#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 4.49 0.06 5.09 0.11 -1.26 -4.05 120.40 124.84 1i9r s VAL 2 Ca 0.00 1.25 0.03 0.00 -2.93 0.00 0.00 61.98 60.33 1i9r s VAL 2 Cb 0.00 -4.41 -0.03 0.00 -1.53 0.00 0.00 36.38 30.42 1i9r s VAL 2 CO 0.00 -0.64 -0.09 0.00 -3.33 0.00 0.00 175.10 171.04 1i9r s GLN 3 N 3.71 0.63 -0.22 1.54 -2.07 0.12 -4.97 119.66 118.40 1i9r s GLN 3 Ca 0.41 -0.87 0.02 0.00 -1.82 0.00 0.00 55.36 53.10 1i9r s GLN 3 Cb -0.11 -0.41 0.04 0.00 -1.09 0.00 0.00 33.01 31.44 1i9r s GLN 3 CO 0.21 0.07 -0.15 -0.51 -1.32 0.00 0.00 175.29 173.59 1i9r s LEU 4 N -1.78 2.82 -0.51 2.60 1.43 -1.26 -0.54 118.68 121.45 1i9r s LEU 4 Ca -0.06 -1.03 -0.07 0.00 -1.03 0.00 0.00 54.13 51.94 1i9r s LEU 4 Cb -0.08 -1.52 0.13 0.00 0.03 0.00 0.00 46.19 44.75 1i9r s LEU 4 CO 0.00 -0.10 0.36 -0.69 0.23 0.00 0.00 176.35 176.16 1i9r s VAL 5 N 1.20 4.05 0.91 -1.59 1.01 -0.55 -3.88 120.40 121.54 1i9r s VAL 5 Ca -0.02 -2.07 -0.11 0.00 0.00 0.00 0.00 61.98 59.78 1i9r s VAL 5 Cb -0.17 -3.67 0.14 0.00 0.00 0.00 0.00 36.38 32.68 1i9r s VAL 5 CO -0.09 -0.79 1.10 -1.58 0.00 0.00 0.00 175.10 173.74 1i9r s GLN 6 N 1.02 1.15 0.92 2.72 0.74 -1.26 -2.61 119.66 122.34 1i9r s GLN 6 Ca 0.09 1.11 -0.15 0.00 0.05 0.00 0.00 55.36 56.46 1i9r s GLN 6 Cb -0.24 -1.77 0.16 0.00 1.10 0.00 0.00 33.01 32.26 1i9r s GLN 6 CO -0.02 -2.40 1.28 -1.54 -0.55 0.00 0.00 175.29 172.05 1i9r s SER 7 N -3.09 3.51 0.74 6.67 1.04 -0.87 -4.89 113.70 116.82 1i9r s SER 7 Ca 0.64 0.44 -0.13 0.00 0.48 0.00 0.00 55.95 57.38 1i9r s SER 7 Cb -0.20 -0.62 0.04 0.00 0.10 0.00 0.00 66.02 65.34 1i9r s SER 7 CO 0.58 -2.50 1.13 -0.83 0.98 0.00 0.00 173.24 172.60 1i9r s GLY 8 N -4.78 1.99 0.75 7.32 0.00 -1.26 -4.72 107.32 106.62 1i9r s GLY 8 Ca 0.70 0.53 -0.15 0.00 0.00 0.00 0.00 44.72 45.80 1i9r s GLY 8 CO 0.52 0.90 1.20 0.00 0.00 0.00 0.00 173.10 175.72 1i9r n ALA 9 N -3.04 0.30 -3.09 3.20 0.00 -1.26 -4.82 120.51 111.81 1i9r n ALA 9 Ca 0.11 -0.22 -0.19 0.00 0.00 0.00 0.00 53.44 53.14 1i9r n ALA 9 Cb 0.52 -2.26 -0.15 0.00 0.00 0.00 0.00 19.45 17.56 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 -3.80 0.81 -0.19 0.00 8.01 -0.46 -4.98 118.70 118.10 1i9r s GLU 10 Ca 0.76 -0.24 -0.02 0.00 0.01 0.00 0.00 54.97 55.49 1i9r s GLU 10 Cb -0.32 -0.77 -0.00 0.00 -4.31 0.00 0.00 34.13 28.72 1i9r s GLU 10 CO 0.48 0.08 -0.10 0.08 0.01 0.00 0.00 175.26 175.80 1i9r s VAL 11 N 0.26 2.97 -0.01 2.63 1.01 -1.26 -1.20 120.40 124.79 1i9r s VAL 11 Ca -0.04 -0.65 -0.05 0.00 0.00 0.00 0.00 61.98 61.25 1i9r s VAL 11 Cb -0.08 -2.30 0.00 0.00 0.00 0.00 0.00 36.38 33.99 1i9r s VAL 11 CO 0.00 0.48 0.10 0.54 0.00 0.00 0.00 175.10 176.22 1i9r s VAL 12 N 1.14 0.05 0.42 2.92 0.11 -0.28 -4.99 120.40 119.77 1i9r s VAL 12 Ca 0.01 -0.45 -0.23 0.00 -2.93 0.00 0.00 61.98 58.38 1i9r s VAL 12 Cb -0.14 -0.30 -0.09 0.00 -1.53 0.00 0.00 36.38 34.32 1i9r s VAL 12 CO -0.03 -0.25 1.08 -1.59 -3.33 0.00 0.00 175.10 170.98 1i9r s LYS 13 N -0.81 4.03 0.86 1.54 0.00 -1.24 -0.74 119.74 123.38 1i9r s LYS 13 Ca -0.09 1.57 -0.16 0.00 0.00 0.00 0.00 55.97 57.29 1i9r s LYS 13 Cb -0.05 -2.47 -0.08 0.00 0.00 0.00 0.00 37.83 35.22 1i9r s LYS 13 CO 0.01 -0.27 -0.16 -2.30 0.00 0.00 0.00 175.35 172.63 1i9r n PRO 14 N -0.25 -0.01 0.00 1.78 -0.02 -1.26 -2.12 135.00 133.12 1i9r n PRO 14 Ca 0.06 0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 1i9r n PRO 14 Cb 0.49 -1.37 0.00 0.00 -0.02 0.00 0.00 33.50 32.60 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 2.51 1.68 0.00 -1.23 0.00 0.31 -4.86 105.19 103.61 1i9r n GLY 15 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 0.37 0.00 -3.21 4.61 0.00 -0.90 -3.82 120.51 117.57 1i9r n ALA 16 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1i9r n ALA 16 Cb 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.36 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 -1.57 -0.20 0.05 0.00 0.01 -1.26 -1.41 113.70 109.33 1i9r s SER 17 Ca 0.00 0.20 0.04 0.00 1.31 0.00 0.00 55.95 57.50 1i9r s SER 17 Cb 0.00 0.39 -0.03 0.00 0.21 0.00 0.00 66.02 66.60 1i9r s SER 17 CO 0.00 -0.34 -0.11 0.54 0.41 0.00 0.00 173.24 173.74 1i9r s VAL 18 N -0.89 0.84 -0.52 3.43 0.11 -0.27 -5.00 120.40 118.09 1i9r s VAL 18 Ca -0.10 -1.14 0.03 0.00 -2.93 0.00 0.00 61.98 57.84 1i9r s VAL 18 Cb -0.05 -0.84 0.13 0.00 -1.53 0.00 0.00 36.38 34.09 1i9r s VAL 18 CO 0.03 -0.26 0.28 -0.75 -3.33 0.00 0.00 175.10 171.06 1i9r s LYS 19 N -1.56 2.05 0.33 1.54 2.20 -1.26 -1.13 119.74 121.91 1i9r s LYS 19 Ca -0.05 -2.55 -0.28 0.00 -0.36 0.00 0.00 55.97 52.73 1i9r s LYS 19 Cb -0.10 -3.39 -0.10 0.00 -1.51 0.00 0.00 37.83 32.74 1i9r s LYS 19 CO 0.01 -1.11 1.21 -0.51 -0.36 0.00 0.00 175.35 174.59 1i9r s LEU 20 N -0.15 4.43 0.21 5.43 1.02 0.43 -4.77 118.68 125.27 1i9r s LEU 20 Ca 0.16 2.48 0.10 0.00 0.02 0.00 0.00 54.13 56.90 1i9r s LEU 20 Cb -0.24 -3.71 -0.05 0.00 0.02 0.00 0.00 46.19 42.21 1i9r s LEU 20 CO -0.01 -0.43 -0.20 -0.94 0.02 0.00 0.00 176.35 174.79 1i9r s SER 21 N -0.74 3.16 -0.13 2.29 1.04 -1.26 0.13 113.70 118.18 1i9r s SER 21 Ca 0.49 -0.93 -0.05 0.00 0.48 0.00 0.00 55.95 55.94 1i9r s SER 21 Cb -0.35 -0.23 0.06 0.00 0.10 0.00 0.00 66.02 65.61 1i9r s SER 21 CO 0.46 0.02 0.26 0.00 0.98 0.00 0.00 173.24 174.96 1i9r s LYS 23 N 2.40 2.73 0.80 0.00 2.20 -1.07 0.01 119.74 126.81 1i9r s LYS 23 Ca 0.01 -1.26 -0.12 0.00 -0.36 0.00 0.00 55.97 54.24 1i9r s LYS 23 Cb -0.12 -3.77 0.07 0.00 -1.51 0.00 0.00 37.83 32.50 1i9r s LYS 23 CO -0.08 -0.83 1.16 0.00 -0.36 0.00 0.00 175.35 175.23 1i9r s ALA 24 N 1.50 2.59 -0.30 3.13 0.00 -0.80 -1.48 121.76 126.40 1i9r s ALA 24 Ca 0.02 -0.56 -0.35 0.00 0.00 0.00 0.00 51.96 51.07 1i9r s ALA 24 Cb -0.21 -2.99 0.17 0.00 0.00 0.00 0.00 23.12 20.10 1i9r s ALA 24 CO 0.05 -1.64 1.40 -1.54 0.00 0.00 0.00 175.76 174.03 1i9r s SER 25 N -4.45 -0.00 0.00 0.00 1.04 0.30 -4.88 113.70 105.71 1i9r s SER 25 Ca 0.61 0.00 0.00 0.00 0.48 0.00 0.00 55.95 57.04 1i9r s SER 25 Cb -0.12 0.00 0.00 0.00 0.10 0.00 0.00 66.02 66.01 1i9r s SER 25 CO 0.50 -0.00 0.00 0.61 0.98 0.00 0.00 173.24 175.33 1i9r n GLY 26 N 0.18 0.74 3.83 7.32 0.00 -1.26 0.14 105.19 116.13 1i9r n GLY 26 Ca 0.04 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 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 -2.42 0.02 -0.44 1.61 1.13 -1.26 -4.28 117.35 111.70 1i9r s TYR 27 Ca 0.00 -0.50 -0.28 0.00 -1.41 0.00 0.00 57.07 54.88 1i9r s TYR 27 Cb 0.00 0.74 0.03 0.00 -1.10 0.00 0.00 41.96 41.63 1i9r s TYR 27 CO 0.00 -1.17 1.06 0.42 -2.51 0.00 0.00 175.55 173.35 1i9r s ILE 28 N -2.65 4.35 0.16 -3.49 1.01 -1.26 -4.91 121.20 114.40 1i9r s ILE 28 Ca 0.16 1.21 -0.25 0.00 0.00 0.00 0.00 60.65 61.77 1i9r s ILE 28 Cb -0.04 -4.51 0.02 0.00 0.01 0.00 0.00 42.46 37.95 1i9r s ILE 28 CO 0.07 -0.84 1.59 0.15 0.00 0.00 0.00 174.94 175.91 1i9r h PHE 29 N 8.93 -1.09 0.00 3.97 3.57 -1.96 -2.35 116.94 128.01 1i9r h PHE 29 Ca -0.23 0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.33 1i9r h PHE 29 Cb 1.07 0.53 0.00 0.00 2.79 0.00 0.00 35.95 40.34 1i9r h PHE 29 CO 0.92 -0.42 0.00 0.25 -2.23 0.00 0.00 178.31 176.83 1i9r n THR 30 N -5.42 1.10 0.63 4.41 -2.24 -1.26 -2.95 114.28 108.54 1i9r n THR 30 Ca -0.00 0.31 0.06 0.00 -2.27 0.00 0.00 64.05 62.15 1i9r n THR 30 Cb 0.35 -1.16 0.18 0.00 -2.10 0.00 0.00 70.33 67.60 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 -1.74 2.33 -3.87 3.42 7.64 -0.88 -4.15 113.62 116.37 1i9r n SER 31 Ca 0.02 -2.09 -0.15 0.00 1.01 0.00 0.00 58.87 57.67 1i9r n SER 31 Cb 0.15 -0.32 -0.15 0.00 -1.01 0.00 0.00 64.21 62.88 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 -1.57 0.20 0.10 1.43 2.02 -1.15 -4.90 117.35 113.49 1i9r s TYR 32 Ca 0.26 -0.01 -0.30 0.00 -0.37 0.00 0.00 57.07 56.65 1i9r s TYR 32 Cb 0.15 -0.21 -0.07 0.00 -0.40 0.00 0.00 41.96 41.44 1i9r s TYR 32 CO 0.16 -0.04 1.21 0.71 -1.57 0.00 0.00 175.55 176.02 1i9r s TYR 33 N 0.34 3.42 -0.25 2.71 1.51 -1.25 -4.20 117.35 119.62 1i9r s TYR 33 Ca -0.03 1.31 -0.13 0.00 -1.01 0.00 0.00 57.07 57.21 1i9r s TYR 33 Cb -0.05 -3.44 -0.04 0.00 -0.11 0.00 0.00 41.96 38.31 1i9r s TYR 33 CO -0.01 -1.34 0.30 1.41 -1.11 0.00 0.00 175.55 174.80 1i9r s MET 34 N 0.67 4.04 0.50 -0.62 1.75 -0.59 -0.20 119.30 124.85 1i9r s MET 34 Ca 0.57 -0.07 0.07 0.00 -1.25 0.00 0.00 55.69 55.02 1i9r s MET 34 Cb -0.31 -3.61 0.09 0.00 2.84 0.00 0.00 34.83 33.83 1i9r s MET 34 CO 0.31 -0.15 0.69 0.66 -0.65 0.00 0.00 175.02 175.88 1i9r n TYR 35 N 4.92 -2.48 -3.73 4.11 4.02 0.16 -1.09 117.16 123.08 1i9r n TYR 35 Ca -0.11 -1.73 -0.12 0.00 -0.01 0.00 0.00 57.90 55.93 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 -2.07 -0.41 -0.04 -0.72 0.52 -1.02 -2.50 118.94 112.70 1i9r s TRP 36 Ca 0.51 0.93 0.04 0.00 0.02 0.00 0.00 56.10 57.60 1i9r s TRP 36 Cb -0.04 0.12 -0.00 0.00 -1.15 0.00 0.00 33.47 32.40 1i9r s TRP 36 CO 0.33 -0.25 -0.16 0.08 0.02 0.00 0.00 176.95 176.96 1i9r s VAL 37 N 1.13 1.37 -0.05 4.03 1.01 0.47 -0.19 120.40 128.17 1i9r s VAL 37 Ca -0.08 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.21 1i9r s VAL 37 Cb -0.09 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.07 1i9r s VAL 37 CO -0.08 0.40 0.02 -0.75 0.00 0.00 0.00 175.10 174.68 1i9r s LYS 38 N 0.08 2.95 -0.12 2.72 2.20 0.12 -0.02 119.74 127.67 1i9r s LYS 38 Ca -0.04 -0.47 -0.04 0.00 -0.36 0.00 0.00 55.97 55.06 1i9r s LYS 38 Cb -0.12 -2.78 0.05 0.00 -1.51 0.00 0.00 37.83 33.48 1i9r s LYS 38 CO 0.02 0.68 0.07 -1.14 -0.36 0.00 0.00 175.35 174.62 1i9r s GLN 39 N -1.20 0.06 0.04 4.03 0.74 0.24 0.44 119.66 124.00 1i9r s GLN 39 Ca 0.16 0.08 -0.00 0.00 0.05 0.00 0.00 55.36 55.65 1i9r s GLN 39 Cb -0.11 -1.33 -0.04 0.00 1.10 0.00 0.00 33.01 32.63 1i9r s GLN 39 CO 0.06 -0.53 0.18 0.00 -0.55 0.00 0.00 175.29 174.46 1i9r s ALA 40 N 2.13 3.93 -0.38 1.58 0.00 -1.22 -0.03 121.76 127.76 1i9r s ALA 40 Ca 0.03 -0.84 -0.35 0.00 0.00 0.00 0.00 51.96 50.80 1i9r s ALA 40 Cb -0.14 -1.79 -0.15 0.00 0.00 0.00 0.00 23.12 21.03 1i9r s ALA 40 CO -0.07 0.79 1.41 -2.30 0.00 0.00 0.00 175.76 175.59 1i9r n PRO 41 N 0.53 0.00 0.00 0.00 -0.02 -1.26 0.32 135.00 134.57 1i9r n PRO 41 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1i9r n PRO 41 Cb 0.52 -1.15 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 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 4.24 1.05 3.74 -1.23 0.00 -1.26 -4.91 105.19 106.82 1i9r n GLY 42 Ca 0.32 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.99 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 2.58 0.00 1.61 2.00 0.96 -5.03 119.66 121.78 1i9r s GLN 43 Ca 0.00 1.73 0.00 0.00 -2.00 0.00 0.00 55.36 55.09 1i9r s GLN 43 Cb 0.00 -1.89 0.00 0.00 0.80 0.00 0.00 33.01 31.92 1i9r s GLN 43 CO 0.00 -1.49 0.00 0.41 -0.50 0.00 0.00 175.29 173.71 1i9r n GLY 44 N 0.29 -0.99 3.70 2.59 0.00 -1.26 -3.46 105.19 106.06 1i9r n GLY 44 Ca 0.13 -1.53 -0.38 0.00 0.00 0.00 0.00 46.02 44.24 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 4.22 -0.04 0.99 2.01 -1.26 -3.50 118.68 121.10 1i9r s LEU 45 Ca 0.00 0.75 0.04 0.00 0.01 0.00 0.00 54.13 54.93 1i9r s LEU 45 Cb 0.00 -2.69 -0.00 0.00 0.01 0.00 0.00 46.19 43.50 1i9r s LEU 45 CO 0.00 -0.07 -0.17 -1.61 1.01 0.00 0.00 176.35 175.51 1i9r s GLU 46 N 1.06 1.71 -0.13 1.70 2.02 0.17 -4.96 118.70 120.26 1i9r s GLU 46 Ca 0.25 -0.59 -0.24 0.00 0.02 0.00 0.00 54.97 54.41 1i9r s GLU 46 Cb -0.15 -1.50 -0.03 0.00 0.10 0.00 0.00 34.13 32.56 1i9r s GLU 46 CO 0.10 0.24 0.74 -0.46 0.02 0.00 0.00 175.26 175.90 1i9r s TRP 47 N 0.03 3.48 -0.13 1.61 -0.00 -1.26 0.15 118.94 122.81 1i9r s TRP 47 Ca -0.03 1.19 -0.07 0.00 -0.00 0.00 0.00 56.10 57.19 1i9r s TRP 47 Cb -0.11 -2.88 -0.02 0.00 -0.00 0.00 0.00 33.47 30.45 1i9r s TRP 47 CO 0.02 -0.09 -0.14 0.82 -0.00 0.00 0.00 176.95 177.56 1i9r h ILE 48 N 5.00 0.00 -1.87 5.86 2.04 -0.94 -3.42 117.51 124.18 1i9r h ILE 48 Ca -0.35 -1.00 0.02 0.00 1.00 0.00 0.00 64.86 64.54 1i9r h ILE 48 Cb 1.16 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.24 1i9r h ILE 48 CO 0.79 0.00 0.10 0.61 0.00 0.00 0.00 178.15 179.65 1i9r n GLY 49 N 1.65 1.32 3.02 5.37 0.00 -1.24 0.84 105.19 116.14 1i9r n GLY 49 Ca -0.06 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.01 0.41 -0.03 1.61 -1.05 0.23 -2.43 118.70 115.44 1i9r s GLU 50 Ca 0.04 -0.75 -0.01 0.00 -0.15 0.00 0.00 54.97 54.10 1i9r s GLU 50 Cb -0.01 0.04 0.02 0.00 -0.44 0.00 0.00 34.13 33.75 1i9r s GLU 50 CO 0.01 -0.04 0.06 -1.50 0.95 0.00 0.00 175.26 174.74 1i9r s ILE 51 N -1.86 -0.04 -0.21 1.83 2.07 -0.25 -0.89 121.20 121.86 1i9r s ILE 51 Ca -0.11 0.13 -0.19 0.00 -1.41 0.00 0.00 60.65 59.07 1i9r s ILE 51 Cb -0.07 -0.11 -0.03 0.00 0.13 0.00 0.00 42.46 42.39 1i9r s ILE 51 CO -0.02 0.05 0.56 0.21 -1.91 0.00 0.00 174.94 173.83 1i9r s ASN 52 N 0.72 6.59 0.37 4.50 3.84 -0.00 -1.53 114.94 129.42 1i9r s ASN 52 Ca -0.06 0.71 0.20 0.00 0.21 0.00 0.00 52.86 53.92 1i9r s ASN 52 Cb -0.08 -2.31 0.55 0.00 -0.55 0.00 0.00 41.25 38.86 1i9r s ASN 52 CO -0.02 -0.23 1.67 1.55 -2.79 0.00 0.00 177.10 177.27 1i9r h PRO 53 N 7.54 0.00 -0.73 0.43 0.13 -1.82 -1.54 132.00 136.01 1i9r h PRO 53 Ca -0.32 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.77 1i9r h PRO 53 Cb 1.15 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.24 1i9r h PRO 53 CO 0.75 0.35 0.30 1.03 -0.23 0.00 0.00 178.00 180.20 1i9r h SER 54 N 0.00 0.99 0.00 1.44 0.87 -1.88 -3.36 113.55 111.61 1i9r h SER 54 Ca -0.00 -0.14 -0.01 0.00 -1.23 0.00 0.00 61.79 60.40 1i9r h SER 54 Cb 1.01 -0.26 -0.00 0.00 -0.44 0.00 0.00 62.40 62.71 1i9r h SER 54 CO 0.05 0.88 -0.17 -1.13 -0.53 0.00 0.00 176.83 175.92 1i9r h ASN 55 N 1.06 0.00 0.00 6.23 -0.73 -1.89 -3.49 115.58 116.76 1i9r h ASN 55 Ca 0.25 -0.23 0.00 0.00 1.87 0.00 0.00 56.30 58.18 1i9r h ASN 55 Cb 0.19 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.78 1i9r h ASN 55 CO -0.02 0.71 0.00 0.61 -0.37 0.00 0.00 177.43 178.36 1i9r n GLY 56 N 1.70 2.26 3.76 1.57 0.00 -0.59 -5.06 105.19 108.83 1i9r n GLY 56 Ca -0.05 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.56 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 3.62 -4.31 1.61 4.64 -1.26 -4.80 116.55 116.06 1i9r n ASP 57 Ca 0.00 1.21 -0.16 0.00 -1.38 0.00 0.00 54.79 54.46 1i9r n ASP 57 Cb 0.00 -1.60 -0.10 0.00 -1.04 0.00 0.00 41.12 38.37 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 -1.12 0.55 -0.25 5.18 -4.23 -1.26 -0.82 115.64 113.68 1i9r s THR 58 Ca 0.54 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.95 1i9r s THR 58 Cb -0.48 -2.59 0.10 0.00 1.34 0.00 0.00 72.50 70.87 1i9r s THR 58 CO 0.63 -0.04 0.57 0.20 -0.54 0.00 0.00 174.62 175.43 1i9r s ASN 59 N -3.30 -0.79 0.28 3.99 0.01 -0.07 -4.97 114.94 110.11 1i9r s ASN 59 Ca 0.37 1.32 0.08 0.00 -0.71 0.00 0.00 52.86 53.92 1i9r s ASN 59 Cb 0.08 1.63 -0.04 0.00 0.41 0.00 0.00 41.25 43.32 1i9r s ASN 59 CO 0.13 -0.22 0.13 -0.36 -1.51 0.00 0.00 177.10 175.26 1i9r s PHE 60 N 2.31 2.87 -0.15 2.20 0.40 -1.26 0.77 117.98 125.12 1i9r s PHE 60 Ca -0.06 -0.22 -0.27 0.00 -0.60 0.00 0.00 56.93 55.78 1i9r s PHE 60 Cb -0.10 -1.41 -0.01 0.00 0.51 0.00 0.00 43.02 42.01 1i9r s PHE 60 CO -0.17 0.49 0.90 1.21 0.70 0.00 0.00 175.22 178.35 1i9r s ASN 61 N -3.80 7.05 0.25 1.36 3.84 0.25 -4.91 114.94 118.99 1i9r s ASN 61 Ca 0.34 1.30 -0.11 0.00 0.21 0.00 0.00 52.86 54.59 1i9r s ASN 61 Cb -0.06 -2.49 0.37 0.00 -0.55 0.00 0.00 41.25 38.51 1i9r s ASN 61 CO 0.23 -0.43 1.57 -0.08 -2.79 0.00 0.00 177.10 175.61 1i9r h GLU 62 N 7.25 -0.01 0.00 0.43 4.57 -1.95 0.61 114.58 125.49 1i9r h GLU 62 Ca -0.29 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.89 1i9r h GLU 62 Cb 1.13 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 1i9r h GLU 62 CO 0.85 -0.01 0.25 1.17 -1.18 0.00 0.00 179.01 180.09 1i9r n LYS 63 N -5.56 0.00 0.00 1.92 3.00 -1.26 -0.51 118.16 115.75 1i9r n LYS 63 Ca 0.13 0.20 0.00 0.00 -0.00 0.00 0.00 58.31 58.64 1i9r n LYS 63 Cb 0.45 -1.75 0.00 0.00 0.00 0.00 0.00 35.03 33.73 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 -1.18 0.00 -0.42 5.64 3.01 0.21 -4.85 117.46 119.88 1i9r n PHE 64 Ca 0.00 -0.07 0.37 0.00 1.01 0.00 0.00 57.45 58.76 1i9r n PHE 64 Cb 0.25 -0.01 0.71 0.00 -0.01 0.00 0.00 39.48 40.42 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 0.08 0.10 -1.08 3.11 -0.17 -1.79 116.57 116.83 1i9r h LYS 65 Ca 0.00 -0.00 -0.24 0.00 -2.81 0.00 0.00 60.65 57.60 1i9r h LYS 65 Cb 0.60 -0.02 -0.00 0.00 -1.00 0.00 0.00 32.23 31.81 1i9r h LYS 65 CO 0.00 0.05 -1.20 0.66 -2.81 0.00 0.00 179.45 176.16 1i9r h SER 66 N 0.08 0.35 -0.03 4.20 4.64 -1.89 -3.39 113.55 117.51 1i9r h SER 66 Ca 0.69 -0.86 -0.10 0.00 -0.47 0.00 0.00 61.79 61.05 1i9r h SER 66 Cb 2.49 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 64.45 1i9r h SER 66 CO -0.13 1.53 -0.27 0.11 -0.87 0.00 0.00 176.83 177.20 1i9r h LYS 67 N -0.41 0.46 -6.21 4.77 6.56 -1.64 -3.44 116.57 116.65 1i9r h LYS 67 Ca -0.26 -0.18 -0.53 0.00 -1.06 0.00 0.00 60.65 58.62 1i9r h LYS 67 Cb 1.66 -0.02 -0.07 0.00 -0.57 0.00 0.00 32.23 33.22 1i9r h LYS 67 CO 0.05 0.70 -0.57 0.00 -2.06 0.00 0.00 179.45 177.57 1i9r s ALA 68 N -4.45 3.45 -0.36 3.86 0.00 -0.95 -2.11 121.76 121.20 1i9r s ALA 68 Ca -0.07 -1.44 0.02 0.00 0.00 0.00 0.00 51.96 50.47 1i9r s ALA 68 Cb 0.14 -1.16 0.15 0.00 0.00 0.00 0.00 23.12 22.25 1i9r s ALA 68 CO 0.79 0.31 0.35 0.99 0.00 0.00 0.00 175.76 178.20 1i9r s THR 69 N -2.09 -0.30 0.27 0.00 2.01 -0.97 -4.91 115.64 109.66 1i9r s THR 69 Ca 0.32 -0.98 -0.30 0.00 0.31 0.00 0.00 61.69 61.04 1i9r s THR 69 Cb -0.08 -0.77 -0.09 0.00 0.01 0.00 0.00 72.50 71.57 1i9r s THR 69 CO 0.23 -0.61 1.08 -0.76 -0.69 0.00 0.00 174.62 173.87 1i9r s LEU 70 N 1.54 4.56 0.18 4.42 1.43 -1.26 -2.48 118.68 127.08 1i9r s LEU 70 Ca 0.16 2.22 -0.23 0.00 -1.03 0.00 0.00 54.13 55.25 1i9r s LEU 70 Cb -0.16 -3.62 0.06 0.00 0.03 0.00 0.00 46.19 42.50 1i9r s LEU 70 CO -0.08 -0.10 0.65 0.28 0.23 0.00 0.00 176.35 177.33 1i9r s THR 71 N -1.13 0.00 0.07 5.49 -1.32 -0.85 -5.01 115.64 112.89 1i9r s THR 71 Ca 0.44 -0.25 -0.14 0.00 -1.21 0.00 0.00 61.69 60.53 1i9r s THR 71 Cb -0.31 -1.25 0.02 0.00 -1.51 0.00 0.00 72.50 69.45 1i9r s THR 71 CO 0.40 0.00 0.33 0.68 -2.21 0.00 0.00 174.62 173.81 1i9r s VAL 72 N -3.74 0.08 -0.81 5.08 -7.23 -1.26 -0.93 120.40 111.59 1i9r s VAL 72 Ca 0.04 -0.69 0.02 0.00 -1.81 0.00 0.00 61.98 59.53 1i9r s VAL 72 Cb -0.02 -1.05 0.22 0.00 0.56 0.00 0.00 36.38 36.09 1i9r s VAL 72 CO -0.08 -0.38 0.77 -0.67 -0.31 0.00 0.00 175.10 174.43 1i9r n ASP 73 N 0.30 4.01 -0.17 4.85 2.03 0.24 -4.93 116.55 122.88 1i9r n ASP 73 Ca -0.17 -3.25 0.01 0.00 0.52 0.00 0.00 54.79 51.89 1i9r n ASP 73 Cb 0.61 -0.92 0.04 0.00 -0.72 0.00 0.00 41.12 40.13 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 1.81 -0.08 0.28 -0.67 4.81 -1.26 0.52 118.16 123.56 1i9r n LYS 74 Ca 0.23 0.71 -0.18 0.00 -0.87 0.00 0.00 58.31 58.21 1i9r n LYS 74 Cb 0.37 -1.06 -0.09 0.00 0.02 0.00 0.00 35.03 34.27 1i9r n LYS 74 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1i9r h SER 75 N 0.00 -1.29 0.00 3.14 0.87 -1.95 -0.86 113.55 113.46 1i9r h SER 75 Ca 0.18 0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 1i9r h SER 75 Cb 0.30 0.43 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 1i9r h SER 75 CO -0.46 -0.63 0.00 0.00 -0.53 0.00 0.00 176.83 175.21 1i9r n ALA 76 N -2.78 2.30 -3.85 6.23 0.00 0.19 -4.87 120.51 117.73 1i9r n ALA 76 Ca -0.11 -0.02 -0.29 0.00 0.00 0.00 0.00 53.44 53.01 1i9r n ALA 76 Cb 0.44 -1.06 0.01 0.00 0.00 0.00 0.00 19.45 18.84 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 -0.58 -2.39 -3.90 0.00 2.88 0.01 -4.82 113.62 104.82 1i9r n SER 77 Ca 0.03 -1.02 -0.11 0.00 -1.33 0.00 0.00 58.87 56.44 1i9r n SER 77 Cb 0.01 -3.14 -0.12 0.00 -0.75 0.00 0.00 64.21 60.22 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 -3.74 0.06 0.32 2.46 2.01 -1.16 -1.90 115.64 113.68 1i9r s THR 78 Ca 0.20 -0.47 0.09 0.00 0.31 0.00 0.00 61.69 61.82 1i9r s THR 78 Cb -0.08 -0.23 -0.05 0.00 0.01 0.00 0.00 72.50 72.15 1i9r s THR 78 CO 0.88 -0.26 0.03 0.00 -0.69 0.00 0.00 174.62 174.58 1i9r s ALA 79 N -0.80 3.24 -0.06 7.40 0.00 0.10 0.82 121.76 132.46 1i9r s ALA 79 Ca -0.09 -1.84 -0.07 0.00 0.00 0.00 0.00 51.96 49.96 1i9r s ALA 79 Cb -0.05 -0.56 0.02 0.00 0.00 0.00 0.00 23.12 22.52 1i9r s ALA 79 CO 0.00 0.12 0.19 0.71 0.00 0.00 0.00 175.76 176.78 1i9r s TYR 80 N -2.45 -0.17 -0.07 0.00 2.02 -0.10 -0.43 117.35 116.15 1i9r s TYR 80 Ca 0.34 0.41 0.05 0.00 -0.37 0.00 0.00 57.07 57.51 1i9r s TYR 80 Cb -0.03 0.06 -0.01 0.00 -0.40 0.00 0.00 41.96 41.58 1i9r s TYR 80 CO 0.20 -0.14 -0.24 1.41 -1.57 0.00 0.00 175.55 175.21 1i9r s MET 81 N -0.18 2.67 -0.28 -0.62 -2.45 0.35 -2.01 119.30 116.78 1i9r s MET 81 Ca -0.03 -0.88 0.02 0.00 -1.25 0.00 0.00 55.69 53.56 1i9r s MET 81 Cb -0.02 -2.22 0.07 0.00 1.25 0.00 0.00 34.83 33.91 1i9r s MET 81 CO 0.01 0.35 -0.03 -2.00 1.05 0.00 0.00 175.02 174.40 1i9r s GLU 82 N -0.09 1.73 -0.02 4.11 2.12 -1.03 0.16 118.70 125.67 1i9r s GLU 82 Ca -0.06 -1.36 -0.17 0.00 0.36 0.00 0.00 54.97 53.75 1i9r s GLU 82 Cb -0.14 -2.81 -0.05 0.00 0.26 0.00 0.00 34.13 31.38 1i9r s GLU 82 CO 0.04 -0.71 0.48 -0.51 -0.54 0.00 0.00 175.26 174.03 1i9r s LEU 83 N 1.18 4.41 0.20 2.70 1.43 -0.28 -2.28 118.68 126.04 1i9r s LEU 83 Ca -0.01 0.99 0.05 0.00 -1.03 0.00 0.00 54.13 54.13 1i9r s LEU 83 Cb -0.19 -2.72 -0.05 0.00 0.03 0.00 0.00 46.19 43.26 1i9r s LEU 83 CO -0.08 0.19 -0.07 -0.94 0.23 0.00 0.00 176.35 175.68 1i9r s SER 84 N -0.43 2.03 -1.04 2.29 1.04 -0.90 -1.12 113.70 115.58 1i9r s SER 84 Ca 0.26 -1.10 -0.17 0.00 0.48 0.00 0.00 55.95 55.43 1i9r s SER 84 Cb -0.17 -0.04 0.01 0.00 0.10 0.00 0.00 66.02 65.92 1i9r s SER 84 CO 0.14 -0.36 0.72 -1.54 0.98 0.00 0.00 173.24 173.17 1i9r n SER 85 N -0.33 -5.28 -4.67 7.02 3.41 -0.50 -4.78 113.62 108.49 1i9r n SER 85 Ca -0.08 -0.96 -0.43 0.00 -0.26 0.00 0.00 58.87 57.15 1i9r n SER 85 Cb 0.62 -2.86 -0.02 0.00 -0.26 0.00 0.00 64.21 61.68 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 -6.04 4.24 0.00 1.04 1.43 -0.80 -4.69 118.68 113.85 1i9r s LEU 86 Ca 0.32 1.83 -0.02 0.00 -1.03 0.00 0.00 54.13 55.23 1i9r s LEU 86 Cb -0.13 -3.55 0.07 0.00 0.03 0.00 0.00 46.19 42.61 1i9r s LEU 86 CO 0.88 -0.73 0.47 0.54 0.23 0.00 0.00 176.35 177.74 1i9r n ARG 87 N 6.13 0.11 0.10 1.70 1.74 -1.26 0.11 116.66 125.28 1i9r n ARG 87 Ca 0.13 -1.12 -0.16 0.00 -0.77 0.00 0.00 57.85 55.93 1i9r n ARG 87 Cb 0.45 -0.36 -0.11 0.00 -1.02 0.00 0.00 32.46 31.42 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 -0.37 0.55 0.00 0.55 4.64 -1.96 -3.23 113.55 113.73 1i9r h SER 88 Ca -0.15 -0.52 0.00 0.00 -0.47 0.00 0.00 61.79 60.64 1i9r h SER 88 Cb 0.53 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1i9r h SER 88 CO 0.15 1.37 0.00 -0.62 -0.87 0.00 0.00 176.83 176.86 1i9r n GLU 89 N -3.65 0.46 0.00 4.77 4.71 -1.26 -2.19 120.64 123.48 1i9r n GLU 89 Ca -0.09 0.00 0.13 0.00 -0.01 0.00 0.00 57.16 57.19 1i9r n GLU 89 Cb 0.96 -1.34 0.52 0.00 -1.01 0.00 0.00 31.44 30.57 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 -0.84 0.20 -4.76 1.62 8.00 -1.22 -4.86 116.55 114.70 1i9r n ASP 90 Ca 0.07 0.14 -0.41 0.00 0.71 0.00 0.00 54.79 55.30 1i9r n ASP 90 Cb 0.03 -0.22 -0.02 0.00 -0.02 0.00 0.00 41.12 40.89 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 -2.93 2.68 -3.04 -3.53 2.01 -0.93 -4.88 115.64 105.02 1i9r s THR 91 Ca 0.15 0.62 0.00 0.00 0.31 0.00 0.00 61.69 62.78 1i9r s THR 91 Cb 0.19 -3.40 0.00 0.00 0.01 0.00 0.00 72.50 69.30 1i9r s THR 91 CO 0.57 0.12 0.00 0.00 -0.69 0.00 0.00 174.62 174.62 1i9r n ALA 92 N 1.61 0.00 -3.06 7.40 0.00 -0.38 -4.58 120.51 121.50 1i9r n ALA 92 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.14 1i9r n ALA 92 Cb 0.41 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.73 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 3.72 -0.26 0.00 1.01 0.96 -0.63 120.40 122.20 1i9r s VAL 93 Ca 0.00 -0.41 -0.09 0.00 0.00 0.00 0.00 61.98 61.48 1i9r s VAL 93 Cb 0.00 -2.64 -0.04 0.00 0.00 0.00 0.00 36.38 33.70 1i9r s VAL 93 CO 0.00 0.48 0.13 -0.31 0.00 0.00 0.00 175.10 175.39 1i9r s TYR 94 N 0.61 3.16 -0.06 5.22 1.51 0.84 -0.60 117.35 128.02 1i9r s TYR 94 Ca -0.03 -0.15 -0.00 0.00 -1.01 0.00 0.00 57.07 55.88 1i9r s TYR 94 Cb -0.15 -2.30 -0.03 0.00 -0.11 0.00 0.00 41.96 39.37 1i9r s TYR 94 CO 0.03 -0.24 -0.02 0.71 -1.11 0.00 0.00 175.55 174.91 1i9r s TYR 95 N 1.63 3.07 -0.10 2.71 2.02 0.97 -0.03 117.35 127.62 1i9r s TYR 95 Ca 0.07 0.12 -0.01 0.00 -0.37 0.00 0.00 57.07 56.87 1i9r s TYR 95 Cb -0.15 -1.74 -0.03 0.00 -0.40 0.00 0.00 41.96 39.64 1i9r s TYR 95 CO 0.07 0.43 -0.06 0.00 -1.57 0.00 0.00 175.55 174.42 1i9r s THR 97 N -0.34 0.05 -0.30 0.00 -1.32 -1.04 -0.32 115.64 112.36 1i9r s THR 97 Ca 0.05 -0.37 -0.28 0.00 -1.21 0.00 0.00 61.69 59.87 1i9r s THR 97 Cb -0.12 -0.40 0.01 0.00 -1.51 0.00 0.00 72.50 70.48 1i9r s THR 97 CO 0.02 -0.21 1.04 -0.60 -2.21 0.00 0.00 174.62 172.67 1i9r s ARG 98 N -0.76 4.09 0.18 7.08 3.00 -0.47 0.38 118.95 132.44 1i9r s ARG 98 Ca -0.08 1.07 -0.18 0.00 -1.00 0.00 0.00 55.73 55.53 1i9r s ARG 98 Cb -0.05 -3.72 -0.08 0.00 0.00 0.00 0.00 34.95 31.11 1i9r s ARG 98 CO 0.01 -0.83 0.65 -1.54 0.00 0.00 0.00 175.30 173.59 1i9r s SER 99 N 1.58 6.99 -0.78 -2.12 1.04 0.72 -1.20 113.70 119.93 1i9r s SER 99 Ca 0.44 1.29 -0.09 0.00 0.48 0.00 0.00 55.95 58.07 1i9r s SER 99 Cb -0.13 -2.37 0.20 0.00 0.10 0.00 0.00 66.02 63.82 1i9r s SER 99 CO 0.13 0.09 0.68 -0.62 0.98 0.00 0.00 173.24 174.50 1i9r s ASP 100 N -1.59 6.22 -0.20 7.02 3.68 0.37 -3.94 116.67 128.23 1i9r s ASP 100 Ca 0.39 -2.87 0.00 0.00 2.13 0.00 0.00 52.55 52.20 1i9r s ASP 100 Cb -0.17 -2.07 0.00 0.00 -1.45 0.00 0.00 42.92 39.23 1i9r s ASP 100 CO 0.20 -0.46 0.00 0.61 0.13 0.00 0.00 175.17 175.65 1i9r n GLY 101 N 3.62 0.38 3.69 2.66 0.00 -1.26 -3.17 105.19 111.12 1i9r n GLY 101 Ca 0.13 -0.87 -0.26 0.00 0.00 0.00 0.00 46.02 45.02 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 -1.83 -7.12 0.00 1.61 1.74 -1.26 -4.89 116.66 104.90 1i9r n ARG 102 Ca -0.02 0.75 0.00 0.00 -0.77 0.00 0.00 57.85 57.81 1i9r n ARG 102 Cb 0.36 -5.76 0.00 0.00 -1.02 0.00 0.00 32.46 26.04 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 -2.95 0.00 -4.77 0.55 4.13 -1.19 -5.05 115.26 105.99 1i9r n ASN 103 Ca 0.02 0.00 -0.39 0.00 1.68 0.00 0.00 54.58 55.89 1i9r n ASN 103 Cb 0.55 0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.76 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 6.89 -0.51 6.41 1.47 -1.26 -4.80 116.67 125.87 1i9r s ASP 104 Ca 0.00 2.34 -0.15 0.00 1.18 0.00 0.00 52.55 55.92 1i9r s ASP 104 Cb 0.00 -2.62 0.11 0.00 -0.34 0.00 0.00 42.92 40.07 1i9r s ASP 104 CO 0.00 -0.42 0.45 -0.04 0.68 0.00 0.00 175.17 175.84 1i9r s MET 105 N -1.89 2.90 0.00 2.11 -1.94 -1.26 -0.48 119.30 118.73 1i9r s MET 105 Ca 0.51 -1.63 0.23 0.00 -1.71 0.00 0.00 55.69 53.09 1i9r s MET 105 Cb -0.32 -4.19 0.83 0.00 2.01 0.00 0.00 34.83 33.16 1i9r s MET 105 CO 0.41 -1.23 1.60 -0.40 -0.01 0.00 0.00 175.02 175.39 1i9r n ASP 106 N 5.18 1.68 -3.66 3.03 5.68 -0.34 -4.93 116.55 123.20 1i9r n ASP 106 Ca -0.13 -1.66 -0.13 0.00 -0.50 0.00 0.00 54.79 52.38 1i9r n ASP 106 Cb 0.41 -0.08 -0.08 0.00 -1.14 0.00 0.00 41.12 40.24 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 -1.70 -0.71 0.07 -1.12 0.01 -1.24 -4.99 113.70 104.03 1i9r s SER 107 Ca 0.34 1.31 0.07 0.00 1.31 0.00 0.00 55.95 58.98 1i9r s SER 107 Cb 0.19 1.30 -0.03 0.00 0.21 0.00 0.00 66.02 67.69 1i9r s SER 107 CO 0.29 -0.22 -0.18 0.26 0.41 0.00 0.00 173.24 173.80 1i9r s TRP 108 N 0.60 1.52 0.92 2.43 0.52 -1.26 -1.37 118.94 122.29 1i9r s TRP 108 Ca -0.02 -0.41 -0.12 0.00 0.02 0.00 0.00 56.10 55.56 1i9r s TRP 108 Cb -0.05 -0.86 0.14 0.00 -1.15 0.00 0.00 33.47 31.56 1i9r s TRP 108 CO -0.03 0.12 1.12 0.20 0.02 0.00 0.00 176.95 178.37 1i9r s GLY 109 N -1.63 1.58 0.33 0.98 0.00 0.57 -4.64 107.32 104.51 1i9r s GLY 109 Ca 0.03 -0.42 0.06 0.00 0.00 0.00 0.00 44.72 44.39 1i9r s GLY 109 CO 0.03 0.13 1.88 1.46 0.00 0.00 0.00 173.10 176.60 1i9r h GLN 110 N -1.55 0.78 0.00 2.90 7.50 -1.90 -3.44 115.11 119.40 1i9r h GLN 110 Ca -0.51 -0.05 0.00 0.00 0.50 0.00 0.00 58.65 58.59 1i9r h GLN 110 Cb 1.32 -0.18 0.00 0.00 0.05 0.00 0.00 27.48 28.67 1i9r h GLN 110 CO 0.60 0.52 0.00 0.41 -1.50 0.00 0.00 178.83 178.86 1i9r n GLY 111 N -1.41 3.22 2.96 3.46 0.00 -1.26 -5.03 105.19 107.13 1i9r n GLY 111 Ca 0.17 -1.87 -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 -2.56 0.99 -0.51 2.61 2.01 0.96 -4.81 115.64 114.33 1i9r s THR 112 Ca 0.00 -0.35 -0.23 0.00 0.31 0.00 0.00 61.69 61.42 1i9r s THR 112 Cb 0.00 -0.95 0.04 0.00 0.01 0.00 0.00 72.50 71.60 1i9r s THR 112 CO 0.00 0.34 0.86 -0.22 -0.69 0.00 0.00 174.62 174.90 1i9r s LEU 113 N 1.04 4.26 -0.33 4.42 1.98 -1.26 -0.11 118.68 128.67 1i9r s LEU 113 Ca -0.08 -0.34 -0.10 0.00 -2.89 0.00 0.00 54.13 50.73 1i9r s LEU 113 Cb -0.15 -2.83 0.01 0.00 0.66 0.00 0.00 46.19 43.88 1i9r s LEU 113 CO -0.01 -1.09 0.16 -0.69 -1.89 0.00 0.00 176.35 172.84 1i9r s VAL 114 N 3.58 4.48 -0.23 1.68 1.01 0.20 -1.35 120.40 129.78 1i9r s VAL 114 Ca 0.29 -0.62 -0.00 0.00 0.00 0.00 0.00 61.98 61.65 1i9r s VAL 114 Cb -0.13 -3.37 0.03 0.00 0.00 0.00 0.00 36.38 32.91 1i9r s VAL 114 CO 0.20 -0.03 -0.11 0.28 0.00 0.00 0.00 175.10 175.43 1i9r s THR 115 N 1.57 2.54 -0.32 3.92 -1.32 -0.34 -1.25 115.64 120.44 1i9r s THR 115 Ca 0.03 -1.06 -0.06 0.00 -1.21 0.00 0.00 61.69 59.39 1i9r s THR 115 Cb -0.18 -2.25 0.03 0.00 -1.51 0.00 0.00 72.50 68.59 1i9r s THR 115 CO 0.06 0.29 0.09 0.68 -2.21 0.00 0.00 174.62 173.52 1i9r s VAL 116 N 1.29 3.82 0.06 5.08 -7.23 -1.25 -1.13 120.40 121.04 1i9r s VAL 116 Ca 0.01 -0.95 -0.11 0.00 -1.81 0.00 0.00 61.98 59.12 1i9r s VAL 116 Cb -0.16 -3.08 0.01 0.00 0.56 0.00 0.00 36.38 33.71 1i9r s VAL 116 CO -0.07 -0.06 0.24 -0.94 -0.31 0.00 0.00 175.10 173.96 1i9r s SER 117 N 1.44 -0.01 0.22 4.85 1.04 0.08 -4.58 113.70 116.74 1i9r s SER 117 Ca 0.00 -0.37 0.12 0.00 0.48 0.00 0.00 55.95 56.17 1i9r s SER 117 Cb -0.18 0.33 -0.01 0.00 0.10 0.00 0.00 66.02 66.25 1i9r s SER 117 CO 0.02 -0.63 1.40 0.77 0.98 0.00 0.00 173.24 175.78 1i9r h SER 118 N 3.18 0.00 -2.15 7.02 4.64 -1.94 -3.29 113.55 121.02 1i9r h SER 118 Ca -0.32 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.52 1i9r h SER 118 Cb 1.20 0.00 0.24 0.00 -0.31 0.00 0.00 62.40 63.53 1i9r h SER 118 CO 0.49 0.71 -1.39 0.00 -0.87 0.00 0.00 176.83 175.78 1i9r n ALA 119 N -2.29 -4.39 -2.98 5.18 0.00 -1.26 -5.02 120.51 109.75 1i9r n ALA 119 Ca 0.01 -1.22 -0.13 0.00 0.00 0.00 0.00 53.44 52.10 1i9r n ALA 119 Cb 0.81 -1.39 -0.14 0.00 0.00 0.00 0.00 19.45 18.72 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 -1.66 0.04 0.05 0.00 0.01 -1.26 -4.98 113.70 105.89 1i9r s SER 120 Ca 0.52 0.00 -0.04 0.00 1.31 0.00 0.00 55.95 57.74 1i9r s SER 120 Cb -0.08 -0.01 -0.03 0.00 0.21 0.00 0.00 66.02 66.10 1i9r s SER 120 CO 0.67 -0.01 0.05 0.41 0.41 0.00 0.00 173.24 174.77 1i9r n THR 121 N 3.22 0.23 -3.65 1.44 -1.04 -1.25 -4.78 114.28 108.44 1i9r n THR 121 Ca -0.14 -0.08 -0.04 0.00 -2.04 0.00 0.00 64.05 61.74 1i9r n THR 121 Cb 0.59 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 69.03 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 -0.17 0.19 0.92 -2.82 2.20 -0.67 -4.90 119.74 114.50 1i9r s LYS 122 Ca 0.10 0.23 -0.12 0.00 -0.36 0.00 0.00 55.97 55.83 1i9r s LYS 122 Cb -0.13 0.09 0.15 0.00 -1.51 0.00 0.00 37.83 36.42 1i9r s LYS 122 CO 0.10 -0.02 1.10 0.20 -0.36 0.00 0.00 175.35 176.36 1i9r s GLY 123 N 0.18 1.59 0.41 5.54 0.00 -1.26 -1.77 107.32 112.01 1i9r s GLY 123 Ca 0.05 -0.24 -0.02 0.00 0.00 0.00 0.00 44.72 44.51 1i9r s GLY 123 CO -0.13 0.30 0.56 -1.55 0.00 0.00 0.00 173.10 172.28 1i9r n PRO 124 N -3.93 0.02 -4.63 2.90 -0.04 -1.26 -4.21 135.00 123.86 1i9r n PRO 124 Ca 0.06 -1.33 -0.27 0.00 -0.04 0.00 0.00 63.50 61.92 1i9r n PRO 124 Cb 0.56 -0.43 -0.14 0.00 -0.04 0.00 0.00 33.50 33.45 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 -3.21 2.87 -0.01 3.54 0.01 0.50 -4.90 113.70 112.50 1i9r s SER 125 Ca 0.36 -0.61 0.07 0.00 1.31 0.00 0.00 55.95 57.07 1i9r s SER 125 Cb -0.02 -0.22 -0.02 0.00 0.21 0.00 0.00 66.02 65.97 1i9r s SER 125 CO 0.24 0.18 -0.23 0.68 0.41 0.00 0.00 173.24 174.52 1i9r s VAL 126 N -0.91 1.83 -0.02 3.43 -7.23 -1.25 0.18 120.40 116.43 1i9r s VAL 126 Ca 0.10 -1.02 -0.00 0.00 -1.81 0.00 0.00 61.98 59.25 1i9r s VAL 126 Cb -0.10 -1.53 0.03 0.00 0.56 0.00 0.00 36.38 35.35 1i9r s VAL 126 CO 0.03 0.49 0.04 -0.36 -0.31 0.00 0.00 175.10 174.99 1i9r s PHE 127 N -0.57 0.02 0.46 2.82 0.08 -0.15 -4.89 117.98 115.74 1i9r s PHE 127 Ca 0.09 0.15 -0.24 0.00 0.12 0.00 0.00 56.93 57.05 1i9r s PHE 127 Cb -0.09 -0.22 -0.07 0.00 -0.57 0.00 0.00 43.02 42.07 1i9r s PHE 127 CO -0.01 -0.09 1.28 -1.25 -0.10 0.00 0.00 175.22 175.06 1i9r s PRO 128 N 1.03 3.70 -0.77 0.24 0.04 -1.26 -0.86 135.00 137.11 1i9r s PRO 128 Ca -0.09 2.08 0.03 0.00 0.04 0.00 0.00 61.00 63.06 1i9r s PRO 128 Cb -0.12 -2.54 0.21 0.00 0.04 0.00 0.00 34.50 32.09 1i9r s PRO 128 CO -0.03 -0.69 0.68 1.28 0.04 0.00 0.00 177.00 178.28 1i9r n LEU 129 N -0.33 3.71 -4.78 -3.56 4.77 0.23 -4.82 117.00 112.20 1i9r n LEU 129 Ca 0.06 -5.24 -0.37 0.00 -0.03 0.00 0.00 56.01 50.44 1i9r n LEU 129 Cb 0.45 -0.87 -0.05 0.00 -2.33 0.00 0.00 43.42 40.62 1i9r n LEU 129 CO 0.53 1.75 0.72 0.00 -1.33 0.00 0.00 177.39 179.06 1i9r s ALA 130 N -1.71 3.12 0.64 -1.18 0.00 -1.26 -1.22 121.76 120.14 1i9r s ALA 130 Ca 0.29 0.66 -0.18 0.00 0.00 0.00 0.00 51.96 52.73 1i9r s ALA 130 Cb -0.01 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.84 1i9r s ALA 130 CO -0.11 -0.12 1.15 -0.35 0.00 0.00 0.00 175.76 176.33 1i9r n PRO 131 N 0.06 0.97 -3.58 0.00 -0.04 -1.25 -4.81 135.00 126.34 1i9r n PRO 131 Ca 0.04 0.38 -0.06 0.00 -0.04 0.00 0.00 63.50 63.83 1i9r n PRO 131 Cb 0.50 -2.38 -0.02 0.00 -0.04 0.00 0.00 33.50 31.56 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 -1.38 -0.26 0.44 3.54 1.04 -1.26 -4.08 113.70 111.75 1i9r s SER 132 Ca 0.80 -0.10 0.24 0.00 0.48 0.00 0.00 55.95 57.37 1i9r s SER 132 Cb -0.39 0.34 1.24 0.00 0.10 0.00 0.00 66.02 67.32 1i9r s SER 132 CO 0.43 -0.58 1.78 0.77 0.98 0.00 0.00 173.24 176.62 1i9r h SER 133 N 2.00 0.31 0.18 7.02 4.64 -1.95 0.84 113.55 126.60 1i9r h SER 133 Ca -0.21 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 1i9r h SER 133 Cb 1.22 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1i9r h SER 133 CO 0.28 0.05 0.00 0.29 -0.87 0.00 0.00 176.83 176.58 1i9r n LYS 134 N -4.50 0.30 -2.03 4.77 5.02 -1.26 -2.69 118.16 117.77 1i9r n LYS 134 Ca 0.25 0.10 0.01 0.00 -2.02 0.00 0.00 58.31 56.65 1i9r n LYS 134 Cb 0.98 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 34.53 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 -1.19 1.40 -3.45 4.39 3.41 0.29 -4.97 113.62 113.50 1i9r n SER 135 Ca 0.08 -2.15 -0.26 0.00 -0.26 0.00 0.00 58.87 56.29 1i9r n SER 135 Cb 0.09 -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 -0.06 0.17 -2.42 6.66 -1.04 -1.06 0.22 114.28 116.76 1i9r n THR 136 Ca 0.08 -4.22 -0.41 0.00 -2.04 0.00 0.00 64.05 57.46 1i9r n THR 136 Cb 0.98 -1.93 -0.04 0.00 -1.82 0.00 0.00 70.33 67.52 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 -1.07 7.13 0.31 8.00 0.01 -0.93 -4.82 113.70 122.35 1i9r s SER 137 Ca 0.33 2.17 0.00 0.00 1.31 0.00 0.00 55.95 59.76 1i9r s SER 137 Cb 0.08 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.71 1i9r s SER 137 CO -0.13 -0.34 0.00 0.61 0.41 0.00 0.00 173.24 173.78 1i9r n GLY 138 N 2.27 1.06 0.00 3.44 0.00 -1.26 -1.54 105.19 109.17 1i9r n GLY 138 Ca 0.04 -0.54 0.07 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.82 3.77 -0.02 0.00 -1.26 -4.78 105.19 102.08 1i9r n GLY 139 Ca 0.00 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.64 1i9r n GLY 139 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1i9r s THR 140 N -2.69 4.62 -0.03 2.61 -1.32 -0.59 -0.61 115.64 117.64 1i9r s THR 140 Ca 0.12 -0.57 0.06 0.00 -1.21 0.00 0.00 61.69 60.08 1i9r s THR 140 Cb 0.10 -3.16 -0.02 0.00 -1.51 0.00 0.00 72.50 67.90 1i9r s THR 140 CO 0.23 0.25 -0.20 0.00 -2.21 0.00 0.00 174.62 172.70 1i9r s ALA 141 N -1.27 2.45 -0.04 11.08 0.00 0.12 -2.18 121.76 131.91 1i9r s ALA 141 Ca 0.26 -1.06 -0.02 0.00 0.00 0.00 0.00 51.96 51.13 1i9r s ALA 141 Cb -0.12 -0.77 -0.04 0.00 0.00 0.00 0.00 23.12 22.19 1i9r s ALA 141 CO 0.17 0.55 0.09 0.00 0.00 0.00 0.00 175.76 176.58 1i9r s ALA 142 N -0.71 3.65 0.05 0.00 0.00 0.13 -1.17 121.76 123.71 1i9r s ALA 142 Ca 0.11 -0.79 -0.27 0.00 0.00 0.00 0.00 51.96 51.01 1i9r s ALA 142 Cb -0.10 -1.69 0.08 0.00 0.00 0.00 0.00 23.12 21.41 1i9r s ALA 142 CO 0.00 0.67 0.73 -0.48 0.00 0.00 0.00 175.76 176.68 1i9r s LEU 143 N -1.46 -0.51 0.00 0.00 2.34 -0.48 -3.94 118.68 114.63 1i9r s LEU 143 Ca 0.20 0.14 0.00 0.00 0.06 0.00 0.00 54.13 54.53 1i9r s LEU 143 Cb -0.12 2.36 0.00 0.00 -0.56 0.00 0.00 46.19 47.87 1i9r s LEU 143 CO 0.10 -0.76 0.00 0.61 -1.06 0.00 0.00 176.35 175.24 1i9r n GLY 144 N -0.06 -1.61 3.71 -3.48 0.00 -0.36 -0.11 105.19 103.28 1i9r n GLY 144 Ca -0.14 -1.08 -0.32 0.00 0.00 0.00 0.00 46.02 44.47 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 -1.81 5.05 -0.92 0.00 2.96 -0.04 -0.73 118.68 123.20 1i9r s LEU 146 Ca 0.22 -1.59 -0.19 0.00 -0.22 0.00 0.00 54.13 52.36 1i9r s LEU 146 Cb -0.12 -1.93 0.13 0.00 0.50 0.00 0.00 46.19 44.77 1i9r s LEU 146 CO 0.14 -0.51 1.11 -0.69 -1.32 0.00 0.00 176.35 175.08 1i9r s VAL 147 N 1.35 4.72 0.11 1.68 1.01 -0.11 -0.98 120.40 128.18 1i9r s VAL 147 Ca 0.03 -1.53 -0.09 0.00 0.00 0.00 0.00 61.98 60.39 1i9r s VAL 147 Cb -0.23 -4.77 -0.06 0.00 0.00 0.00 0.00 36.38 31.32 1i9r s VAL 147 CO 0.01 -1.50 0.42 -0.54 0.00 0.00 0.00 175.10 173.49 1i9r s LYS 148 N 2.72 3.75 0.00 2.72 -0.14 0.47 -2.07 119.74 127.20 1i9r s LYS 148 Ca 0.32 0.16 0.00 0.00 -1.36 0.00 0.00 55.97 55.09 1i9r s LYS 148 Cb -0.05 -2.93 0.00 0.00 -1.68 0.00 0.00 37.83 33.17 1i9r s LYS 148 CO -0.09 0.51 0.00 -0.25 -0.76 0.00 0.00 175.35 174.77 1i9r n ASP 149 N 0.65 -5.48 -3.80 2.83 8.00 -0.88 0.19 116.55 118.05 1i9r n ASP 149 Ca -0.06 0.37 -0.14 0.00 0.71 0.00 0.00 54.79 55.67 1i9r n ASP 149 Cb 0.52 -1.29 -0.08 0.00 -0.02 0.00 0.00 41.12 40.25 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 -0.75 1.20 -0.29 1.24 -0.00 -1.11 -4.21 117.35 113.43 1i9r s TYR 150 Ca 0.00 -1.36 -0.22 0.00 -0.00 0.00 0.00 57.07 55.49 1i9r s TYR 150 Cb 0.00 -0.43 0.17 0.00 -0.00 0.00 0.00 41.96 41.69 1i9r s TYR 150 CO 0.00 -0.82 1.21 0.12 -0.00 0.00 0.00 175.55 176.06 1i9r s PHE 151 N -3.78 -0.27 0.34 -3.49 2.19 -0.73 -1.55 117.98 110.69 1i9r s PHE 151 Ca 0.36 0.61 0.01 0.00 0.33 0.00 0.00 56.93 58.24 1i9r s PHE 151 Cb 0.04 0.35 0.07 0.00 -1.31 0.00 0.00 43.02 42.17 1i9r s PHE 151 CO 0.17 -0.13 0.47 -0.35 1.83 0.00 0.00 175.22 177.21 1i9r n PRO 152 N 2.36 0.37 -0.99 10.12 -0.04 -1.26 -1.66 135.00 143.90 1i9r n PRO 152 Ca -0.13 -1.37 -0.30 0.00 -0.04 0.00 0.00 63.50 61.66 1i9r n PRO 152 Cb 0.57 -0.28 0.17 0.00 -0.04 0.00 0.00 33.50 33.91 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 -3.63 0.72 0.20 0.54 2.02 -1.26 -4.74 118.70 112.55 1i9r s GLU 153 Ca 0.32 0.91 0.07 0.00 0.02 0.00 0.00 54.97 56.29 1i9r s GLU 153 Cb -0.02 -1.74 -0.04 0.00 0.10 0.00 0.00 34.13 32.43 1i9r s GLU 153 CO 0.21 -2.63 0.10 -1.25 0.02 0.00 0.00 175.26 171.70 1i9r s PRO 154 N -4.80 2.70 -0.26 0.39 0.04 -1.26 -4.94 135.00 126.87 1i9r s PRO 154 Ca 0.65 -1.03 0.00 0.00 0.04 0.00 0.00 61.00 60.66 1i9r s PRO 154 Cb -0.20 -2.50 0.05 0.00 0.04 0.00 0.00 34.50 31.89 1i9r s PRO 154 CO 0.59 0.45 -0.07 0.54 0.04 0.00 0.00 177.00 178.55 1i9r s VAL 155 N -1.88 2.61 0.22 -0.36 0.11 -1.26 -4.49 120.40 115.35 1i9r s VAL 155 Ca 0.30 -1.35 -0.24 0.00 -2.93 0.00 0.00 61.98 57.76 1i9r s VAL 155 Cb -0.09 -2.44 -0.09 0.00 -1.53 0.00 0.00 36.38 32.23 1i9r s VAL 155 CO 0.22 0.04 0.80 0.28 -3.33 0.00 0.00 175.10 173.11 1i9r s THR 156 N 1.22 4.39 -0.07 5.04 -1.32 -0.42 -4.87 115.64 119.61 1i9r s THR 156 Ca -0.04 1.60 0.01 0.00 -1.21 0.00 0.00 61.69 62.05 1i9r s THR 156 Cb -0.19 -4.02 0.02 0.00 -1.51 0.00 0.00 72.50 66.80 1i9r s THR 156 CO -0.04 0.33 -0.09 -0.69 -2.21 0.00 0.00 174.62 171.92 1i9r s VAL 157 N -1.38 0.94 0.14 5.08 1.01 -1.26 -0.67 120.40 124.26 1i9r s VAL 157 Ca 0.42 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 62.11 1i9r s VAL 157 Cb -0.20 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 1i9r s VAL 157 CO 0.24 0.32 -0.12 -0.55 0.00 0.00 0.00 175.10 174.99 1i9r s SER 158 N 0.94 1.90 -0.01 3.32 0.15 -1.00 -4.92 113.70 114.07 1i9r s SER 158 Ca -0.10 -0.91 0.04 0.00 0.70 0.00 0.00 55.95 55.68 1i9r s SER 158 Cb -0.15 -0.04 -0.03 0.00 -1.71 0.00 0.00 66.02 64.09 1i9r s SER 158 CO 0.01 -0.24 -0.10 0.26 1.20 0.00 0.00 173.24 174.37 1i9r s TRP 159 N -2.72 2.80 -1.05 3.44 0.52 -1.26 0.13 118.94 120.80 1i9r s TRP 159 Ca 0.13 -0.09 -0.26 0.00 0.02 0.00 0.00 56.10 55.89 1i9r s TRP 159 Cb -0.01 -1.61 0.04 0.00 -1.15 0.00 0.00 33.47 30.74 1i9r s TRP 159 CO 0.02 0.30 0.50 0.09 0.02 0.00 0.00 176.95 177.88 1i9r n ASN 160 N 1.84 -2.90 -3.68 2.95 3.02 0.12 -1.04 115.26 115.57 1i9r n ASN 160 Ca -0.16 -1.10 -0.14 0.00 -0.03 0.00 0.00 54.58 53.15 1i9r n ASN 160 Cb 0.52 -1.32 0.01 0.00 -0.61 0.00 0.00 39.78 38.38 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 -1.70 -1.39 0.00 6.41 7.64 -1.26 -1.49 113.62 121.82 1i9r n SER 161 Ca -0.11 -0.42 0.00 0.00 1.01 0.00 0.00 58.87 59.35 1i9r n SER 161 Cb 0.48 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 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 -1.24 2.41 0.28 0.23 0.00 -0.21 -4.86 105.19 101.80 1i9r n GLY 162 Ca -0.05 -0.48 0.10 0.00 0.00 0.00 0.00 46.02 45.59 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 0.34 -2.53 4.61 0.00 -0.55 -3.74 120.51 118.63 1i9r n ALA 163 Ca 0.00 0.87 -0.43 0.00 0.00 0.00 0.00 53.44 53.88 1i9r n ALA 163 Cb 0.00 -0.60 -0.06 0.00 0.00 0.00 0.00 19.45 18.79 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 -10.41 4.38 -0.00 0.00 2.96 -1.18 -4.76 118.68 109.67 1i9r s LEU 164 Ca -0.11 -0.22 0.00 0.00 -0.22 0.00 0.00 54.13 53.58 1i9r s LEU 164 Cb 0.23 -2.84 0.00 0.00 0.50 0.00 0.00 46.19 44.08 1i9r s LEU 164 CO 0.63 -0.84 0.75 0.35 -1.32 0.00 0.00 176.35 175.92 1i9r n THR 165 N 5.98 0.03 -4.66 3.68 -2.24 -1.25 -4.06 114.28 111.76 1i9r n THR 165 Ca 0.00 -0.03 -0.33 0.00 -2.27 0.00 0.00 64.05 61.42 1i9r n THR 165 Cb 0.48 0.75 -0.14 0.00 -2.10 0.00 0.00 70.33 69.32 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 -0.51 4.09 0.00 3.42 0.15 -1.26 -4.45 113.70 115.13 1i9r s SER 166 Ca 0.00 -0.32 0.00 0.00 0.70 0.00 0.00 55.95 56.33 1i9r s SER 166 Cb 0.00 -1.63 0.00 0.00 -1.71 0.00 0.00 66.02 62.68 1i9r s SER 166 CO 0.00 0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.20 1i9r n GLY 167 N 3.64 1.33 3.77 9.45 0.00 -1.26 -4.68 105.19 117.44 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 -2.72 3.43 -0.31 1.61 1.01 -1.26 -3.01 120.40 119.16 1i9r s VAL 168 Ca 0.00 1.26 -0.02 0.00 0.00 0.00 0.00 61.98 63.22 1i9r s VAL 168 Cb 0.00 -3.73 0.12 0.00 0.00 0.00 0.00 36.38 32.76 1i9r s VAL 168 CO 0.00 0.17 0.18 -1.00 0.00 0.00 0.00 175.10 174.45 1i9r s HIS 169 N -1.39 0.29 -0.44 5.22 3.76 0.19 -4.95 115.29 117.98 1i9r s HIS 169 Ca 0.52 -0.97 -0.16 0.00 -0.15 0.00 0.00 55.06 54.30 1i9r s HIS 169 Cb -0.29 -0.83 0.04 0.00 1.11 0.00 0.00 32.58 32.61 1i9r s HIS 169 CO 0.37 -0.85 0.41 -0.08 -0.85 0.00 0.00 174.74 173.73 1i9r s THR 170 N 1.85 5.15 0.85 1.30 -1.32 -1.26 -1.46 115.64 120.75 1i9r s THR 170 Ca 0.12 -0.63 -0.12 0.00 -1.21 0.00 0.00 61.69 59.85 1i9r s THR 170 Cb -0.17 -4.05 0.11 0.00 -1.51 0.00 0.00 72.50 66.87 1i9r s THR 170 CO -0.26 -0.47 1.18 0.49 -2.21 0.00 0.00 174.62 173.35 1i9r n PHE 171 N 5.43 1.10 -2.46 9.09 3.01 -0.92 -4.97 117.46 127.75 1i9r n PHE 171 Ca -0.10 0.40 -0.37 0.00 1.01 0.00 0.00 57.45 58.40 1i9r n PHE 171 Cb 0.46 -2.06 -0.03 0.00 -0.01 0.00 0.00 39.48 37.84 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 -4.32 4.07 0.72 -1.08 0.04 -1.26 -4.60 135.00 128.57 1i9r s PRO 172 Ca 0.71 1.60 -0.16 0.00 0.04 0.00 0.00 61.00 63.19 1i9r s PRO 172 Cb -0.27 -2.53 0.03 0.00 0.04 0.00 0.00 34.50 31.77 1i9r s PRO 172 CO 0.54 -0.24 1.26 0.00 0.04 0.00 0.00 177.00 178.60 1i9r n ALA 173 N -0.13 0.66 -3.60 8.56 0.00 -1.26 -4.79 120.51 119.94 1i9r n ALA 173 Ca 0.05 -0.14 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 1i9r n ALA 173 Cb 0.49 -2.30 -0.16 0.00 0.00 0.00 0.00 19.45 17.48 1i9r n ALA 173 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1i9r s VAL 174 N -1.70 -0.16 -0.49 0.00 1.01 -1.25 -4.96 120.40 112.85 1i9r s VAL 174 Ca 0.79 0.01 -0.26 0.00 0.00 0.00 0.00 61.98 62.51 1i9r s VAL 174 Cb -0.34 -0.49 -0.07 0.00 0.00 0.00 0.00 36.38 35.48 1i9r s VAL 174 CO 0.45 -0.14 2.42 -0.22 0.00 0.00 0.00 175.10 177.60 1i9r s LEU 175 N 2.20 3.41 0.94 3.92 2.96 -1.26 -2.84 118.68 128.01 1i9r s LEU 175 Ca 0.04 1.08 -0.12 0.00 -0.22 0.00 0.00 54.13 54.90 1i9r s LEU 175 Cb -0.15 -2.50 0.15 0.00 0.50 0.00 0.00 46.19 44.20 1i9r s LEU 175 CO -0.08 -2.90 1.11 0.00 -1.32 0.00 0.00 176.35 173.16 1i9r s GLN 176 N 8.30 0.90 0.05 1.98 -2.07 -1.06 -5.00 119.66 122.77 1i9r s GLN 176 Ca 0.98 0.42 -0.01 0.00 -1.82 0.00 0.00 55.36 54.93 1i9r s GLN 176 Cb -0.17 -1.80 0.01 0.00 -1.09 0.00 0.00 33.01 29.96 1i9r s GLN 176 CO 0.26 -2.39 0.03 0.45 -1.32 0.00 0.00 175.29 172.31 1i9r n SER 177 N -3.92 -1.46 -0.42 12.60 2.88 -1.26 -4.44 113.62 117.59 1i9r n SER 177 Ca 0.06 -0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1i9r n SER 177 Cb 0.58 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 64.00 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 -2.09 -3.62 -0.05 -3.46 3.41 -1.26 -4.24 113.62 102.31 1i9r n SER 178 Ca 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.67 1i9r n SER 178 Cb 0.02 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.92 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 -0.07 3.94 5.00 0.00 -1.26 -5.04 105.19 107.75 1i9r n GLY 179 Ca 0.00 -0.32 -0.25 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.38 4.01 0.42 0.99 1.02 -1.26 -4.85 118.68 116.64 1i9r s LEU 180 Ca 0.05 0.49 -0.05 0.00 0.02 0.00 0.00 54.13 54.65 1i9r s LEU 180 Cb 0.09 -3.35 -0.04 0.00 0.02 0.00 0.00 46.19 42.91 1i9r s LEU 180 CO 0.43 -0.28 0.71 -0.31 0.02 0.00 0.00 176.35 176.92 1i9r s TYR 181 N -2.28 3.53 -0.26 0.29 2.02 -0.59 -2.55 117.35 117.51 1i9r s TYR 181 Ca 0.41 0.72 -0.01 0.00 -0.37 0.00 0.00 57.07 57.82 1i9r s TYR 181 Cb -0.10 -2.21 0.14 0.00 -0.40 0.00 0.00 41.96 39.40 1i9r s TYR 181 CO 0.35 -0.13 0.40 0.45 -1.57 0.00 0.00 175.55 175.05 1i9r s SER 182 N -3.88 0.23 0.21 2.29 0.15 -1.13 -2.07 113.70 109.50 1i9r s SER 182 Ca 0.46 0.05 0.10 0.00 0.70 0.00 0.00 55.95 57.25 1i9r s SER 182 Cb -0.10 1.15 -0.04 0.00 -1.71 0.00 0.00 66.02 65.32 1i9r s SER 182 CO 0.40 -0.32 -0.13 -1.48 1.20 0.00 0.00 173.24 172.92 1i9r s LEU 183 N 2.56 2.84 -0.09 3.45 0.05 -0.88 -3.77 118.68 122.84 1i9r s LEU 183 Ca 0.12 -0.71 0.03 0.00 0.05 0.00 0.00 54.13 53.62 1i9r s LEU 183 Cb -0.14 -1.49 0.00 0.00 -2.05 0.00 0.00 46.19 42.51 1i9r s LEU 183 CO -0.21 0.08 -0.20 -0.55 -0.55 0.00 0.00 176.35 174.92 1i9r s SER 184 N -3.02 2.62 -0.20 1.48 0.15 -1.26 -0.94 113.70 112.54 1i9r s SER 184 Ca 0.26 -0.47 -0.07 0.00 0.70 0.00 0.00 55.95 56.37 1i9r s SER 184 Cb -0.08 -1.20 -0.04 0.00 -1.71 0.00 0.00 66.02 63.00 1i9r s SER 184 CO 0.15 0.12 0.06 -0.55 1.20 0.00 0.00 173.24 174.21 1i9r s SER 185 N 0.45 5.43 0.14 5.45 0.15 0.09 -2.16 113.70 123.25 1i9r s SER 185 Ca -0.17 -0.01 0.06 0.00 0.70 0.00 0.00 55.95 56.53 1i9r s SER 185 Cb -0.17 -1.94 -0.04 0.00 -1.71 0.00 0.00 66.02 62.16 1i9r s SER 185 CO 0.07 0.12 -0.14 -0.69 1.20 0.00 0.00 173.24 173.80 1i9r s VAL 186 N 0.67 1.40 -0.05 4.45 1.01 -0.54 -0.05 120.40 127.30 1i9r s VAL 186 Ca 0.03 -1.82 -0.10 0.00 0.00 0.00 0.00 61.98 60.09 1i9r s VAL 186 Cb -0.13 -1.64 0.02 0.00 0.00 0.00 0.00 36.38 34.62 1i9r s VAL 186 CO 0.02 -0.45 0.24 0.54 0.00 0.00 0.00 175.10 175.45 1i9r s VAL 187 N -2.32 0.04 -0.12 2.92 0.11 0.84 0.57 120.40 122.44 1i9r s VAL 187 Ca 0.12 -0.30 -0.00 0.00 -2.93 0.00 0.00 61.98 58.86 1i9r s VAL 187 Cb -0.04 -0.45 -0.02 0.00 -1.53 0.00 0.00 36.38 34.34 1i9r s VAL 187 CO 0.03 -0.17 -0.10 0.42 -3.33 0.00 0.00 175.10 171.95 1i9r s THR 188 N -0.65 3.32 0.21 5.04 -4.23 -1.16 -1.39 115.64 116.77 1i9r s THR 188 Ca -0.07 -0.58 0.04 0.00 -1.18 0.00 0.00 61.69 59.89 1i9r s THR 188 Cb -0.04 -2.39 -0.05 0.00 1.34 0.00 0.00 72.50 71.36 1i9r s THR 188 CO 0.02 0.54 -0.04 0.68 -0.54 0.00 0.00 174.62 175.28 1i9r s VAL 189 N 0.05 1.10 0.32 2.29 -7.23 -0.32 -4.70 120.40 111.91 1i9r s VAL 189 Ca -0.03 -2.05 -0.29 0.00 -1.81 0.00 0.00 61.98 57.80 1i9r s VAL 189 Cb -0.14 -2.19 -0.10 0.00 0.56 0.00 0.00 36.38 34.50 1i9r s VAL 189 CO 0.04 -0.46 1.32 -2.84 -0.31 0.00 0.00 175.10 172.85 1i9r s PRO 190 N -3.82 4.35 0.09 4.82 0.02 -1.26 0.11 135.00 139.31 1i9r s PRO 190 Ca 0.25 2.22 -0.29 0.00 0.02 0.00 0.00 61.00 63.20 1i9r s PRO 190 Cb 0.05 -3.07 -0.14 0.00 0.02 0.00 0.00 34.50 31.35 1i9r s PRO 190 CO 0.06 -0.21 1.65 0.77 -0.33 0.00 0.00 177.00 178.95 1i9r h SER 191 N 3.51 -0.63 0.00 2.53 0.02 -1.14 -1.58 113.55 116.26 1i9r h SER 191 Ca -0.49 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 1i9r h SER 191 Cb 1.23 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.97 1i9r h SER 191 CO 0.66 -0.38 0.39 -1.54 -1.14 0.00 0.00 176.83 174.82 1i9r n SER 192 N -5.38 0.18 -0.03 3.07 3.41 -1.26 -1.37 113.62 112.25 1i9r n SER 192 Ca -0.10 0.40 -0.16 0.00 -0.26 0.00 0.00 58.87 58.76 1i9r n SER 192 Cb 0.28 -0.32 -0.12 0.00 -0.26 0.00 0.00 64.21 63.79 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 0.20 -0.64 4.04 4.64 -1.65 -3.36 113.55 116.78 1i9r h SER 193 Ca 0.00 -0.85 0.19 0.00 -0.47 0.00 0.00 61.79 60.65 1i9r h SER 193 Cb 0.78 -0.06 -0.03 0.00 -0.31 0.00 0.00 62.40 62.78 1i9r h SER 193 CO 0.00 1.03 0.59 0.18 -0.87 0.00 0.00 176.83 177.76 1i9r n LEU 194 N -4.48 0.00 -0.05 5.97 4.77 -0.47 -0.57 117.00 122.16 1i9r n LEU 194 Ca -0.10 0.38 -0.01 0.00 -0.03 0.00 0.00 56.01 56.25 1i9r n LEU 194 Cb 0.54 -0.16 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 1i9r n LEU 194 CO 0.39 -0.38 -0.04 1.23 -1.33 0.00 0.00 177.39 177.26 1i9r h GLY 195 N 0.00 0.00 1.92 -0.72 0.00 -1.79 -3.38 103.07 99.09 1i9r h GLY 195 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.63 1i9r h GLY 195 CO -0.00 0.00 -0.07 -0.91 0.00 0.00 0.00 176.54 175.56 1i9r h THR 196 N -1.00 0.00 -3.68 4.70 1.35 -1.07 -3.46 112.91 109.76 1i9r h THR 196 Ca -0.00 -0.66 -0.68 0.00 -0.55 0.00 0.00 66.41 64.52 1i9r h THR 196 Cb 0.09 1.62 -0.18 0.00 -1.73 0.00 0.00 68.15 67.95 1i9r h THR 196 CO -0.00 0.00 -0.71 -1.10 -0.25 0.00 0.00 175.52 173.46 1i9r s GLN 197 N -3.15 2.58 0.25 4.72 -1.52 -0.19 -5.13 119.66 117.22 1i9r s GLN 197 Ca 0.09 -0.68 0.09 0.00 -1.95 0.00 0.00 55.36 52.90 1i9r s GLN 197 Cb 0.10 -2.50 -0.04 0.00 -0.22 0.00 0.00 33.01 30.35 1i9r s GLN 197 CO 0.63 0.62 0.03 -0.08 -0.25 0.00 0.00 175.29 176.25 1i9r s THR 198 N -0.92 3.68 -0.05 -0.19 -1.32 -1.26 -4.50 115.64 111.08 1i9r s THR 198 Ca 0.15 -1.75 -0.04 0.00 -1.21 0.00 0.00 61.69 58.84 1i9r s THR 198 Cb -0.11 -2.96 0.01 0.00 -1.51 0.00 0.00 72.50 67.94 1i9r s THR 198 CO 0.05 -0.34 0.12 -0.31 -2.21 0.00 0.00 174.62 171.93 1i9r s TYR 199 N -2.21 -0.13 -0.01 9.09 2.02 -1.26 -5.02 117.35 119.83 1i9r s TYR 199 Ca 0.31 0.32 0.01 0.00 -0.37 0.00 0.00 57.07 57.34 1i9r s TYR 199 Cb -0.07 0.03 0.01 0.00 -0.40 0.00 0.00 41.96 41.52 1i9r s TYR 199 CO 0.21 -0.07 -0.02 0.42 -1.57 0.00 0.00 175.55 174.52 1i9r s ILE 200 N 0.17 0.18 0.01 2.71 -1.09 -1.26 -1.05 121.20 120.87 1i9r s ILE 200 Ca -0.01 -0.05 -0.01 0.00 -2.23 0.00 0.00 60.65 58.35 1i9r s ILE 200 Cb -0.02 -0.19 -0.04 0.00 -1.58 0.00 0.00 42.46 40.64 1i9r s ILE 200 CO -0.00 0.08 0.15 0.00 -1.23 0.00 0.00 174.94 173.93 1i9r s ASN 202 N -2.05 4.31 0.08 0.00 -0.87 0.35 -1.64 114.94 115.12 1i9r s ASN 202 Ca 0.28 -3.09 -0.30 0.00 -1.57 0.00 0.00 52.86 48.17 1i9r s ASN 202 Cb -0.12 -1.59 -0.05 0.00 -0.02 0.00 0.00 41.25 39.47 1i9r s ASN 202 CO 0.20 -0.21 1.01 -0.69 -2.57 0.00 0.00 177.10 174.83 1i9r s VAL 203 N -0.39 4.49 -0.13 1.60 1.01 0.10 -2.37 120.40 124.71 1i9r s VAL 203 Ca 0.18 1.95 -0.02 0.00 0.00 0.00 0.00 61.98 64.09 1i9r s VAL 203 Cb -0.23 -4.25 0.04 0.00 0.00 0.00 0.00 36.38 31.94 1i9r s VAL 203 CO -0.02 0.24 -0.00 0.21 0.00 0.00 0.00 175.10 175.53 1i9r s ASN 204 N 0.42 2.26 -0.83 3.32 3.84 0.16 -0.34 114.94 123.77 1i9r s ASN 204 Ca 0.50 -0.43 0.02 0.00 0.21 0.00 0.00 52.86 53.15 1i9r s ASN 204 Cb -0.24 -0.60 0.26 0.00 -0.55 0.00 0.00 41.25 40.13 1i9r s ASN 204 CO 0.30 -0.22 1.00 1.57 -2.79 0.00 0.00 177.10 176.96 1i9r n HIS 205 N 5.06 3.24 -0.33 0.43 -0.00 0.97 -1.30 115.22 123.28 1i9r n HIS 205 Ca -0.09 -3.61 0.07 0.00 0.46 0.00 0.00 57.72 54.54 1i9r n HIS 205 Cb 0.49 -0.88 0.16 0.00 -0.12 0.00 0.00 29.99 29.64 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 4.87 0.01 0.00 1.57 1.57 -1.79 0.90 116.57 123.70 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 0.66 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.97 1i9r h LYS 206 CO 1.01 0.00 0.00 -2.30 -0.57 0.00 0.00 179.45 177.60 1i9r n PRO 207 N -5.56 0.00 -0.07 3.15 -0.02 -1.26 0.11 135.00 131.34 1i9r n PRO 207 Ca 0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1i9r n PRO 207 Cb 0.52 -1.29 0.00 0.00 -0.02 0.00 0.00 33.50 32.71 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 -0.55 0.00 0.00 2.55 3.41 0.27 -4.69 113.62 114.62 1i9r n SER 208 Ca 0.00 -1.05 0.00 0.00 -0.26 0.00 0.00 58.87 57.56 1i9r n SER 208 Cb 0.00 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 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 -4.65 4.04 5.15 0.30 -4.85 115.26 115.26 1i9r n ASN 209 Ca 0.00 0.00 -0.40 0.00 -0.60 0.00 0.00 54.58 53.58 1i9r n ASN 209 Cb 0.51 -1.11 0.03 0.00 -0.53 0.00 0.00 39.78 38.68 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 3.05 -3.62 -0.44 -1.04 -1.00 -4.80 114.28 104.43 1i9r n THR 210 Ca 0.00 -0.50 -0.03 0.00 -2.04 0.00 0.00 64.05 61.48 1i9r n THR 210 Cb 0.00 -1.31 -0.06 0.00 -1.82 0.00 0.00 70.33 67.13 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 -2.41 0.49 0.02 -2.82 2.47 -1.26 -0.02 119.74 116.21 1i9r s LYS 211 Ca 0.68 0.89 0.00 0.00 -1.56 0.00 0.00 55.97 55.98 1i9r s LYS 211 Cb -0.48 0.17 -0.02 0.00 -1.46 0.00 0.00 37.83 36.04 1i9r s LYS 211 CO 0.53 -0.11 -0.04 0.08 0.16 0.00 0.00 175.35 175.97 1i9r s VAL 212 N 1.62 0.16 -0.46 4.02 1.01 0.54 -5.00 120.40 122.29 1i9r s VAL 212 Ca -0.09 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 60.95 1i9r s VAL 212 Cb -0.05 -0.35 0.14 0.00 0.00 0.00 0.00 36.38 36.13 1i9r s VAL 212 CO -0.17 -0.51 0.27 -1.81 0.00 0.00 0.00 175.10 172.89 1i9r s ASP 213 N -1.53 3.51 -0.25 3.32 1.01 -1.26 -0.72 116.67 120.74 1i9r s ASP 213 Ca -0.14 -2.77 -0.29 0.00 0.71 0.00 0.00 52.55 50.05 1i9r s ASP 213 Cb -0.09 -1.01 0.01 0.00 1.01 0.00 0.00 42.92 42.84 1i9r s ASP 213 CO -0.01 -0.24 1.07 -0.75 0.21 0.00 0.00 175.17 175.45 1i9r s LYS 214 N 0.17 4.19 -0.54 8.23 2.36 -0.65 -4.82 119.74 128.69 1i9r s LYS 214 Ca 0.20 1.29 -0.25 0.00 -2.55 0.00 0.00 55.97 54.65 1i9r s LYS 214 Cb -0.19 -3.68 0.04 0.00 -1.05 0.00 0.00 37.83 32.94 1i9r s LYS 214 CO -0.03 -0.73 1.00 0.21 1.55 0.00 0.00 175.35 177.34 1i9r s LYS 215 N 3.38 3.42 -0.14 4.03 2.20 -1.26 -0.55 119.74 130.81 1i9r s LYS 215 Ca 0.45 -0.05 -0.29 0.00 -0.36 0.00 0.00 55.97 55.72 1i9r s LYS 215 Cb -0.15 -4.02 -0.01 0.00 -1.51 0.00 0.00 37.83 32.15 1i9r s LYS 215 CO 0.10 -1.47 1.07 0.08 -0.36 0.00 0.00 175.35 174.77 1i9r s VAL 216 N 4.13 4.62 0.10 4.02 1.01 -0.22 -4.97 120.40 129.09 1i9r s VAL 216 Ca 0.35 1.92 0.08 0.00 0.00 0.00 0.00 61.98 64.33 1i9r s VAL 216 Cb -0.11 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 1i9r s VAL 216 CO 0.22 -0.07 -0.21 -1.61 0.00 0.00 0.00 175.10 173.44 1i9r s GLU 217 N 2.56 1.12 -1.06 2.72 2.02 -1.26 -4.24 118.70 120.55 1i9r s GLU 217 Ca 0.49 -1.16 -0.23 0.00 0.02 0.00 0.00 54.97 54.09 1i9r s GLU 217 Cb -0.19 -1.38 -0.12 0.00 0.10 0.00 0.00 34.13 32.55 1i9r s GLU 217 CO 0.15 0.32 1.93 -0.35 0.02 0.00 0.00 175.26 177.32 1i9r n PRO 218 N 1.08 1.50 0.00 0.39 -0.04 -1.26 -4.50 135.00 132.16 1i9r n PRO 218 Ca -0.19 -2.27 0.13 0.00 -0.04 0.00 0.00 63.50 61.12 1i9r n PRO 218 Cb 0.54 -3.53 0.79 0.00 -0.04 0.00 0.00 33.50 31.26 1i9r n PRO 218 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09