118.16 118.98 1i9r n LYS 63 Ca 0.14 0.27 0.00 0.00 -0.00 0.00 0.00 58.31 58.72 1i9r n LYS 63 Cb 0.43 -1.85 0.00 0.00 0.00 0.00 0.00 35.03 33.62 1i9r n LYS 63 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 1i9r n PHE 64 N -1.34 0.00 -0.40 5.64 3.01 0.34 -4.85 117.46 119.86 1i9r n PHE 64 Ca -0.00 -0.05 0.36 0.00 1.01 0.00 0.00 57.45 58.77 1i9r n PHE 64 Cb 0.31 -0.00 0.72 0.00 -0.01 0.00 0.00 39.48 40.49 1i9r n PHE 64 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 1i9r h LYS 65 N 0.00 0.07 0.03 -1.08 3.11 -0.60 -1.33 116.57 116.77 1i9r h LYS 65 Ca 0.00 -0.00 -0.11 0.00 -2.81 0.00 0.00 60.65 57.73 1i9r h LYS 65 Cb 0.49 -0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.70 1i9r h LYS 65 CO 0.00 0.04 -0.55 0.66 -2.81 0.00 0.00 179.45 176.79 1i9r h SER 66 N 0.07 0.11 0.07 4.20 4.64 -1.89 -3.39 113.55 117.35 1i9r h SER 66 Ca 0.65 -0.87 -0.06 0.00 -0.47 0.00 0.00 61.79 61.05 1i9r h SER 66 Cb 2.42 -0.03 -0.01 0.00 -0.31 0.00 0.00 62.40 64.46 1i9r h SER 66 CO -0.09 1.23 -0.18 0.11 -0.87 0.00 0.00 176.83 177.03 1i9r h LYS 67 N -0.84 0.23 -6.23 4.77 6.56 -1.57 -3.45 116.57 116.05 1i9r h LYS 67 Ca -0.13 -0.06 -0.55 0.00 -1.06 0.00 0.00 60.65 58.85 1i9r h LYS 67 Cb 1.24 -0.03 -0.08 0.00 -0.57 0.00 0.00 32.23 32.79 1i9r h LYS 67 CO -0.02 0.41 -0.60 0.00 -2.06 0.00 0.00 179.45 177.18 1i9r s ALA 68 N -4.62 3.35 -0.35 3.86 0.00 -0.97 -2.13 121.76 120.90 1i9r s ALA 68 Ca -0.05 -1.47 0.01 0.00 0.00 0.00 0.00 51.96 50.44 1i9r s ALA 68 Cb 0.15 -1.05 0.14 0.00 0.00 0.00 0.00 23.12 22.36 1i9r s ALA 68 CO 0.74 0.33 0.27 0.99 0.00 0.00 0.00 175.76 178.09 1i9r s THR 69 N -2.08 -0.10 0.25 0.00 2.01 -0.89 -4.91 115.64 109.93 1i9r s THR 69 Ca 0.31 -1.27 -0.30 0.00 0.31 0.00 0.00 61.69 60.74 1i9r s THR 69 Cb -0.08 -0.92 -0.09 0.00 0.01 0.00 0.00 72.50 71.42 1i9r s THR 69 CO 0.22 -0.78 1.13 -0.76 -0.69 0.00 0.00 174.62 173.74 1i9r s LEU 70 N 1.38 4.51 0.12 4.42 1.43 -1.26 -2.69 118.68 126.59 1i9r s LEU 70 Ca 0.16 2.27 -0.20 0.00 -1.03 0.00 0.00 54.13 55.33 1i9r s LEU 70 Cb -0.19 -3.62 0.05 0.00 0.03 0.00 0.00 46.19 42.46 1i9r s LEU 70 CO -0.06 -0.23 0.49 0.28 0.23 0.00 0.00 176.35 177.07 1i9r s THR 71 N -0.81 0.04 0.03 5.49 -1.32 -0.73 -4.99 115.64 113.34 1i9r s THR 71 Ca 0.47 -0.31 -0.07 0.00 -1.21 0.00 0.00 61.69 60.56 1i9r s THR 71 Cb -0.32 -1.07 -0.00 0.00 -1.51 0.00 0.00 72.50 69.60 1i9r s THR 71 CO 0.40 -0.17 0.14 0.68 -2.21 0.00 0.00 174.62 173.46 1i9r s VAL 72 N -3.47 0.11 -0.87 5.08 -7.23 -1.26 -0.37 120.40 112.39 1i9r s VAL 72 Ca 0.00 -0.90 -0.00 0.00 -1.81 0.00 0.00 61.98 59.27 1i9r s VAL 72 Cb 0.00 -0.76 0.25 0.00 0.56 0.00 0.00 36.38 36.42 1i9r s VAL 72 CO -0.10 -0.50 0.91 -0.67 -0.31 0.00 0.00 175.10 174.44 1i9r n ASP 73 N 0.94 4.53 -0.12 4.85 2.03 0.22 -4.93 116.55 124.07 1i9r n ASP 73 Ca -0.20 -3.27 0.01 0.00 0.52 0.00 0.00 54.79 51.84 1i9r n ASP 73 Cb 0.58 -0.99 0.03 0.00 -0.72 0.00 0.00 41.12 40.01 1i9r n ASP 73 CO 0.00 0.00 0.00 1.17 -1.92 0.00 0.00 177.20 176.45 1i9r n LYS 74 N 1.72 -0.05 0.40 -0.67 4.81 -1.26 0.44 118.16 123.54 1i9r n LYS 74 Ca 0.25 0.49 -0.19 0.00 -0.87 0.00 0.00 58.31 57.99 1i9r n LYS 74 Cb 0.37 -0.73 -0.09 0.00 0.02 0.00 0.00 35.03 34.59 1i9r n LYS 74 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1i9r h SER 75 N 0.00 -1.04 0.00 3.14 4.64 -1.95 -1.87 113.55 116.47 1i9r h SER 75 Ca 0.13 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1i9r h SER 75 Cb 0.21 0.30 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1i9r h SER 75 CO -0.32 -0.66 0.00 0.00 -0.87 0.00 0.00 176.83 174.98 1i9r n ALA 76 N -2.63 2.17 -4.10 5.18 0.00 0.17 -4.84 120.51 116.46 1i9r n ALA 76 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 52.95 1i9r n ALA 76 Cb 0.44 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 1i9r n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1i9r n SER 77 N -0.45 -1.71 -3.88 0.00 2.88 -0.18 -4.80 113.62 105.47 1i9r n SER 77 Ca 0.00 -1.21 -0.11 0.00 -1.33 0.00 0.00 58.87 56.22 1i9r n SER 77 Cb 0.01 -2.10 -0.12 0.00 -0.75 0.00 0.00 64.21 61.25 1i9r n SER 77 CO 0.00 0.00 0.00 -0.89 -1.23 0.00 0.00 175.04 172.92 1i9r s THR 78 N -3.91 0.04 0.26 2.46 2.01 -1.21 -1.62 115.64 113.67 1i9r s THR 78 Ca 0.22 -0.34 0.10 0.00 0.31 0.00 0.00 61.69 61.98 1i9r s THR 78 Cb -0.11 -0.21 -0.04 0.00 0.01 0.00 0.00 72.50 72.15 1i9r s THR 78 CO 0.95 -0.19 -0.04 0.00 -0.69 0.00 0.00 174.62 174.66 1i9r s ALA 79 N -0.58 3.10 0.01 7.40 0.00 0.40 0.73 121.76 132.82 1i9r s ALA 79 Ca -0.06 -1.67 -0.01 0.00 0.00 0.00 0.00 51.96 50.21 1i9r s ALA 79 Cb -0.04 -0.70 -0.01 0.00 0.00 0.00 0.00 23.12 22.36 1i9r s ALA 79 CO 0.00 0.28 0.00 0.71 0.00 0.00 0.00 175.76 176.76 1i9r s TYR 80 N -2.31 0.16 -0.05 0.00 2.02 0.51 -0.11 117.35 117.56 1i9r s TYR 80 Ca 0.31 -0.32 0.03 0.00 -0.37 0.00 0.00 57.07 56.72 1i9r s TYR 80 Cb -0.06 -0.12 0.00 0.00 -0.40 0.00 0.00 41.96 41.38 1i9r s TYR 80 CO 0.19 -0.15 -0.15 1.41 -1.57 0.00 0.00 175.55 175.28 1i9r s MET 81 N -1.04 1.69 -0.26 -0.62 -2.45 0.20 -1.76 119.30 115.05 1i9r s MET 81 Ca -0.11 -0.51 0.02 0.00 -1.25 0.00 0.00 55.69 53.84 1i9r s MET 81 Cb -0.07 -1.44 0.06 0.00 1.25 0.00 0.00 34.83 34.64 1i9r s MET 81 CO -0.00 0.15 -0.08 -2.00 1.05 0.00 0.00 175.02 174.14 1i9r s GLU 82 N 0.27 1.97 -0.06 4.11 2.12 -1.09 0.14 118.70 126.15 1i9r s GLU 82 Ca -0.08 -1.26 -0.15 0.00 0.36 0.00 0.00 54.97 53.84 1i9r s GLU 82 Cb -0.13 -2.80 -0.05 0.00 0.26 0.00 0.00 34.13 31.42 1i9r s GLU 82 CO 0.03 -0.61 0.39 -0.51 -0.54 0.00 0.00 175.26 174.02 1i9r s LEU 83 N 1.19 4.38 0.25 2.70 1.43 -0.42 -2.10 118.68 126.11 1i9r s LEU 83 Ca -0.07 0.82 0.07 0.00 -1.03 0.00 0.00 54.13 53.92 1i9r s LEU 83 Cb -0.20 -2.55 -0.05 0.00 0.03 0.00 0.00 46.19 43.43 1i9r s LEU 83 CO -0.06 0.21 -0.10 -0.94 0.23 0.00 0.00 176.35 175.69 1i9r s SER 84 N -0.37 2.70 -0.97 2.29 1.04 -0.91 -1.24 113.70 116.24 1i9r s SER 84 Ca 0.22 -1.11 -0.12 0.00 0.48 0.00 0.00 55.95 55.42 1i9r s SER 84 Cb -0.15 -0.16 0.01 0.00 0.10 0.00 0.00 66.02 65.82 1i9r s SER 84 CO 0.10 -0.25 0.69 -1.54 0.98 0.00 0.00 173.24 173.22 1i9r n SER 85 N -0.49 -5.32 -4.68 7.02 3.41 -0.69 -4.80 113.62 108.07 1i9r n SER 85 Ca -0.06 -0.91 -0.42 0.00 -0.26 0.00 0.00 58.87 57.22 1i9r n SER 85 Cb 0.62 -2.71 -0.03 0.00 -0.26 0.00 0.00 64.21 61.83 1i9r n SER 85 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1i9r s LEU 86 N -5.70 4.27 0.00 1.04 1.43 -0.79 -4.71 118.68 114.22 1i9r s LEU 86 Ca 0.23 1.84 -0.01 0.00 -1.03 0.00 0.00 54.13 55.16 1i9r s LEU 86 Cb -0.10 -3.55 0.15 0.00 0.03 0.00 0.00 46.19 42.72 1i9r s LEU 86 CO 0.88 -0.64 1.03 0.54 0.23 0.00 0.00 176.35 178.38 1i9r n ARG 87 N 5.51 -0.18 0.00 1.70 1.74 -1.26 0.64 116.66 124.82 1i9r n ARG 87 Ca 0.12 -2.72 -0.12 0.00 -0.77 0.00 0.00 57.85 54.36 1i9r n ARG 87 Cb 0.45 -0.71 0.01 0.00 -1.02 0.00 0.00 32.46 31.20 1i9r n ARG 87 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1i9r h SER 88 N -0.66 0.69 0.00 0.55 4.64 -1.96 -2.88 113.55 113.93 1i9r h SER 88 Ca -0.34 -0.41 0.00 0.00 -0.47 0.00 0.00 61.79 60.57 1i9r h SER 88 Cb 1.23 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1i9r h SER 88 CO 0.36 1.16 0.00 -0.62 -0.87 0.00 0.00 176.83 176.86 1i9r n GLU 89 N -3.92 0.52 0.03 4.77 4.71 -1.26 -2.03 120.64 123.46 1i9r n GLU 89 Ca -0.05 0.00 0.13 0.00 -0.01 0.00 0.00 57.16 57.23 1i9r n GLU 89 Cb 0.67 -1.14 0.36 0.00 -1.01 0.00 0.00 31.44 30.33 1i9r n GLU 89 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1i9r n ASP 90 N -0.64 0.47 -4.74 1.62 8.00 -1.09 -4.88 116.55 115.29 1i9r n ASP 90 Ca 0.03 0.20 -0.41 0.00 0.71 0.00 0.00 54.79 55.32 1i9r n ASP 90 Cb 0.02 -0.16 -0.02 0.00 -0.02 0.00 0.00 41.12 40.93 1i9r n ASP 90 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1i9r s THR 91 N -3.06 2.53 -2.99 -3.53 2.01 -0.86 -4.90 115.64 104.84 1i9r s THR 91 Ca 0.11 0.44 0.00 0.00 0.31 0.00 0.00 61.69 62.55 1i9r s THR 91 Cb 0.16 -3.28 0.00 0.00 0.01 0.00 0.00 72.50 69.39 1i9r s THR 91 CO 0.64 0.07 0.00 0.00 -0.69 0.00 0.00 174.62 174.64 1i9r n ALA 92 N 2.38 0.00 -3.07 7.40 0.00 -0.41 -4.53 120.51 122.28 1i9r n ALA 92 Ca 0.07 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.18 1i9r n ALA 92 Cb 0.40 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.71 1i9r n ALA 92 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1i9r s VAL 93 N -3.00 3.39 -0.24 0.00 1.01 0.35 -0.55 120.40 121.36 1i9r s VAL 93 Ca 0.00 -0.54 -0.08 0.00 0.00 0.00 0.00 61.98 61.36 1i9r s VAL 93 Cb 0.00 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.88 1i9r s VAL 93 CO 0.00 0.50 0.10 -0.31 0.00 0.00 0.00 175.10 175.39 1i9r s TYR 94 N 0.45 3.16 -0.00 5.22 1.51 0.17 -1.03 117.35 126.83 1i9r s TYR 94 Ca -0.07 -0.16 0.01 0.00 -1.01 0.00 0.00 57.07 55.84 1i9r s TYR 94 Cb -0.15 -2.22 -0.04 0.00 -0.11 0.00 0.00 41.96 39.44 1i9r s TYR 94 CO 0.04 -0.17 0.02 0.71 -1.11 0.00 0.00 175.55 175.04 1i9r s TYR 95 N 1.29 3.12 -0.08 2.71 2.02 0.42 0.42 117.35 127.25 1i9r s TYR 95 Ca 0.05 0.11 -0.00 0.00 -0.37 0.00 0.00 57.07 56.86 1i9r s TYR 95 Cb -0.15 -1.69 -0.03 0.00 -0.40 0.00 0.00 41.96 39.70 1i9r s TYR 95 CO 0.04 0.48 -0.05 0.00 -1.57 0.00 0.00 175.55 174.46 1i9r s THR 97 N -0.67 0.02 -0.21 0.00 -1.32 -1.14 -0.82 115.64 111.51 1i9r s THR 97 Ca 0.10 -0.20 -0.28 0.00 -1.21 0.00 0.00 61.69 60.10 1i9r s THR 97 Cb -0.12 -0.62 0.00 0.00 -1.51 0.00 0.00 72.50 70.26 1i9r s THR 97 CO 0.02 -0.11 1.00 -0.60 -2.21 0.00 0.00 174.62 172.72 1i9r s ARG 98 N -0.53 4.28 0.13 7.08 3.00 -0.33 0.32 118.95 132.90 1i9r s ARG 98 Ca -0.06 1.31 -0.15 0.00 -1.00 0.00 0.00 55.73 55.82 1i9r s ARG 98 Cb -0.04 -3.62 -0.07 0.00 0.00 0.00 0.00 34.95 31.23 1i9r s ARG 98 CO 0.03 -0.55 0.55 -1.54 0.00 0.00 0.00 175.30 173.79 1i9r s SER 99 N 1.19 6.86 -0.79 -2.12 1.04 0.32 -1.32 113.70 118.88 1i9r s SER 99 Ca 0.44 1.11 -0.08 0.00 0.48 0.00 0.00 55.95 57.89 1i9r s SER 99 Cb -0.16 -2.30 0.21 0.00 0.10 0.00 0.00 66.02 63.87 1i9r s SER 99 CO 0.09 0.13 0.69 -0.62 0.98 0.00 0.00 173.24 174.51 1i9r s ASP 100 N -1.62 6.19 -0.31 7.02 3.68 0.21 -3.93 116.67 127.91 1i9r s ASP 100 Ca 0.36 -2.96 0.00 0.00 2.13 0.00 0.00 52.55 52.08 1i9r s ASP 100 Cb -0.16 -2.05 0.00 0.00 -1.45 0.00 0.00 42.92 39.26 1i9r s ASP 100 CO 0.19 -0.43 0.00 0.61 0.13 0.00 0.00 175.17 175.67 1i9r n GLY 101 N 3.48 0.41 3.72 2.66 0.00 -1.26 -3.35 105.19 110.86 1i9r n GLY 101 Ca 0.14 -0.83 -0.25 0.00 0.00 0.00 0.00 46.02 45.08 1i9r n GLY 101 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i9r n ARG 102 N -2.03 -6.02 0.00 1.61 1.74 -1.26 -4.89 116.66 105.82 1i9r n ARG 102 Ca -0.04 0.69 0.00 0.00 -0.77 0.00 0.00 57.85 57.73 1i9r n ARG 102 Cb 0.34 -5.53 0.00 0.00 -1.02 0.00 0.00 32.46 26.25 1i9r n ARG 102 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1i9r n ASN 103 N -2.98 0.00 -4.76 0.55 4.13 -1.21 -5.06 115.26 105.94 1i9r n ASN 103 Ca -0.11 0.00 -0.40 0.00 1.68 0.00 0.00 54.58 55.75 1i9r n ASN 103 Cb 0.60 0.00 -0.04 0.00 -1.54 0.00 0.00 39.78 38.80 1i9r n ASN 103 CO 0.00 0.00 0.00 1.51 0.28 0.00 0.00 177.26 179.05 1i9r s ASP 104 N 1.00 7.18 -0.71 6.41 1.47 -1.26 -4.81 116.67 125.96 1i9r s ASP 104 Ca 0.00 2.31 -0.15 0.00 1.18 0.00 0.00 52.55 55.89 1i9r s ASP 104 Cb 0.00 -2.63 0.17 0.00 -0.34 0.00 0.00 42.92 40.13 1i9r s ASP 104 CO 0.00 -0.22 0.68 -0.04 0.68 0.00 0.00 175.17 176.27 1i9r s MET 105 N -1.28 3.34 0.00 2.11 -1.94 -1.26 -0.62 119.30 119.65 1i9r s MET 105 Ca 0.46 -2.07 0.30 0.00 -1.71 0.00 0.00 55.69 52.68 1i9r s MET 105 Cb -0.33 -4.39 1.52 0.00 2.01 0.00 0.00 34.83 33.64 1i9r s MET 105 CO 0.42 -1.35 2.02 -0.40 -0.01 0.00 0.00 175.02 175.70 1i9r n ASP 106 N 4.74 0.41 -3.69 3.03 5.68 -0.43 -4.88 116.55 121.41 1i9r n ASP 106 Ca 0.02 -0.89 -0.11 0.00 -0.50 0.00 0.00 54.79 53.31 1i9r n ASP 106 Cb 0.44 -0.05 -0.10 0.00 -1.14 0.00 0.00 41.12 40.28 1i9r n ASP 106 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1i9r s SER 107 N -2.19 -0.56 0.07 -1.12 0.01 -1.23 -4.97 113.70 103.71 1i9r s SER 107 Ca 0.39 1.01 0.08 0.00 1.31 0.00 0.00 55.95 58.74 1i9r s SER 107 Cb 0.21 0.96 -0.03 0.00 0.21 0.00 0.00 66.02 67.37 1i9r s SER 107 CO 0.40 -0.19 -0.20 0.26 0.41 0.00 0.00 173.24 173.92 1i9r s TRP 108 N 0.85 1.77 1.10 2.43 0.52 -1.26 -1.19 118.94 123.16 1i9r s TRP 108 Ca -0.05 -0.39 -0.17 0.00 0.02 0.00 0.00 56.10 55.51 1i9r s TRP 108 Cb -0.05 -1.01 0.24 0.00 -1.15 0.00 0.00 33.47 31.49 1i9r s TRP 108 CO -0.07 0.14 1.14 0.20 0.02 0.00 0.00 176.95 178.38 1i9r s GLY 109 N -1.53 1.60 0.26 0.98 0.00 0.00 -4.67 107.32 103.97 1i9r s GLY 109 Ca 0.07 -0.83 -0.02 0.00 0.00 0.00 0.00 44.72 43.93 1i9r s GLY 109 CO 0.03 -0.05 1.87 1.46 0.00 0.00 0.00 173.10 176.41 1i9r h GLN 110 N -2.21 1.07 0.00 2.90 7.50 -1.90 -3.44 115.11 119.02 1i9r h GLN 110 Ca -0.47 -0.06 0.00 0.00 0.50 0.00 0.00 58.65 58.61 1i9r h GLN 110 Cb 1.30 -0.24 0.00 0.00 0.05 0.00 0.00 27.48 28.59 1i9r h GLN 110 CO 0.42 0.71 0.00 0.41 -1.50 0.00 0.00 178.83 178.87 1i9r n GLY 111 N -1.35 3.06 3.01 3.46 0.00 -1.26 -5.02 105.19 107.08 1i9r n GLY 111 Ca 0.15 -1.86 -0.24 0.00 0.00 0.00 0.00 46.02 44.07 1i9r n GLY 111 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1i9r s THR 112 N -2.55 1.08 -0.53 2.61 2.01 0.17 -4.83 115.64 113.61 1i9r s THR 112 Ca 0.00 -0.44 -0.22 0.00 0.31 0.00 0.00 61.69 61.34 1i9r s THR 112 Cb 0.00 -1.00 0.05 0.00 0.01 0.00 0.00 72.50 71.56 1i9r s THR 112 CO 0.00 0.34 0.81 -0.22 -0.69 0.00 0.00 174.62 174.86 1i9r s LEU 113 N 0.74 4.44 -0.34 4.42 1.98 -1.26 0.43 118.68 129.08 1i9r s LEU 113 Ca -0.13 -0.54 -0.12 0.00 -2.89 0.00 0.00 54.13 50.45 1i9r s LEU 113 Cb -0.16 -2.69 -0.00 0.00 0.66 0.00 0.00 46.19 44.00 1i9r s LEU 113 CO 0.03 -1.07 0.21 -0.69 -1.89 0.00 0.00 176.35 172.94 1i9r s VAL 114 N 3.40 4.95 -0.22 1.68 1.01 0.29 -1.28 120.40 130.22 1i9r s VAL 114 Ca 0.25 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 61.80 1i9r s VAL 114 Cb -0.15 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.67 1i9r s VAL 114 CO 0.17 -0.06 -0.14 0.28 0.00 0.00 0.00 175.10 175.35 1i9r s THR 115 N 1.66 2.32 -0.32 3.92 -1.32 -0.17 -1.29 115.64 120.43 1i9r s THR 115 Ca 0.05 -1.14 -0.06 0.00 -1.21 0.00 0.00 61.69 59.33 1i9r s THR 115 Cb -0.18 -2.14 0.03 0.00 -1.51 0.00 0.00 72.50 68.71 1i9r s THR 115 CO 0.08 0.30 0.07 0.68 -2.21 0.00 0.00 174.62 173.55 1i9r s VAL 116 N 1.25 3.65 0.05 5.08 -7.23 -1.25 -1.41 120.40 120.54 1i9r s VAL 116 Ca -0.00 -1.08 -0.08 0.00 -1.81 0.00 0.00 61.98 59.01 1i9r s VAL 116 Cb -0.16 -3.02 -0.00 0.00 0.56 0.00 0.00 36.38 33.76 1i9r s VAL 116 CO -0.08 -0.10 0.16 -0.94 -0.31 0.00 0.00 175.10 173.83 1i9r s SER 117 N 1.39 0.11 0.18 4.85 1.04 0.23 -4.53 113.70 116.97 1i9r s SER 117 Ca -0.01 -0.51 0.10 0.00 0.48 0.00 0.00 55.95 56.01 1i9r s SER 117 Cb -0.19 0.28 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 1i9r s SER 117 CO 0.02 -0.59 1.38 0.77 0.98 0.00 0.00 173.24 175.79 1i9r h SER 118 N 3.30 0.00 -2.18 7.02 4.64 -1.94 -3.29 113.55 121.10 1i9r h SER 118 Ca -0.33 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.51 1i9r h SER 118 Cb 1.19 0.00 0.24 0.00 -0.31 0.00 0.00 62.40 63.52 1i9r h SER 118 CO 0.52 0.83 -1.45 0.00 -0.87 0.00 0.00 176.83 175.86 1i9r n ALA 119 N -2.33 -4.39 -3.14 5.18 0.00 -1.26 -5.00 120.51 109.56 1i9r n ALA 119 Ca 0.00 -1.14 -0.13 0.00 0.00 0.00 0.00 53.44 52.17 1i9r n ALA 119 Cb 0.84 -1.37 -0.15 0.00 0.00 0.00 0.00 19.45 18.77 1i9r n ALA 119 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1i9r s SER 120 N -1.60 0.03 0.02 0.00 0.01 -1.26 -4.98 113.70 105.93 1i9r s SER 120 Ca 0.50 0.01 -0.02 0.00 1.31 0.00 0.00 55.95 57.75 1i9r s SER 120 Cb -0.09 -0.02 -0.01 0.00 0.21 0.00 0.00 66.02 66.10 1i9r s SER 120 CO 0.68 -0.04 0.03 0.41 0.41 0.00 0.00 173.24 174.73 1i9r n THR 121 N 3.41 0.12 -3.64 1.44 -1.04 -1.25 -4.81 114.28 108.51 1i9r n THR 121 Ca -0.17 -0.04 -0.05 0.00 -2.04 0.00 0.00 64.05 61.76 1i9r n THR 121 Cb 0.57 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 69.02 1i9r n THR 121 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1i9r s LYS 122 N -0.08 0.19 0.85 -2.82 2.20 -0.56 -4.90 119.74 114.62 1i9r s LYS 122 Ca 0.05 0.15 -0.12 0.00 -0.36 0.00 0.00 55.97 55.70 1i9r s LYS 122 Cb -0.07 0.09 0.10 0.00 -1.51 0.00 0.00 37.83 36.44 1i9r s LYS 122 CO 0.05 -0.04 1.10 0.20 -0.36 0.00 0.00 175.35 176.30 1i9r s GLY 123 N -0.33 1.62 0.44 5.54 0.00 -1.26 -1.86 107.32 111.47 1i9r s GLY 123 Ca 0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 44.72 44.59 1i9r s GLY 123 CO -0.10 0.29 0.61 -1.55 0.00 0.00 0.00 173.10 172.35 1i9r n PRO 124 N -3.64 -0.06 -4.74 2.90 -0.04 -1.26 -4.19 135.00 123.96 1i9r n PRO 124 Ca 0.07 -1.40 -0.27 0.00 -0.04 0.00 0.00 63.50 61.86 1i9r n PRO 124 Cb 0.56 -0.48 -0.14 0.00 -0.04 0.00 0.00 33.50 33.39 1i9r n PRO 124 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1i9r s SER 125 N -3.38 2.71 -0.02 3.54 0.01 0.36 -4.90 113.70 112.02 1i9r s SER 125 Ca 0.38 -0.54 0.07 0.00 1.31 0.00 0.00 55.95 57.17 1i9r s SER 125 Cb -0.02 -0.24 -0.02 0.00 0.21 0.00 0.00 66.02 65.96 1i9r s SER 125 CO 0.26 0.20 -0.23 0.68 0.41 0.00 0.00 173.24 174.55 1i9r s VAL 126 N -0.79 1.84 -0.02 3.43 -7.23 -1.24 0.24 120.40 116.62 1i9r s VAL 126 Ca 0.09 -1.00 0.00 0.00 -1.81 0.00 0.00 61.98 59.26 1i9r s VAL 126 Cb -0.09 -1.53 0.03 0.00 0.56 0.00 0.00 36.38 35.34 1i9r s VAL 126 CO 0.02 0.52 0.01 -0.36 -0.31 0.00 0.00 175.10 174.98 1i9r s PHE 127 N -0.55 0.17 0.48 2.82 0.08 0.37 -4.90 117.98 116.45 1i9r s PHE 127 Ca 0.09 0.06 -0.23 0.00 0.12 0.00 0.00 56.93 56.97 1i9r s PHE 127 Cb -0.09 -0.31 -0.07 0.00 -0.57 0.00 0.00 43.02 41.98 1i9r s PHE 127 CO -0.01 -0.10 1.26 -1.25 -0.10 0.00 0.00 175.22 175.02 1i9r s PRO 128 N 0.98 3.60 -0.73 0.24 0.04 -1.26 -0.73 135.00 137.13 1i9r s PRO 128 Ca -0.09 2.00 0.04 0.00 0.04 0.00 0.00 61.00 62.99 1i9r s PRO 128 Cb -0.13 -2.43 0.20 0.00 0.04 0.00 0.00 34.50 32.19 1i9r s PRO 128 CO -0.02 -0.75 0.65 1.28 0.04 0.00 0.00 177.00 178.20 1i9r n LEU 129 N -0.54 3.55 -4.76 -3.56 4.77 0.28 -4.81 117.00 111.92 1i9r n LEU 129 Ca 0.08 -5.27 -0.40 0.00 -0.03 0.00 0.00 56.01 50.39 1i9r n LEU 129 Cb 0.46 -0.81 -0.04 0.00 -2.33 0.00 0.00 43.42 40.71 1i9r n LEU 129 CO 0.51 1.81 0.82 0.00 -1.33 0.00 0.00 177.39 179.19 1i9r s ALA 130 N -1.79 3.36 0.74 -1.18 0.00 -1.26 -1.43 121.76 120.20 1i9r s ALA 130 Ca 0.30 0.93 -0.16 0.00 0.00 0.00 0.00 51.96 53.04 1i9r s ALA 130 Cb 0.01 -3.35 0.02 0.00 0.00 0.00 0.00 23.12 19.80 1i9r s ALA 130 CO -0.11 -0.26 1.01 -0.35 0.00 0.00 0.00 175.76 176.05 1i9r n PRO 131 N 0.91 0.47 -3.60 0.00 -0.04 -1.26 -4.80 135.00 126.69 1i9r n PRO 131 Ca 0.00 0.22 -0.04 0.00 -0.04 0.00 0.00 63.50 63.64 1i9r n PRO 131 Cb 0.45 -2.27 -0.02 0.00 -0.04 0.00 0.00 33.50 31.63 1i9r n PRO 131 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1i9r s SER 132 N -1.71 -0.21 0.43 3.54 1.04 -1.26 -4.06 113.70 111.47 1i9r s SER 132 Ca 0.73 -0.11 0.23 0.00 0.48 0.00 0.00 55.95 57.28 1i9r s SER 132 Cb -0.34 0.30 1.22 0.00 0.10 0.00 0.00 66.02 67.31 1i9r s SER 132 CO 0.50 -0.52 1.77 0.77 0.98 0.00 0.00 173.24 176.74 1i9r h SER 133 N 2.00 0.34 0.19 7.02 4.64 -1.95 1.53 113.55 127.32 1i9r h SER 133 Ca -0.21 0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.18 1i9r h SER 133 Cb 1.21 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1i9r h SER 133 CO 0.27 0.05 0.00 0.29 -0.87 0.00 0.00 176.83 176.57 1i9r n LYS 134 N -4.54 0.35 -1.99 4.77 5.02 -1.26 -2.64 118.16 117.87 1i9r n LYS 134 Ca 0.26 0.08 0.01 0.00 -2.02 0.00 0.00 58.31 56.64 1i9r n LYS 134 Cb 0.99 -1.50 0.05 0.00 -0.02 0.00 0.00 35.03 34.54 1i9r n LYS 134 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1i9r n SER 135 N -1.18 1.55 -3.45 4.39 3.41 0.52 -4.98 113.62 113.89 1i9r n SER 135 Ca 0.10 -2.28 -0.26 0.00 -0.26 0.00 0.00 58.87 56.16 1i9r n SER 135 Cb 0.10 -0.39 -0.09 0.00 -0.26 0.00 0.00 64.21 63.57 1i9r n SER 135 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 1i9r n THR 136 N -0.14 0.00 -2.39 6.66 -1.04 -1.00 -0.44 114.28 115.92 1i9r n THR 136 Ca 0.10 -4.13 -0.41 0.00 -2.04 0.00 0.00 64.05 57.57 1i9r n THR 136 Cb 0.96 -1.90 -0.03 0.00 -1.82 0.00 0.00 70.33 67.53 1i9r n THR 136 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1i9r s SER 137 N -0.94 7.10 0.44 8.00 0.01 -0.87 -4.81 113.70 122.62 1i9r s SER 137 Ca 0.33 2.18 0.00 0.00 1.31 0.00 0.00 55.95 59.77 1i9r s SER 137 Cb 0.07 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1i9r s SER 137 CO -0.14 -0.38 0.00 0.61 0.41 0.00 0.00 173.24 173.73 1i9r n GLY 138 N 2.40 0.98 0.00 3.44 0.00 -1.26 -1.43 105.19 109.33 1i9r n GLY 138 Ca 0.05 -0.58 0.08 0.00 0.00 0.00 0.00 46.02 45.57 1i9r n GLY 138 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i9r n GLY 139 N 0.00 -0.81 3.79 -0.02 0.00 -1.26 -4.79 105.19 102.10 1i9r n GLY 139 Ca 0.00 -0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.62 1i9r n GLY 139 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1i9r s THR 140 N -2.57 4.75 0.04 2.61 -4.23 -0.51 -0.39 115.64 115.32 1i9r s THR 140 Ca 0.15 -0.42 0.07 0.00 -1.18 0.00 0.00 61.69 60.31 1i9r s THR 140 Cb 0.11 -3.18 -0.03 0.00 1.34 0.00 0.00 72.50 70.73 1i9r s THR 140 CO 0.24 0.33 -0.19 0.00 -0.54 0.00 0.00 174.62 174.46 1i9r s ALA 141 N -1.22 2.54 0.03 3.99 0.00 0.58 -2.06 121.76 125.63 1i9r s ALA 141 Ca 0.24 -1.19 0.02 0.00 0.00 0.00 0.00 51.96 51.03 1i9r s ALA 141 Cb -0.12 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.25 1i9r s ALA 141 CO 0.15 0.56 0.03 0.00 0.00 0.00 0.00 175.76 176.50 1i9r s ALA 142 N -0.89 3.38 -0.05 0.00 0.00 0.41 -1.10 121.76 123.52 1i9r s ALA 142 Ca 0.14 -0.99 -0.29 0.00 0.00 0.00 0.00 51.96 50.82 1i9r s ALA 142 Cb -0.10 -1.36 0.10 0.00 0.00 0.00 0.00 23.12 21.76 1i9r s ALA 142 CO 0.04 0.69 0.87 -0.48 0.00 0.00 0.00 175.76 176.88 1i9r s LEU 143 N -1.91 -0.42 0.00 0.00 -0.00 -0.15 -3.98 118.68 112.22 1i9r s LEU 143 Ca 0.23 0.22 0.00 0.00 -0.00 0.00 0.00 54.13 54.58 1i9r s LEU 143 Cb -0.12 2.09 0.00 0.00 -0.00 0.00 0.00 46.19 48.16 1i9r s LEU 143 CO 0.15 -0.56 0.00 0.61 -0.00 0.00 0.00 176.35 176.55 1i9r n GLY 144 N 0.20 -1.35 3.67 -3.48 0.00 -0.51 -0.02 105.19 103.70 1i9r n GLY 144 Ca -0.11 -1.03 -0.33 0.00 0.00 0.00 0.00 46.02 44.55 1i9r n GLY 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i9r s LEU 146 N -1.50 5.03 -0.93 0.00 2.96 0.09 -0.45 118.68 123.88 1i9r s LEU 146 Ca 0.19 -1.36 -0.18 0.00 -0.22 0.00 0.00 54.13 52.56 1i9r s LEU 146 Cb -0.11 -2.00 0.15 0.00 0.50 0.00 0.00 46.19 44.73 1i9r s LEU 146 CO 0.09 -0.50 1.09 -0.69 -1.32 0.00 0.00 176.35 175.03 1i9r s VAL 147 N 1.46 4.88 0.22 1.68 1.01 0.30 -0.48 120.40 129.48 1i9r s VAL 147 Ca 0.02 -1.78 -0.10 0.00 0.00 0.00 0.00 61.98 60.12 1i9r s VAL 147 Cb -0.22 -4.74 -0.07 0.00 0.00 0.00 0.00 36.38 31.35 1i9r s VAL 147 CO 0.03 -1.44 0.56 -0.54 0.00 0.00 0.00 175.10 173.71 1i9r s LYS 148 N 2.23 3.83 0.00 2.72 -0.14 0.64 -2.26 119.74 126.76 1i9r s LYS 148 Ca 0.31 0.32 0.00 0.00 -1.36 0.00 0.00 55.97 55.24 1i9r s LYS 148 Cb -0.05 -2.68 0.00 0.00 -1.68 0.00 0.00 37.83 33.42 1i9r s LYS 148 CO -0.09 0.33 0.00 -0.25 -0.76 0.00 0.00 175.35 174.58 1i9r n ASP 149 N -0.02 -5.05 -3.86 2.83 8.00 -0.75 0.14 116.55 117.84 1i9r n ASP 149 Ca -0.00 0.41 -0.12 0.00 0.71 0.00 0.00 54.79 55.78 1i9r n ASP 149 Cb 0.52 -1.15 -0.07 0.00 -0.02 0.00 0.00 41.12 40.40 1i9r n ASP 149 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1i9r s TYR 150 N -0.54 0.87 -0.29 1.24 -0.00 -1.11 -4.13 117.35 113.39 1i9r s TYR 150 Ca 0.00 -1.13 -0.21 0.00 -0.00 0.00 0.00 57.07 55.73 1i9r s TYR 150 Cb 0.00 -0.18 0.15 0.00 -0.00 0.00 0.00 41.96 41.93 1i9r s TYR 150 CO 0.00 -0.90 1.12 0.12 -0.00 0.00 0.00 175.55 175.89 1i9r s PHE 151 N -3.82 -0.38 0.48 -3.49 2.19 -0.78 -1.35 117.98 110.83 1i9r s PHE 151 Ca 0.31 0.85 0.03 0.00 0.33 0.00 0.00 56.93 58.45 1i9r s PHE 151 Cb 0.02 0.34 0.09 0.00 -1.31 0.00 0.00 43.02 42.17 1i9r s PHE 151 CO 0.14 -0.19 0.66 -0.35 1.83 0.00 0.00 175.22 177.31 1i9r n PRO 152 N 2.69 0.34 -0.77 10.12 -0.04 -1.26 -1.50 135.00 144.58 1i9r n PRO 152 Ca -0.15 -2.06 -0.29 0.00 -0.04 0.00 0.00 63.50 60.96 1i9r n PRO 152 Cb 0.57 -0.36 0.20 0.00 -0.04 0.00 0.00 33.50 33.87 1i9r n PRO 152 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1i9r s GLU 153 N -4.16 0.10 0.18 0.54 0.41 -1.26 -4.73 118.70 109.78 1i9r s GLU 153 Ca 0.46 0.99 0.07 0.00 -0.41 0.00 0.00 54.97 56.07 1i9r s GLU 153 Cb -0.03 -1.66 -0.04 0.00 -1.78 0.00 0.00 34.13 30.62 1i9r s GLU 153 CO 0.30 -3.08 0.06 -1.25 -0.49 0.00 0.00 175.26 170.80 1i9r s PRO 154 N -4.64 2.61 -0.27 0.39 0.04 -1.26 -4.93 135.00 126.94 1i9r s PRO 154 Ca 0.67 -1.04 0.00 0.00 0.04 0.00 0.00 61.00 60.67 1i9r s PRO 154 Cb -0.22 -2.46 0.05 0.00 0.04 0.00 0.00 34.50 31.91 1i9r s PRO 154 CO 0.61 0.45 -0.06 0.54 0.04 0.00 0.00 177.00 178.58 1i9r s VAL 155 N -1.81 2.58 0.23 -0.36 0.11 -1.26 -4.51 120.40 115.38 1i9r s VAL 155 Ca 0.29 -1.43 -0.22 0.00 -2.93 0.00 0.00 61.98 57.69 1i9r s VAL 155 Cb -0.09 -2.46 -0.09 0.00 -1.53 0.00 0.00 36.38 32.21 1i9r s VAL 155 CO 0.21 -0.01 0.78 0.28 -3.33 0.00 0.00 175.10 173.03 1i9r s THR 156 N 1.20 4.46 -0.07 5.04 -1.32 -0.60 -4.87 115.64 119.47 1i9r s THR 156 Ca -0.06 1.47 0.01 0.00 -1.21 0.00 0.00 61.69 61.91 1i9r s THR 156 Cb -0.19 -3.94 0.02 0.00 -1.51 0.00 0.00 72.50 66.87 1i9r s THR 156 CO -0.04 0.25 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.85 1i9r s VAL 157 N -1.47 0.90 0.10 5.08 1.01 -1.26 -0.67 120.40 124.09 1i9r s VAL 157 Ca 0.43 -0.31 0.04 0.00 0.00 0.00 0.00 61.98 62.14 1i9r s VAL 157 Cb -0.18 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 1i9r s VAL 157 CO 0.22 0.31 -0.11 -0.55 0.00 0.00 0.00 175.10 174.98 1i9r s SER 158 N 0.97 1.54 -0.08 3.32 0.15 -0.97 -4.92 113.70 113.71 1i9r s SER 158 Ca -0.09 -0.80 -0.00 0.00 0.70 0.00 0.00 55.95 55.75 1i9r s SER 158 Cb -0.15 -0.01 -0.03 0.00 -1.71 0.00 0.00 66.02 64.13 1i9r s SER 158 CO 0.00 -0.23 -0.04 0.26 1.20 0.00 0.00 173.24 174.43 1i9r s TRP 159 N -2.32 3.04 -1.02 3.44 0.52 -1.26 0.24 118.94 121.58 1i9r s TRP 159 Ca 0.05 0.10 -0.29 0.00 0.02 0.00 0.00 56.10 55.99 1i9r s TRP 159 Cb -0.04 -1.75 0.04 0.00 -1.15 0.00 0.00 33.47 30.58 1i9r s TRP 159 CO 0.01 0.40 0.57 0.09 0.02 0.00 0.00 176.95 178.03 1i9r n ASN 160 N 2.18 -3.48 -3.26 2.95 3.02 0.10 -0.78 115.26 115.99 1i9r n ASN 160 Ca -0.18 -1.10 -0.08 0.00 -0.03 0.00 0.00 54.58 53.18 1i9r n ASN 160 Cb 0.53 -1.34 0.00 0.00 -0.61 0.00 0.00 39.78 38.37 1i9r n ASN 160 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1i9r n SER 161 N -1.67 -1.06 0.00 6.41 7.64 -1.26 -0.92 113.62 122.75 1i9r n SER 161 Ca -0.10 -0.27 0.00 0.00 1.01 0.00 0.00 58.87 59.51 1i9r n SER 161 Cb 0.48 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1i9r n SER 161 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1i9r n GLY 162 N -0.97 2.28 0.31 0.23 0.00 0.04 -4.82 105.19 102.26 1i9r n GLY 162 Ca -0.05 -0.42 0.12 0.00 0.00 0.00 0.00 46.02 45.67 1i9r n GLY 162 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i9r n ALA 163 N 0.00 0.43 -2.64 4.61 0.00 -0.10 -3.78 120.51 119.02 1i9r n ALA 163 Ca 0.00 0.96 -0.43 0.00 0.00 0.00 0.00 53.44 53.97 1i9r n ALA 163 Cb 0.00 -0.69 -0.05 0.00 0.00 0.00 0.00 19.45 18.72 1i9r n ALA 163 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1i9r s LEU 164 N -10.63 4.29 -0.00 0.00 2.96 -1.15 -4.77 118.68 109.37 1i9r s LEU 164 Ca -0.12 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 53.41 1i9r s LEU 164 Cb 0.26 -2.80 0.01 0.00 0.50 0.00 0.00 46.19 44.16 1i9r s LEU 164 CO 0.69 -1.09 0.82 0.35 -1.32 0.00 0.00 176.35 175.81 1i9r n THR 165 N 6.08 0.08 -4.77 3.68 -2.24 -1.25 -4.13 114.28 111.74 1i9r n THR 165 Ca 0.00 -0.09 -0.33 0.00 -2.27 0.00 0.00 64.05 61.36 1i9r n THR 165 Cb 0.47 0.66 -0.15 0.00 -2.10 0.00 0.00 70.33 69.21 1i9r n THR 165 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1i9r s SER 166 N -0.70 3.81 0.00 3.42 0.15 -1.26 -4.49 113.70 114.64 1i9r s SER 166 Ca 0.01 -0.39 0.00 0.00 0.70 0.00 0.00 55.95 56.27 1i9r s SER 166 Cb 0.01 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.74 1i9r s SER 166 CO 0.00 0.14 0.00 0.61 1.20 0.00 0.00 173.24 175.19 1i9r n GLY 167 N 3.66 1.14 3.76 9.45 0.00 -1.26 -4.71 105.19 117.24 1i9r n GLY 167 Ca -0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 1i9r n GLY 167 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i9r s VAL 168 N -3.14 3.83 -0.32 1.61 1.01 -1.26 -2.76 120.40 119.38 1i9r s VAL 168 Ca 0.00 1.71 -0.02 0.00 0.00 0.00 0.00 61.98 63.68 1i9r s VAL 168 Cb 0.00 -4.04 0.12 0.00 0.00 0.00 0.00 36.38 32.46 1i9r s VAL 168 CO 0.00 0.31 0.20 -1.00 0.00 0.00 0.00 175.10 174.61 1i9r s HIS 169 N -1.33 0.29 -0.42 5.22 3.76 0.21 -4.96 115.29 118.06 1i9r s HIS 169 Ca 0.46 -1.02 -0.15 0.00 -0.15 0.00 0.00 55.06 54.21 1i9r s HIS 169 Cb -0.26 -0.80 0.04 0.00 1.11 0.00 0.00 32.58 32.66 1i9r s HIS 169 CO 0.33 -0.85 0.32 -0.08 -0.85 0.00 0.00 174.74 173.61 1i9r s THR 170 N 1.75 5.18 0.89 1.30 -1.32 -1.26 -1.09 115.64 121.09 1i9r s THR 170 Ca 0.13 -0.80 -0.11 0.00 -1.21 0.00 0.00 61.69 59.69 1i9r s THR 170 Cb -0.18 -3.95 0.12 0.00 -1.51 0.00 0.00 72.50 66.98 1i9r s THR 170 CO -0.22 -0.38 1.12 0.49 -2.21 0.00 0.00 174.62 173.42 1i9r n PHE 171 N 5.15 0.84 -2.41 9.09 3.01 -0.86 -4.97 117.46 127.31 1i9r n PHE 171 Ca -0.11 0.39 -0.34 0.00 1.01 0.00 0.00 57.45 58.40 1i9r n PHE 171 Cb 0.46 -2.02 -0.02 0.00 -0.01 0.00 0.00 39.48 37.89 1i9r n PHE 171 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1i9r s PRO 172 N -4.41 3.62 0.63 -1.08 0.04 -1.26 -4.64 135.00 127.90 1i9r s PRO 172 Ca 0.68 1.43 -0.17 0.00 0.04 0.00 0.00 61.00 62.98 1i9r s PRO 172 Cb -0.25 -2.06 -0.02 0.00 0.04 0.00 0.00 34.50 32.22 1i9r s PRO 172 CO 0.56 -0.60 1.17 0.00 0.04 0.00 0.00 177.00 178.18 1i9r s ALA 173 N -1.95 2.46 -0.12 8.56 0.00 -1.26 -4.77 121.76 124.69 1i9r s ALA 173 Ca 0.69 0.83 -0.04 0.00 0.00 0.00 0.00 51.96 53.44 1i9r s ALA 173 Cb -0.19 -3.41 0.05 0.00 0.00 0.00 0.00 23.12 19.58 1i9r s ALA 173 CO 0.23 -1.27 0.11 0.08 0.00 0.00 0.00 175.76 174.92 1i9r s VAL 174 N -1.89 -0.16 -0.59 0.00 1.01 -1.25 -4.96 120.40 112.54 1i9r s VAL 174 Ca 0.73 0.14 -0.26 0.00 0.00 0.00 0.00 61.98 62.59 1i9r s VAL 174 Cb -0.26 -0.40 -0.08 0.00 0.00 0.00 0.00 36.38 35.64 1i9r s VAL 174 CO 0.37 -0.04 2.31 -0.22 0.00 0.00 0.00 175.10 177.52 1i9r s LEU 175 N 2.21 3.26 1.05 3.92 2.96 -1.26 -2.77 118.68 128.04 1i9r s LEU 175 Ca 0.04 0.66 -0.14 0.00 -0.22 0.00 0.00 54.13 54.47 1i9r s LEU 175 Cb -0.14 -2.52 0.21 0.00 0.50 0.00 0.00 46.19 44.25 1i9r s LEU 175 CO -0.07 -3.02 1.10 0.00 -1.32 0.00 0.00 176.35 173.04 1i9r s GLN 176 N 8.17 0.02 0.00 1.98 -2.07 -0.98 -4.99 119.66 121.78 1i9r s GLN 176 Ca 0.91 0.33 0.00 0.00 -1.82 0.00 0.00 55.36 54.78 1i9r s GLN 176 Cb -0.15 -1.71 0.00 0.00 -1.09 0.00 0.00 33.01 30.07 1i9r s GLN 176 CO 0.20 -2.97 0.00 0.45 -1.32 0.00 0.00 175.29 171.65 1i9r n SER 177 N -4.31 -0.99 -0.50 12.60 2.88 -1.26 -4.46 113.62 117.57 1i9r n SER 177 Ca 0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.61 1i9r n SER 177 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 1i9r n SER 177 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1i9r n SER 178 N -1.49 -4.40 -0.00 -3.46 3.41 -1.26 -4.22 113.62 102.19 1i9r n SER 178 Ca 0.00 0.00 0.06 0.00 -0.26 0.00 0.00 58.87 58.67 1i9r n SER 178 Cb 0.00 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 63.87 1i9r n SER 178 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i9r n GLY 179 N 0.00 -0.28 3.93 5.00 0.00 -1.26 -5.05 105.19 107.54 1i9r n GLY 179 Ca 0.00 -0.34 -0.25 0.00 0.00 0.00 0.00 46.02 45.43 1i9r n GLY 179 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1i9r s LEU 180 N -2.92 3.76 0.39 0.99 1.02 -1.26 -4.84 118.68 115.82 1i9r s LEU 180 Ca 0.02 0.59 -0.03 0.00 0.02 0.00 0.00 54.13 54.73 1i9r s LEU 180 Cb 0.09 -3.48 -0.04 0.00 0.02 0.00 0.00 46.19 42.78 1i9r s LEU 180 CO 0.52 -0.52 0.64 -0.31 0.02 0.00 0.00 176.35 176.70 1i9r s TYR 181 N -2.55 3.52 -0.27 0.29 2.02 -0.46 -2.33 117.35 117.57 1i9r s TYR 181 Ca 0.45 0.59 -0.00 0.00 -0.37 0.00 0.00 57.07 57.73 1i9r s TYR 181 Cb -0.10 -2.09 0.16 0.00 -0.40 0.00 0.00 41.96 39.53 1i9r s TYR 181 CO 0.40 -0.02 0.45 0.45 -1.57 0.00 0.00 175.55 175.25 1i9r s SER 182 N -3.90 -0.20 0.17 2.29 0.15 -1.12 -1.80 113.70 109.29 1i9r s SER 182 Ca 0.44 0.15 0.08 0.00 0.70 0.00 0.00 55.95 57.31 1i9r s SER 182 Cb -0.10 1.40 -0.04 0.00 -1.71 0.00 0.00 66.02 65.57 1i9r s SER 182 CO 0.38 -0.31 -0.07 -1.48 1.20 0.00 0.00 173.24 172.96 1i9r s LEU 183 N 2.63 3.07 -0.09 3.45 0.05 -0.96 -3.88 118.68 122.94 1i9r s LEU 183 Ca 0.13 -0.50 0.04 0.00 0.05 0.00 0.00 54.13 53.85 1i9r s LEU 183 Cb -0.14 -1.76 0.00 0.00 -2.05 0.00 0.00 46.19 42.24 1i9r s LEU 183 CO -0.22 0.11 -0.22 -0.55 -0.55 0.00 0.00 176.35 174.92 1i9r s SER 184 N -2.75 2.84 -0.21 1.48 0.15 -1.26 -0.54 113.70 113.41 1i9r s SER 184 Ca 0.25 -0.51 -0.07 0.00 0.70 0.00 0.00 55.95 56.31 1i9r s SER 184 Cb -0.09 -1.30 -0.04 0.00 -1.71 0.00 0.00 66.02 62.88 1i9r s SER 184 CO 0.16 0.13 0.07 -0.55 1.20 0.00 0.00 173.24 174.25 1i9r s SER 185 N 0.42 5.44 0.17 5.45 0.15 0.40 -2.02 113.70 123.70 1i9r s SER 185 Ca -0.18 -0.04 0.06 0.00 0.70 0.00 0.00 55.95 56.49 1i9r s SER 185 Cb -0.18 -1.95 -0.04 0.00 -1.71 0.00 0.00 66.02 62.14 1i9r s SER 185 CO 0.08 0.08 -0.14 -0.69 1.20 0.00 0.00 173.24 173.77 1i9r s VAL 186 N 0.95 1.50 -0.08 4.45 1.01 -0.25 -0.06 120.40 127.91 1i9r s VAL 186 Ca 0.04 -2.02 -0.13 0.00 0.00 0.00 0.00 61.98 59.87 1i9r s VAL 186 Cb -0.14 -1.85 0.03 0.00 0.00 0.00 0.00 36.38 34.43 1i9r s VAL 186 CO 0.03 -0.57 0.33 0.54 0.00 0.00 0.00 175.10 175.44 1i9r s VAL 187 N -2.77 0.02 -0.14 2.92 0.11 0.97 0.66 120.40 122.18 1i9r s VAL 187 Ca 0.17 -0.19 -0.02 0.00 -2.93 0.00 0.00 61.98 59.01 1i9r s VAL 187 Cb -0.01 -0.54 -0.03 0.00 -1.53 0.00 0.00 36.38 34.27 1i9r s VAL 187 CO 0.04 -0.10 -0.06 0.42 -3.33 0.00 0.00 175.10 172.07 1i9r s THR 188 N -0.42 3.69 0.19 5.04 -4.23 -1.11 -0.97 115.64 117.82 1i9r s THR 188 Ca -0.05 -0.44 0.04 0.00 -1.18 0.00 0.00 61.69 60.06 1i9r s THR 188 Cb -0.04 -2.59 -0.05 0.00 1.34 0.00 0.00 72.50 71.17 1i9r s THR 188 CO 0.02 0.52 -0.05 0.68 -0.54 0.00 0.00 174.62 175.25 1i9r s VAL 189 N 0.19 1.04 0.34 2.29 -7.23 -0.26 -4.70 120.40 112.07 1i9r s VAL 189 Ca -0.03 -2.04 -0.29 0.00 -1.81 0.00 0.00 61.98 57.81 1i9r s VAL 189 Cb -0.14 -2.09 -0.11 0.00 0.56 0.00 0.00 36.38 34.60 1i9r s VAL 189 CO 0.03 -0.53 1.39 -2.84 -0.31 0.00 0.00 175.10 172.84 1i9r s PRO 190 N -3.82 4.26 0.09 4.82 0.02 -1.26 -0.31 135.00 138.80 1i9r s PRO 190 Ca 0.23 2.35 -0.27 0.00 0.02 0.00 0.00 61.00 63.33 1i9r s PRO 190 Cb 0.04 -3.04 -0.15 0.00 0.02 0.00 0.00 34.50 31.37 1i9r s PRO 190 CO 0.04 -0.33 1.69 1.03 -0.33 0.00 0.00 177.00 179.10 1i9r h SER 191 N 3.45 -0.35 0.00 2.53 0.87 -1.00 -1.78 113.55 117.27 1i9r h SER 191 Ca -0.49 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1i9r h SER 191 Cb 1.23 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.29 1i9r h SER 191 CO 0.66 -0.23 0.43 -1.54 -0.53 0.00 0.00 176.83 175.63 1i9r n SER 192 N -5.26 0.21 -0.01 6.23 3.41 -1.26 -1.08 113.62 115.86 1i9r n SER 192 Ca -0.09 0.43 -0.16 0.00 -0.26 0.00 0.00 58.87 58.79 1i9r n SER 192 Cb 0.18 -0.32 -0.12 0.00 -0.26 0.00 0.00 64.21 63.68 1i9r n SER 192 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1i9r h SER 193 N 0.00 0.31 -0.68 4.04 4.64 -1.68 -3.35 113.55 116.82 1i9r h SER 193 Ca 0.00 -0.83 0.20 0.00 -0.47 0.00 0.00 61.79 60.68 1i9r h SER 193 Cb 0.86 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.83 1i9r h SER 193 CO 0.00 1.11 0.60 0.18 -0.87 0.00 0.00 176.83 177.84 1i9r n LEU 194 N -4.39 0.00 -0.04 5.97 4.77 -0.24 -0.85 117.00 122.23 1i9r n LEU 194 Ca -0.11 0.40 -0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1i9r n LEU 194 Cb 0.60 -0.17 -0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1i9r n LEU 194 CO 0.42 -0.40 -0.00 1.23 -1.33 0.00 0.00 177.39 177.31 1i9r h GLY 195 N 0.00 0.00 2.00 -0.72 0.00 -1.79 -3.38 103.07 99.18 1i9r h GLY 195 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.65 1i9r h GLY 195 CO -0.00 0.00 0.00 -0.91 0.00 0.00 0.00 176.54 175.63 1i9r h THR 196 N -0.73 0.00 -3.57 4.70 1.35 -1.22 -3.45 112.91 109.98 1i9r h THR 196 Ca 0.00 -0.79 -0.67 0.00 -0.55 0.00 0.00 66.41 64.40 1i9r h THR 196 Cb 0.00 1.77 -0.17 0.00 -1.73 0.00 0.00 68.15 68.03 1i9r h THR 196 CO 0.00 0.00 -0.69 -1.10 -0.25 0.00 0.00 175.52 173.48 1i9r s GLN 197 N -3.30 2.62 0.24 4.72 -1.52 -0.21 -5.13 119.66 117.09 1i9r s GLN 197 Ca 0.06 -0.68 0.09 0.00 -1.95 0.00 0.00 55.36 52.88 1i9r s GLN 197 Cb 0.07 -2.55 -0.04 0.00 -0.22 0.00 0.00 33.01 30.27 1i9r s GLN 197 CO 0.62 0.61 -0.01 -0.08 -0.25 0.00 0.00 175.29 176.18 1i9r s THR 198 N -0.99 3.47 -0.06 -0.19 -1.32 -1.26 -4.53 115.64 110.76 1i9r s THR 198 Ca 0.17 -1.80 -0.04 0.00 -1.21 0.00 0.00 61.69 58.81 1i9r s THR 198 Cb -0.11 -2.82 0.03 0.00 -1.51 0.00 0.00 72.50 68.08 1i9r s THR 198 CO 0.07 -0.30 0.14 -0.31 -2.21 0.00 0.00 174.62 172.01 1i9r s TYR 199 N -2.15 -0.16 -0.00 9.09 2.02 -1.26 -5.02 117.35 119.87 1i9r s TYR 199 Ca 0.30 0.42 0.02 0.00 -0.37 0.00 0.00 57.07 57.45 1i9r s TYR 199 Cb -0.07 -0.02 -0.01 0.00 -0.40 0.00 0.00 41.96 41.46 1i9r s TYR 199 CO 0.19 -0.12 -0.07 0.42 -1.57 0.00 0.00 175.55 174.40 1i9r s ILE 200 N 0.65 0.58 0.06 2.71 -1.09 -1.26 -0.33 121.20 122.51 1i9r s ILE 200 Ca -0.05 -0.37 0.01 0.00 -2.23 0.00 0.00 60.65 58.01 1i9r s ILE 200 Cb -0.06 -0.50 -0.04 0.00 -1.58 0.00 0.00 42.46 40.27 1i9r s ILE 200 CO -0.03 0.13 0.16 0.00 -1.23 0.00 0.00 174.94 173.97 1i9r s ASN 202 N -2.38 4.25 0.12 0.00 -0.87 0.65 -1.30 114.94 115.41 1i9r s ASN 202 Ca 0.32 -3.14 -0.30 0.00 -1.57 0.00 0.00 52.86 48.17 1i9r s ASN 202 Cb -0.13 -1.51 -0.06 0.00 -0.02 0.00 0.00 41.25 39.53 1i9r s ASN 202 CO 0.25 -0.20 1.00 -0.69 -2.57 0.00 0.00 177.10 174.88 1i9r s VAL 203 N -0.44 4.35 -0.16 1.60 1.01 0.31 -2.30 120.40 124.76 1i9r s VAL 203 Ca 0.19 1.95 -0.03 0.00 0.00 0.00 0.00 61.98 64.10 1i9r s VAL 203 Cb -0.20 -4.25 0.05 0.00 0.00 0.00 0.00 36.38 31.98 1i9r s VAL 203 CO -0.04 0.30 0.03 0.21 0.00 0.00 0.00 175.10 175.60 1i9r s ASN 204 N 0.01 2.54 -0.90 3.32 3.84 0.15 -0.00 114.94 123.90 1i9r s ASN 204 Ca 0.48 -0.62 -0.01 0.00 0.21 0.00 0.00 52.86 52.93 1i9r s ASN 204 Cb -0.25 -0.55 0.27 0.00 -0.55 0.00 0.00 41.25 40.17 1i9r s ASN 204 CO 0.31 -0.28 1.07 1.57 -2.79 0.00 0.00 177.10 176.99 1i9r n HIS 205 N 5.08 3.30 -0.37 0.43 -0.00 0.86 -1.56 115.22 122.96 1i9r n HIS 205 Ca -0.08 -3.50 0.02 0.00 0.46 0.00 0.00 57.72 54.61 1i9r n HIS 205 Cb 0.48 -1.03 0.08 0.00 -0.12 0.00 0.00 29.99 29.40 1i9r n HIS 205 CO 0.00 0.00 0.00 0.87 0.46 0.00 0.00 176.34 177.67 1i9r h LYS 206 N 5.21 -0.00 0.00 1.57 1.57 -1.79 0.14 116.57 123.27 1i9r h LYS 206 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1i9r h LYS 206 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1i9r h LYS 206 CO 1.05 -0.00 0.00 -2.30 -0.57 0.00 0.00 179.45 177.63 1i9r n PRO 207 N -5.54 0.00 0.00 3.15 -0.02 -1.26 0.13 135.00 131.46 1i9r n PRO 207 Ca 0.13 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.61 1i9r n PRO 207 Cb 0.44 -1.43 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 1i9r n PRO 207 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1i9r n SER 208 N -0.67 0.00 0.00 2.55 3.41 0.44 -4.71 113.62 114.64 1i9r n SER 208 Ca 0.00 -1.00 0.00 0.00 -0.26 0.00 0.00 58.87 57.61 1i9r n SER 208 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1i9r n SER 208 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1i9r n ASN 209 N 0.00 0.00 -4.62 4.04 5.15 0.34 -4.85 115.26 115.31 1i9r n ASN 209 Ca 0.00 0.00 -0.39 0.00 -0.60 0.00 0.00 54.58 53.59 1i9r n ASN 209 Cb 0.49 -0.99 0.04 0.00 -0.53 0.00 0.00 39.78 38.79 1i9r n ASN 209 CO 0.00 0.00 0.00 0.41 1.40 0.00 0.00 177.26 179.07 1i9r n THR 210 N -2.00 3.30 -3.64 -0.44 -1.04 -0.86 -4.80 114.28 104.79 1i9r n THR 210 Ca 0.00 -0.50 -0.04 0.00 -2.04 0.00 0.00 64.05 61.47 1i9r n THR 210 Cb 0.00 -1.20 -0.07 0.00 -1.82 0.00 0.00 70.33 67.24 1i9r n THR 210 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1i9r s LYS 211 N -2.54 0.50 0.03 -2.82 2.47 -1.26 -0.10 119.74 116.02 1i9r s LYS 211 Ca 0.71 0.87 -0.01 0.00 -1.56 0.00 0.00 55.97 55.98 1i9r s LYS 211 Cb -0.45 0.10 -0.02 0.00 -1.46 0.00 0.00 37.83 36.00 1i9r s LYS 211 CO 0.50 -0.11 -0.01 0.08 0.16 0.00 0.00 175.35 175.97 1i9r s VAL 212 N 1.43 0.14 -0.40 4.02 1.01 1.00 -4.99 120.40 122.60 1i9r s VAL 212 Ca -0.09 -1.14 0.01 0.00 0.00 0.00 0.00 61.98 60.76 1i9r s VAL 212 Cb -0.04 -0.63 0.13 0.00 0.00 0.00 0.00 36.38 35.84 1i9r s VAL 212 CO -0.17 -0.63 0.20 -1.81 0.00 0.00 0.00 175.10 172.70 1i9r s ASP 213 N -1.87 3.67 -0.23 3.32 1.01 -1.26 -0.53 116.67 120.78 1i9r s ASP 213 Ca -0.09 -2.36 -0.26 0.00 0.71 0.00 0.00 52.55 50.54 1i9r s ASP 213 Cb -0.05 -0.93 0.00 0.00 1.01 0.00 0.00 42.92 42.95 1i9r s ASP 213 CO -0.03 -0.30 0.91 -0.75 0.21 0.00 0.00 175.17 175.20 1i9r s LYS 214 N 0.71 4.22 -0.53 8.23 2.36 -0.42 -4.84 119.74 129.47 1i9r s LYS 214 Ca 0.16 1.11 -0.25 0.00 -2.55 0.00 0.00 55.97 54.44 1i9r s LYS 214 Cb -0.23 -3.64 0.04 0.00 -1.05 0.00 0.00 37.83 32.95 1i9r s LYS 214 CO -0.05 -0.55 0.96 0.21 1.55 0.00 0.00 175.35 177.47 1i9r s LYS 215 N 2.94 3.40 -0.11 4.03 2.20 -1.26 0.08 119.74 131.02 1i9r s LYS 215 Ca 0.39 -0.11 -0.30 0.00 -0.36 0.00 0.00 55.97 55.59 1i9r s LYS 215 Cb -0.15 -4.02 -0.01 0.00 -1.51 0.00 0.00 37.83 32.14 1i9r s LYS 215 CO 0.07 -1.43 1.05 0.08 -0.36 0.00 0.00 175.35 174.76 1i9r s VAL 216 N 3.98 4.66 0.08 4.02 1.01 0.55 -4.97 120.40 129.72 1i9r s VAL 216 Ca 0.33 1.95 0.08 0.00 0.00 0.00 0.00 61.98 64.33 1i9r s VAL 216 Cb -0.11 -4.25 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 1i9r s VAL 216 CO 0.22 -0.01 -0.20 -1.61 0.00 0.00 0.00 175.10 173.49 1i9r s GLU 217 N 2.17 1.20 -1.06 2.72 2.02 -1.26 -4.21 118.70 120.28 1i9r s GLU 217 Ca 0.50 -1.06 -0.23 0.00 0.02 0.00 0.00 54.97 54.20 1i9r s GLU 217 Cb -0.19 -1.40 -0.13 0.00 0.10 0.00 0.00 34.13 32.51 1i9r s GLU 217 CO 0.18 0.34 1.94 -0.35 0.02 0.00 0.00 175.26 177.38 1i9r n PRO 218 N 1.41 1.35 0.00 0.39 -0.04 -1.26 -4.52 135.00 132.33 1i9r n PRO 218 Ca -0.19 -2.22 0.12 0.00 -0.04 0.00 0.00 63.50 61.17 1i9r n PRO 218 Cb 0.53 -3.57 0.69 0.00 -0.04 0.00 0.00 33.50 31.12 1i9r n PRO 218 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09