#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ibg s VAL 3 N 0.00 -0.00 -0.08 1.39 1.01 -1.26 -4.95 120.40 116.51 1ibg s VAL 3 Ca 0.00 0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.01 1ibg s VAL 3 Cb 0.00 -0.97 -0.02 0.00 0.00 0.00 0.00 36.38 35.39 1ibg s VAL 3 CO 0.00 0.00 -0.16 -0.76 0.00 0.00 0.00 175.10 174.19 1ibg s LEU 4 N 1.33 2.63 -0.25 3.92 1.43 -1.26 -1.67 118.68 124.80 1ibg s LEU 4 Ca -0.08 -0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 52.73 1ibg s LEU 4 Cb -0.05 -1.54 0.03 0.00 0.03 0.00 0.00 46.19 44.65 1ibg s LEU 4 CO -0.15 0.27 -0.07 -0.89 0.23 0.00 0.00 176.35 175.74 1ibg s THR 5 N -0.30 2.76 -0.16 5.49 2.01 -0.07 -4.11 115.64 121.26 1ibg s THR 5 Ca 0.02 -1.09 -0.08 0.00 0.31 0.00 0.00 61.69 60.85 1ibg s THR 5 Cb -0.13 -2.41 -0.04 0.00 0.01 0.00 0.00 72.50 69.93 1ibg s THR 5 CO 0.03 0.19 0.13 -1.10 -0.69 0.00 0.00 174.62 173.18 1ibg s GLN 6 N 1.30 3.81 0.03 4.92 -0.21 -1.26 -0.88 119.66 127.36 1ibg s GLN 6 Ca -0.01 -0.18 0.01 0.00 0.02 0.00 0.00 55.36 55.20 1ibg s GLN 6 Cb -0.17 -3.30 -0.02 0.00 1.00 0.00 0.00 33.01 30.52 1ibg s GLN 6 CO -0.05 0.54 -0.05 -1.54 -2.12 0.00 0.00 175.29 172.06 1ibg s SER 7 N -0.32 0.55 0.95 5.90 1.04 -1.19 -4.47 113.70 116.14 1ibg s SER 7 Ca 0.11 -0.51 -0.11 0.00 0.48 0.00 0.00 55.95 55.92 1ibg s SER 7 Cb -0.12 0.06 0.16 0.00 0.10 0.00 0.00 66.02 66.23 1ibg s SER 7 CO 0.01 -0.24 1.09 -2.16 0.98 0.00 0.00 173.24 172.92 1ibg s PRO 8 N -1.46 0.82 0.22 4.02 0.04 -1.26 -1.01 135.00 136.37 1ibg s PRO 8 Ca -0.12 0.99 0.15 0.00 0.04 0.00 0.00 61.00 62.06 1ibg s PRO 8 Cb -0.10 -1.75 -0.00 0.00 0.04 0.00 0.00 34.50 32.70 1ibg s PRO 8 CO -0.00 -2.59 1.30 0.00 0.04 0.00 0.00 177.00 175.74 1ibg h ALA 9 N -1.81 0.64 -2.46 8.56 0.00 -1.83 -3.41 119.26 118.95 1ibg h ALA 9 Ca -0.50 -0.57 -0.22 0.00 0.00 0.00 0.00 54.91 53.61 1ibg h ALA 9 Cb 1.29 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.90 1ibg h ALA 9 CO 0.51 0.74 -0.70 0.45 0.00 0.00 0.00 179.25 180.24 1ibg s SER 10 N -6.33 1.01 -0.13 0.00 0.15 -1.26 -0.81 113.70 106.33 1ibg s SER 10 Ca 0.02 -0.89 -0.20 0.00 0.70 0.00 0.00 55.95 55.58 1ibg s SER 10 Cb 0.08 0.09 0.05 0.00 -1.71 0.00 0.00 66.02 64.53 1ibg s SER 10 CO 0.77 -0.42 0.50 -0.22 1.20 0.00 0.00 173.24 175.07 1ibg s LEU 11 N -2.68 0.08 -0.04 3.45 2.96 0.11 -4.85 118.68 117.72 1ibg s LEU 11 Ca 0.06 0.76 0.01 0.00 -0.22 0.00 0.00 54.13 54.75 1ibg s LEU 11 Cb 0.02 1.81 0.02 0.00 0.50 0.00 0.00 46.19 48.53 1ibg s LEU 11 CO -0.04 -0.32 -0.06 0.00 -1.32 0.00 0.00 176.35 174.61 1ibg s ALA 12 N -0.37 0.69 -0.09 5.97 0.00 -1.24 0.65 121.76 127.37 1ibg s ALA 12 Ca -0.05 -0.12 -0.08 0.00 0.00 0.00 0.00 51.96 51.71 1ibg s ALA 12 Cb -0.03 -0.37 0.03 0.00 0.00 0.00 0.00 23.12 22.75 1ibg s ALA 12 CO 0.03 0.04 0.24 0.14 0.00 0.00 0.00 175.76 176.21 1ibg s VAL 13 N 0.66 -0.01 0.69 0.00 -7.23 -0.93 -4.87 120.40 108.72 1ibg s VAL 13 Ca -0.09 0.03 -0.11 0.00 -1.81 0.00 0.00 61.98 60.00 1ibg s VAL 13 Cb -0.12 -0.35 0.00 0.00 0.56 0.00 0.00 36.38 36.47 1ibg s VAL 13 CO 0.00 0.01 1.06 -0.44 -0.31 0.00 0.00 175.10 175.43 1ibg s SER 14 N 0.38 5.50 0.66 4.85 0.01 -1.26 -2.08 113.70 121.76 1ibg s SER 14 Ca -0.02 1.40 -0.17 0.00 1.31 0.00 0.00 55.95 58.47 1ibg s SER 14 Cb -0.04 -2.29 -0.00 0.00 0.21 0.00 0.00 66.02 63.90 1ibg s SER 14 CO -0.02 -1.34 1.25 -0.76 0.41 0.00 0.00 173.24 172.79 1ibg s LEU 15 N -5.43 3.52 0.00 2.44 1.02 -1.26 -1.51 118.68 117.46 1ibg s LEU 15 Ca 0.58 2.49 0.00 0.00 0.02 0.00 0.00 54.13 57.22 1ibg s LEU 15 Cb -0.13 -4.61 0.00 0.00 0.02 0.00 0.00 46.19 41.48 1ibg s LEU 15 CO 0.54 -1.98 0.00 0.61 0.02 0.00 0.00 176.35 175.54 1ibg n GLY 16 N 0.66 2.94 3.53 -3.19 0.00 -0.58 -4.92 105.19 103.64 1ibg n GLY 16 Ca 0.15 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 1ibg n GLY 16 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1ibg n GLN 17 N -1.34 -2.53 -4.74 1.61 3.00 -0.57 -4.50 117.38 108.31 1ibg n GLN 17 Ca 0.00 -1.80 -0.30 0.00 -0.01 0.00 0.00 57.00 54.88 1ibg n GLN 17 Cb 0.00 -1.52 -0.13 0.00 0.00 0.00 0.00 30.24 28.59 1ibg n GLN 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 1ibg s ARG 18 N -5.56 1.95 0.06 -1.09 3.52 -1.26 -1.09 118.95 115.48 1ibg s ARG 18 Ca 0.71 -1.04 0.05 0.00 -0.13 0.00 0.00 55.73 55.32 1ibg s ARG 18 Cb -0.05 -2.10 -0.03 0.00 -1.56 0.00 0.00 34.95 31.21 1ibg s ARG 18 CO 0.53 0.53 -0.15 0.00 -0.81 0.00 0.00 175.30 175.39 1ibg s ALA 19 N -0.89 1.28 -0.25 6.12 0.00 0.16 -4.97 121.76 123.21 1ibg s ALA 19 Ca 0.14 -0.96 -0.04 0.00 0.00 0.00 0.00 51.96 51.10 1ibg s ALA 19 Cb -0.10 -0.16 0.09 0.00 0.00 0.00 0.00 23.12 22.94 1ibg s ALA 19 CO 0.04 0.22 0.11 0.99 0.00 0.00 0.00 175.76 177.12 1ibg s THR 20 N -1.06 0.08 0.04 0.00 2.01 -1.26 -1.81 115.64 113.65 1ibg s THR 20 Ca 0.01 -0.64 -0.20 0.00 0.31 0.00 0.00 61.69 61.17 1ibg s THR 20 Cb -0.09 -0.94 -0.06 0.00 0.01 0.00 0.00 72.50 71.42 1ibg s THR 20 CO 0.02 -0.55 0.57 -0.63 -0.69 0.00 0.00 174.62 173.34 1ibg s ILE 21 N 2.04 4.82 0.39 1.82 -1.09 -0.47 -4.61 121.20 124.10 1ibg s ILE 21 Ca 0.06 1.21 0.08 0.00 -2.23 0.00 0.00 60.65 59.77 1ibg s ILE 21 Cb -0.16 -3.90 -0.05 0.00 -1.58 0.00 0.00 42.46 36.77 1ibg s ILE 21 CO -0.25 0.50 0.16 -0.44 -1.23 0.00 0.00 174.94 173.68 1ibg s SER 22 N -0.73 4.49 -0.30 3.58 0.01 -0.18 -1.33 113.70 119.23 1ibg s SER 22 Ca 0.29 -0.98 -0.12 0.00 1.31 0.00 0.00 55.95 56.45 1ibg s SER 22 Cb -0.19 -0.55 0.16 0.00 0.21 0.00 0.00 66.02 65.66 1ibg s SER 22 CO 0.18 -0.46 0.87 0.00 0.41 0.00 0.00 173.24 174.24 1ibg s ARG 24 N 2.65 1.79 0.17 0.00 0.52 -0.06 -0.53 118.95 123.50 1ibg s ARG 24 Ca -0.01 -0.70 0.05 0.00 -0.52 0.00 0.00 55.73 54.55 1ibg s ARG 24 Cb -0.09 -1.63 -0.04 0.00 0.52 0.00 0.00 34.95 33.72 1ibg s ARG 24 CO -0.18 0.35 0.17 0.00 0.02 0.00 0.00 175.30 175.67 1ibg s ALA 25 N -0.24 3.65 0.52 2.13 0.00 0.59 -0.89 121.76 127.51 1ibg s ALA 25 Ca 0.02 -1.21 0.33 0.00 0.00 0.00 0.00 51.96 51.10 1ibg s ALA 25 Cb -0.10 -1.44 1.84 0.00 0.00 0.00 0.00 23.12 23.42 1ibg s ALA 25 CO 0.01 0.48 2.21 0.77 0.00 0.00 0.00 175.76 179.23 1ibg h SER 26 N 2.23 0.00 -5.22 0.00 0.02 -1.65 -3.45 113.55 105.48 1ibg h SER 26 Ca -0.48 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.37 1ibg h SER 26 Cb 1.20 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.61 1ibg h SER 26 CO 0.64 0.04 -0.37 -0.75 -1.14 0.00 0.00 176.83 175.25 1ibg s LYS 27 N -4.31 0.99 -0.60 3.45 2.20 -1.26 -5.01 119.74 115.19 1ibg s LYS 27 Ca -0.04 -1.09 -0.27 0.00 -0.36 0.00 0.00 55.97 54.22 1ibg s LYS 27 Cb 0.14 0.35 -0.02 0.00 -1.51 0.00 0.00 37.83 36.79 1ibg s LYS 27 CO 0.52 -0.34 1.81 0.45 -0.36 0.00 0.00 175.35 177.44 1ibg s SER 27 N -2.92 5.38 0.00 1.43 0.15 -1.26 -4.33 113.70 112.16 1ibg s SER 27 Ca 0.12 0.35 0.00 0.00 0.70 0.00 0.00 55.95 57.12 1ibg s SER 27 Cb 0.04 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 1ibg s SER 27 CO -0.05 -2.29 1.44 1.33 1.20 0.00 0.00 173.24 174.87 1ibg n VAL 27 N 7.17 1.44 -4.07 4.45 0.24 -0.73 -4.78 118.33 122.05 1ibg n VAL 27 Ca 0.19 -0.23 -0.33 0.00 -2.04 0.00 0.00 64.34 61.93 1ibg n VAL 27 Cb 0.51 -1.23 -0.15 0.00 -1.47 0.00 0.00 33.84 31.51 1ibg n VAL 27 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1ibg s SER 27 N 1.49 3.92 -0.23 -1.34 0.01 -1.26 -0.78 113.70 115.51 1ibg s SER 27 Ca 0.00 -1.02 -0.02 0.00 1.31 0.00 0.00 55.95 56.22 1ibg s SER 27 Cb 0.00 -1.54 0.01 0.00 0.21 0.00 0.00 66.02 64.70 1ibg s SER 27 CO 0.00 -0.11 -0.07 -0.89 0.41 0.00 0.00 173.24 172.59 1ibg s THR 27 N 1.21 3.03 0.00 1.44 2.01 -0.41 -4.89 115.64 118.03 1ibg s THR 27 Ca -0.02 -0.77 0.00 0.00 0.31 0.00 0.00 61.69 61.21 1ibg s THR 27 Cb -0.17 -2.44 0.00 0.00 0.01 0.00 0.00 72.50 69.91 1ibg s THR 27 CO -0.08 0.34 0.00 -1.20 -0.69 0.00 0.00 174.62 172.99 1ibg n SER 28 N 4.73 0.00 -2.11 3.53 7.64 -1.26 -2.35 113.62 123.80 1ibg n SER 28 Ca -0.18 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.45 1ibg n SER 28 Cb 0.49 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 63.77 1ibg n SER 28 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ibg n GLY 29 N 0.00 4.91 2.76 0.23 0.00 -1.26 -4.84 105.19 106.99 1ibg n GLY 29 Ca 0.00 -1.62 -0.25 0.00 0.00 0.00 0.00 46.02 44.16 1ibg n GLY 29 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ibg s TYR 30 N -2.91 0.81 -0.53 1.61 1.51 -0.99 -5.08 117.35 111.76 1ibg s TYR 30 Ca 0.50 -0.41 -0.25 0.00 -1.01 0.00 0.00 57.07 55.89 1ibg s TYR 30 Cb 0.39 -0.89 0.04 0.00 -0.11 0.00 0.00 41.96 41.39 1ibg s TYR 30 CO 0.01 -0.43 0.99 -1.12 -1.11 0.00 0.00 175.55 173.90 1ibg s SER 31 N 1.93 6.40 -1.42 2.29 0.01 -1.26 -1.29 113.70 120.36 1ibg s SER 31 Ca 0.03 -0.14 -0.15 0.00 1.31 0.00 0.00 55.95 57.01 1ibg s SER 31 Cb -0.14 -2.47 0.05 0.00 0.21 0.00 0.00 66.02 63.68 1ibg s SER 31 CO -0.06 -1.24 2.10 1.41 0.41 0.00 0.00 173.24 175.86 1ibg n HIS 32 N 7.60 3.78 -4.13 2.43 8.25 0.04 -2.97 115.22 130.22 1ibg n HIS 32 Ca 0.04 -2.95 -0.09 0.00 -0.26 0.00 0.00 57.72 54.46 1ibg n HIS 32 Cb 0.48 -2.55 -0.10 0.00 1.12 0.00 0.00 29.99 28.94 1ibg n HIS 32 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 1ibg s ILE 33 N 3.32 0.49 0.06 1.59 -5.25 -1.26 -1.25 121.20 118.90 1ibg s ILE 33 Ca 0.48 -1.83 -0.05 0.00 -0.99 0.00 0.00 60.65 58.26 1ibg s ILE 33 Cb 0.12 -1.55 -0.02 0.00 2.95 0.00 0.00 42.46 43.96 1ibg s ILE 33 CO -0.05 -0.89 0.08 -1.00 -1.79 0.00 0.00 174.94 171.29 1ibg s HIS 34 N -3.60 0.31 -0.03 1.37 3.76 -0.19 -0.85 115.29 116.06 1ibg s HIS 34 Ca 0.09 -0.75 0.01 0.00 -0.15 0.00 0.00 55.06 54.25 1ibg s HIS 34 Cb 0.05 -0.21 0.02 0.00 1.11 0.00 0.00 32.58 33.55 1ibg s HIS 34 CO -0.06 -0.43 -0.03 -1.58 -0.85 0.00 0.00 174.74 171.78 1ibg s TRP 35 N -3.56 0.55 0.04 1.40 0.52 -0.41 -1.63 118.94 115.85 1ibg s TRP 35 Ca 0.03 -0.11 0.05 0.00 0.02 0.00 0.00 56.10 56.09 1ibg s TRP 35 Cb 0.05 -0.50 -0.02 0.00 -1.15 0.00 0.00 33.47 31.84 1ibg s TRP 35 CO -0.09 -0.13 -0.14 0.71 0.02 0.00 0.00 176.95 177.32 1ibg s TYR 36 N 0.71 1.24 -0.22 -1.98 2.02 -0.02 -0.55 117.35 118.56 1ibg s TYR 36 Ca -0.08 -0.37 -0.05 0.00 -0.37 0.00 0.00 57.07 56.20 1ibg s TYR 36 Cb -0.12 -0.73 -0.02 0.00 -0.40 0.00 0.00 41.96 40.69 1ibg s TYR 36 CO -0.00 0.04 -0.01 -1.14 -1.57 0.00 0.00 175.55 172.87 1ibg s GLN 37 N -1.22 3.52 -0.33 -0.62 0.74 0.11 -1.23 119.66 120.62 1ibg s GLN 37 Ca 0.01 -0.56 -0.02 0.00 0.05 0.00 0.00 55.36 54.85 1ibg s GLN 37 Cb -0.08 -3.08 0.07 0.00 1.10 0.00 0.00 33.01 31.02 1ibg s GLN 37 CO 0.01 -0.10 0.06 -1.14 -0.55 0.00 0.00 175.29 173.57 1ibg s GLN 38 N 1.29 2.23 0.86 1.67 0.74 0.77 -1.01 119.66 126.20 1ibg s GLN 38 Ca 0.04 -1.47 -0.10 0.00 0.05 0.00 0.00 55.36 53.87 1ibg s GLN 38 Cb -0.15 -3.29 0.11 0.00 1.10 0.00 0.00 33.01 30.78 1ibg s GLN 38 CO 0.00 -0.77 1.12 0.15 -0.55 0.00 0.00 175.29 175.24 1ibg s LYS 39 N 1.19 1.52 0.00 1.67 -0.14 -1.26 -1.25 119.74 121.47 1ibg s LYS 39 Ca -0.00 1.33 0.00 0.00 -1.36 0.00 0.00 55.97 55.94 1ibg s LYS 39 Cb -0.21 -1.80 0.00 0.00 -1.68 0.00 0.00 37.83 34.14 1ibg s LYS 39 CO -0.03 -2.21 0.00 -2.30 -0.76 0.00 0.00 175.35 170.05 1ibg n PRO 40 N -3.93 0.00 -2.38 -1.68 -0.02 -1.26 -3.20 135.00 122.53 1ibg n PRO 40 Ca 0.10 0.00 -0.00 0.00 -2.02 0.00 0.00 63.50 61.58 1ibg n PRO 40 Cb 0.53 0.00 0.04 0.00 -0.02 0.00 0.00 33.50 34.05 1ibg n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ibg n GLY 41 N -0.88 1.93 3.74 -1.23 0.00 -1.26 -5.07 105.19 102.42 1ibg n GLY 41 Ca 0.00 -1.11 -0.23 0.00 0.00 0.00 0.00 46.02 44.68 1ibg n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ibg s GLN 42 N -2.77 2.33 0.90 1.61 1.11 -1.20 -5.14 119.66 116.50 1ibg s GLN 42 Ca 0.31 -1.65 -0.10 0.00 0.01 0.00 0.00 55.36 53.93 1ibg s GLN 42 Cb 0.35 -2.12 0.14 0.00 -1.01 0.00 0.00 33.01 30.36 1ibg s GLN 42 CO -0.07 0.01 1.13 -1.25 0.01 0.00 0.00 175.29 175.12 1ibg s PRO 43 N -3.88 1.14 0.43 2.91 0.04 -1.26 -4.66 135.00 129.72 1ibg s PRO 43 Ca 0.40 1.40 -0.25 0.00 0.04 0.00 0.00 61.00 62.58 1ibg s PRO 43 Cb -0.01 -1.75 -0.09 0.00 0.04 0.00 0.00 34.50 32.69 1ibg s PRO 43 CO 0.23 -2.50 1.30 -2.30 0.04 0.00 0.00 177.00 173.78 1ibg n PRO 44 N -4.13 1.98 -4.40 0.56 -0.02 -1.26 -4.61 135.00 123.12 1ibg n PRO 44 Ca 0.11 0.70 -0.34 0.00 -2.02 0.00 0.00 63.50 61.95 1ibg n PRO 44 Cb 0.52 -2.44 -0.14 0.00 -0.02 0.00 0.00 33.50 31.43 1ibg n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1ibg s LYS 45 N -2.28 3.41 0.25 -0.52 2.20 -0.18 -4.96 119.74 117.67 1ibg s LYS 45 Ca 0.61 -0.64 -0.30 0.00 -0.36 0.00 0.00 55.97 55.28 1ibg s LYS 45 Cb -0.49 -2.80 -0.10 0.00 -1.51 0.00 0.00 37.83 32.93 1ibg s LYS 45 CO 0.58 0.06 1.35 -1.17 -0.36 0.00 0.00 175.35 175.81 1ibg s LEU 46 N 0.77 4.41 -0.08 5.43 2.96 -1.26 -0.71 118.68 130.20 1ibg s LEU 46 Ca -0.04 2.57 -0.04 0.00 -0.22 0.00 0.00 54.13 56.40 1ibg s LEU 46 Cb -0.15 -3.63 -0.04 0.00 0.50 0.00 0.00 46.19 42.88 1ibg s LEU 46 CO 0.01 -0.58 -0.11 0.18 -1.32 0.00 0.00 176.35 174.54 1ibg n LEU 47 N 2.02 0.60 -3.78 -0.68 4.77 0.29 -4.83 117.00 115.38 1ibg n LEU 47 Ca 0.05 0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 56.00 1ibg n LEU 47 Cb 0.42 -0.25 -0.13 0.00 -2.33 0.00 0.00 43.42 41.13 1ibg n LEU 47 CO 0.59 0.16 -0.19 -0.63 -1.33 0.00 0.00 177.39 175.99 1ibg s ILE 48 N -2.15 -0.02 0.13 -0.08 1.01 -1.06 -2.37 121.20 116.66 1ibg s ILE 48 Ca -0.11 0.08 0.10 0.00 0.00 0.00 0.00 60.65 60.71 1ibg s ILE 48 Cb 0.04 -0.26 -0.04 0.00 0.01 0.00 0.00 42.46 42.22 1ibg s ILE 48 CO 0.14 0.03 -0.25 -0.72 0.00 0.00 0.00 174.94 174.15 1ibg s TYR 49 N 0.58 2.17 -1.26 3.97 -0.85 -0.23 -1.29 117.35 120.44 1ibg s TYR 49 Ca -0.04 -0.39 -0.04 0.00 -0.52 0.00 0.00 57.07 56.08 1ibg s TYR 49 Cb -0.06 -1.16 -0.01 0.00 0.38 0.00 0.00 41.96 41.11 1ibg s TYR 49 CO -0.03 0.32 0.71 -0.11 -1.52 0.00 0.00 175.55 174.92 1ibg n LEU 50 N 0.87 -3.21 0.00 -3.49 7.94 -0.03 -1.48 117.00 117.60 1ibg n LEU 50 Ca -0.18 -0.86 0.00 0.00 -1.11 0.00 0.00 56.01 53.86 1ibg n LEU 50 Cb 0.54 -2.63 0.00 0.00 0.53 0.00 0.00 43.42 41.86 1ibg n LEU 50 CO 0.24 0.39 0.00 0.00 -1.11 0.00 0.00 177.39 176.91 1ibg n ALA 51 N -4.18 0.00 0.00 1.96 0.00 -0.21 -3.68 120.51 114.41 1ibg n ALA 51 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1ibg n ALA 51 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.11 1ibg n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ibg n SER 52 N 0.00 1.88 -4.76 0.00 3.41 -1.20 -3.59 113.62 109.37 1ibg n SER 52 Ca 0.00 -0.03 -0.40 0.00 -0.26 0.00 0.00 58.87 58.18 1ibg n SER 52 Cb 0.00 0.44 -0.06 0.00 -0.26 0.00 0.00 64.21 64.33 1ibg n SER 52 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1ibg s ILE 53 N -0.82 4.25 0.06 -1.33 1.01 -0.55 -4.53 121.20 119.29 1ibg s ILE 53 Ca 0.00 1.91 -0.14 0.00 0.00 0.00 0.00 60.65 62.42 1ibg s ILE 53 Cb 0.00 -4.24 -0.06 0.00 0.01 0.00 0.00 42.46 38.17 1ibg s ILE 53 CO 0.00 0.49 0.45 -0.76 0.00 0.00 0.00 174.94 175.13 1ibg s LEU 54 N -1.04 4.43 0.11 2.97 1.43 -1.26 -1.07 118.68 124.25 1ibg s LEU 54 Ca 0.39 0.98 -0.30 0.00 -1.03 0.00 0.00 54.13 54.17 1ibg s LEU 54 Cb -0.24 -2.85 -0.06 0.00 0.03 0.00 0.00 46.19 43.07 1ibg s LEU 54 CO 0.29 0.24 0.98 -0.70 0.23 0.00 0.00 176.35 177.39 1ibg s GLU 55 N -1.45 4.67 0.11 1.70 2.56 -1.00 -4.92 118.70 120.37 1ibg s GLU 55 Ca 0.29 1.48 -0.31 0.00 0.00 0.00 0.00 54.97 56.43 1ibg s GLU 55 Cb -0.16 -3.37 -0.09 0.00 2.00 0.00 0.00 34.13 32.51 1ibg s GLU 55 CO 0.16 0.17 1.55 -1.12 -0.56 0.00 0.00 175.26 175.47 1ibg s SER 56 N 0.08 6.66 0.00 -1.70 0.01 -1.26 -1.37 113.70 116.11 1ibg s SER 56 Ca 0.48 2.47 0.00 0.00 1.31 0.00 0.00 55.95 60.21 1ibg s SER 56 Cb -0.24 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.41 1ibg s SER 56 CO 0.30 -0.81 0.00 0.61 0.41 0.00 0.00 173.24 173.76 1ibg n GLY 57 N 3.78 2.35 3.71 3.44 0.00 -1.26 -5.05 105.19 112.16 1ibg n GLY 57 Ca 0.14 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 45.09 1ibg n GLY 57 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ibg s VAL 58 N -0.82 4.28 0.74 1.61 -7.23 -0.47 -4.93 120.40 113.58 1ibg s VAL 58 Ca 0.00 1.63 -0.14 0.00 -1.81 0.00 0.00 61.98 61.67 1ibg s VAL 58 Cb 0.00 -4.05 0.05 0.00 0.56 0.00 0.00 36.38 32.94 1ibg s VAL 58 CO 0.00 0.11 1.16 -2.16 -0.31 0.00 0.00 175.10 173.90 1ibg s PRO 59 N 1.17 2.17 0.00 4.82 0.04 -1.26 -4.81 135.00 137.12 1ibg s PRO 59 Ca 0.57 1.57 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1ibg s PRO 59 Cb -0.27 -1.86 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1ibg s PRO 59 CO 0.28 -1.77 0.40 0.00 0.04 0.00 0.00 177.00 175.95 1ibg n ALA 60 N -2.93 1.90 1.35 8.56 0.00 -1.26 -2.80 120.51 125.32 1ibg n ALA 60 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.69 1ibg n ALA 60 Cb 0.51 -1.00 0.41 0.00 0.00 0.00 0.00 19.45 19.37 1ibg n ALA 60 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1ibg n ARG 61 N -0.30 1.85 -3.35 0.00 1.85 -1.26 -4.78 116.66 110.67 1ibg n ARG 61 Ca 0.00 -1.23 -0.38 0.00 -1.00 0.00 0.00 57.85 55.24 1ibg n ARG 61 Cb 0.03 -1.47 -0.06 0.00 -1.05 0.00 0.00 32.46 29.90 1ibg n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1ibg s PHE 62 N -1.99 3.49 -0.01 2.89 0.08 -1.12 -2.12 117.98 119.19 1ibg s PHE 62 Ca 0.35 0.82 0.02 0.00 0.12 0.00 0.00 56.93 58.24 1ibg s PHE 62 Cb 0.21 -2.52 -0.00 0.00 -0.57 0.00 0.00 43.02 40.13 1ibg s PHE 62 CO 0.32 0.15 -0.06 -1.12 -0.10 0.00 0.00 175.22 174.42 1ibg s SER 63 N 0.66 0.71 0.07 1.36 0.01 -0.42 -4.94 113.70 111.14 1ibg s SER 63 Ca 0.24 -0.11 0.07 0.00 1.31 0.00 0.00 55.95 57.46 1ibg s SER 63 Cb -0.15 -0.10 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 1ibg s SER 63 CO 0.09 0.06 -0.13 -0.83 0.41 0.00 0.00 173.24 172.84 1ibg s GLY 64 N -0.07 1.70 0.10 3.44 0.00 -1.26 -1.01 107.32 110.22 1ibg s GLY 64 Ca 0.01 -1.20 -0.05 0.00 0.00 0.00 0.00 44.72 43.48 1ibg s GLY 64 CO -0.00 -1.13 0.11 -0.56 0.00 0.00 0.00 173.10 171.52 1ibg s SER 65 N -1.81 0.25 0.00 1.64 0.01 -0.84 -4.49 113.70 108.47 1ibg s SER 65 Ca 0.18 -0.91 0.00 0.00 1.31 0.00 0.00 55.95 56.53 1ibg s SER 65 Cb -0.11 0.31 0.00 0.00 0.21 0.00 0.00 66.02 66.43 1ibg s SER 65 CO 0.09 -0.72 0.00 0.61 0.41 0.00 0.00 173.24 173.63 1ibg n GLY 66 N -0.05 2.93 3.39 3.44 0.00 -1.26 -2.45 105.19 111.19 1ibg n GLY 66 Ca -0.11 -1.98 -0.16 0.00 0.00 0.00 0.00 46.02 43.77 1ibg n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ibg s SER 67 N 0.00 -0.44 1.25 1.61 0.01 -1.01 -4.87 113.70 110.24 1ibg s SER 67 Ca 0.00 0.46 0.00 0.00 1.31 0.00 0.00 55.95 57.72 1ibg s SER 67 Cb 0.00 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.71 1ibg s SER 67 CO 0.00 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 173.75 1ibg n GLY 68 N 1.20 1.17 0.10 3.44 0.00 -1.26 -2.41 105.19 107.42 1ibg n GLY 68 Ca -0.20 0.29 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 1ibg n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ibg n THR 69 N 0.00 1.51 -3.93 2.61 -2.24 -1.26 -1.77 114.28 109.20 1ibg n THR 69 Ca 0.00 -0.78 -0.35 0.00 -2.27 0.00 0.00 64.05 60.65 1ibg n THR 69 Cb 0.00 -0.91 -0.09 0.00 -2.10 0.00 0.00 70.33 67.23 1ibg n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ibg s ASP 70 N -5.99 5.89 0.14 3.42 1.11 -1.01 -0.30 116.67 119.93 1ibg s ASP 70 Ca -0.14 0.19 -0.03 0.00 0.18 0.00 0.00 52.55 52.76 1ibg s ASP 70 Cb 0.07 -1.99 -0.03 0.00 1.07 0.00 0.00 42.92 42.04 1ibg s ASP 70 CO 0.79 0.22 0.10 -0.36 1.18 0.00 0.00 175.17 177.10 1ibg s PHE 71 N 0.09 0.77 -0.27 4.23 0.08 0.31 -2.39 117.98 120.79 1ibg s PHE 71 Ca 0.07 -1.14 -0.24 0.00 0.12 0.00 0.00 56.93 55.74 1ibg s PHE 71 Cb -0.12 -0.40 0.08 0.00 -0.57 0.00 0.00 43.02 42.01 1ibg s PHE 71 CO 0.00 -0.56 0.76 0.99 -0.10 0.00 0.00 175.22 176.31 1ibg s THR 72 N -4.03 0.00 -0.10 0.64 2.01 -1.03 -2.45 115.64 110.68 1ibg s THR 72 Ca 0.23 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.26 1ibg s THR 72 Cb 0.07 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.57 1ibg s THR 72 CO 0.02 0.00 -0.19 -0.22 -0.69 0.00 0.00 174.62 173.53 1ibg s LEU 73 N 0.51 2.38 -0.05 4.42 2.96 -0.45 -1.98 118.68 126.48 1ibg s LEU 73 Ca -0.01 -0.43 0.05 0.00 -0.22 0.00 0.00 54.13 53.52 1ibg s LEU 73 Cb -0.05 -1.49 -0.02 0.00 0.50 0.00 0.00 46.19 45.12 1ibg s LEU 73 CO -0.02 0.19 -0.18 0.20 -1.32 0.00 0.00 176.35 175.22 1ibg s ASN 74 N 0.17 3.73 -0.14 3.68 0.01 -0.18 -1.36 114.94 120.85 1ibg s ASN 74 Ca -0.11 -0.29 -0.01 0.00 -0.71 0.00 0.00 52.86 51.74 1ibg s ASN 74 Cb -0.16 -0.76 0.04 0.00 0.41 0.00 0.00 41.25 40.78 1ibg s ASN 74 CO 0.06 0.32 -0.03 -0.63 -1.51 0.00 0.00 177.10 175.32 1ibg s ILE 75 N -0.61 0.83 -0.28 0.60 1.01 -0.75 -1.31 121.20 120.70 1ibg s ILE 75 Ca 0.09 -0.38 -0.15 0.00 0.00 0.00 0.00 60.65 60.21 1ibg s ILE 75 Cb -0.11 -1.03 0.09 0.00 0.01 0.00 0.00 42.46 41.42 1ibg s ILE 75 CO 0.01 0.15 0.66 -2.28 0.00 0.00 0.00 174.94 173.48 1ibg s HIS 76 N 1.76 -1.08 0.01 3.97 2.46 -0.90 -0.66 115.29 120.85 1ibg s HIS 76 Ca 0.02 2.11 -0.26 0.00 0.47 0.00 0.00 55.06 57.40 1ibg s HIS 76 Cb -0.14 0.64 -0.04 0.00 -0.13 0.00 0.00 32.58 32.90 1ibg s HIS 76 CO -0.07 -0.54 0.81 -1.25 -2.47 0.00 0.00 174.74 171.22 1ibg s PRO 77 N 1.81 4.51 -0.06 2.88 0.04 -1.26 -4.64 135.00 138.28 1ibg s PRO 77 Ca -0.09 1.12 -0.30 0.00 0.04 0.00 0.00 61.00 61.77 1ibg s PRO 77 Cb -0.06 -3.41 -0.05 0.00 0.04 0.00 0.00 34.50 31.02 1ibg s PRO 77 CO -0.19 0.14 1.54 0.08 0.04 0.00 0.00 177.00 178.60 1ibg s VAL 78 N 0.44 3.70 0.25 -0.36 1.01 -0.25 -4.78 120.40 120.40 1ibg s VAL 78 Ca 0.42 0.91 0.07 0.00 0.00 0.00 0.00 61.98 63.38 1ibg s VAL 78 Cb -0.20 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1ibg s VAL 78 CO 0.23 -0.06 0.16 -1.61 0.00 0.00 0.00 175.10 173.82 1ibg s GLU 79 N 3.58 2.82 0.45 2.72 2.02 -1.26 -1.52 118.70 127.51 1ibg s GLU 79 Ca 0.68 -1.09 0.21 0.00 0.02 0.00 0.00 54.97 54.79 1ibg s GLU 79 Cb -0.31 -2.51 1.18 0.00 0.10 0.00 0.00 34.13 32.59 1ibg s GLU 79 CO 0.26 0.40 1.88 1.05 0.02 0.00 0.00 175.26 178.87 1ibg h GLU 80 N 1.64 0.29 0.00 1.61 9.09 -1.91 0.43 114.58 125.73 1ibg h GLU 80 Ca -0.48 -0.02 0.00 0.00 0.05 0.00 0.00 59.36 58.91 1ibg h GLU 80 Cb 1.24 -0.06 0.00 0.00 -1.65 0.00 0.00 28.75 28.27 1ibg h GLU 80 CO 0.61 0.19 0.01 -0.85 0.05 0.00 0.00 179.01 179.02 1ibg n GLU 81 N -4.45 0.04 -0.53 1.06 0.00 -1.14 -3.06 120.64 112.55 1ibg n GLU 81 Ca 0.18 0.54 0.08 0.00 0.00 0.00 0.00 57.16 57.96 1ibg n GLU 81 Cb 0.73 -1.66 0.30 0.00 0.00 0.00 0.00 31.44 30.82 1ibg n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1ibg n ASP 82 N -1.73 4.35 -4.56 -1.84 8.00 0.14 -4.81 116.55 116.10 1ibg n ASP 82 Ca -0.00 -2.59 -0.23 0.00 0.71 0.00 0.00 54.79 52.67 1ibg n ASP 82 Cb 0.02 -0.52 -0.06 0.00 -0.02 0.00 0.00 41.12 40.54 1ibg n ASP 82 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ibg s ALA 83 N -2.09 1.41 0.06 2.24 0.00 -1.17 -4.78 121.76 117.44 1ibg s ALA 83 Ca 0.44 -1.38 -0.01 0.00 0.00 0.00 0.00 51.96 51.01 1ibg s ALA 83 Cb 0.31 -4.57 0.00 0.00 0.00 0.00 0.00 23.12 18.86 1ibg s ALA 83 CO 0.18 -5.17 0.10 0.00 0.00 0.00 0.00 175.76 170.87 1ibg n ALA 84 N 15.28 -0.11 -2.53 0.00 0.00 -1.25 -4.55 120.51 127.35 1ibg n ALA 84 Ca 0.42 -0.28 -0.33 0.00 0.00 0.00 0.00 53.44 53.26 1ibg n ALA 84 Cb 0.46 0.22 -0.12 0.00 0.00 0.00 0.00 19.45 20.01 1ibg n ALA 84 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ibg s THR 85 N -2.57 3.36 -0.14 0.00 2.01 -0.38 -1.44 115.64 116.47 1ibg s THR 85 Ca 0.05 -0.68 0.01 0.00 0.31 0.00 0.00 61.69 61.38 1ibg s THR 85 Cb -0.00 -2.36 -0.00 0.00 0.01 0.00 0.00 72.50 70.14 1ibg s THR 85 CO 0.03 0.55 -0.16 -0.31 -0.69 0.00 0.00 174.62 174.04 1ibg s TYR 86 N -0.81 2.75 0.09 4.92 2.02 -0.57 -0.16 117.35 125.59 1ibg s TYR 86 Ca 0.13 -1.00 0.09 0.00 -0.37 0.00 0.00 57.07 55.92 1ibg s TYR 86 Cb -0.11 -1.86 -0.04 0.00 -0.40 0.00 0.00 41.96 39.56 1ibg s TYR 86 CO 0.02 -0.44 -0.22 0.71 -1.57 0.00 0.00 175.55 174.05 1ibg s TYR 87 N 0.69 2.43 0.08 2.71 2.02 -0.37 -1.63 117.35 123.29 1ibg s TYR 87 Ca -0.08 -0.33 0.10 0.00 -0.37 0.00 0.00 57.07 56.39 1ibg s TYR 87 Cb -0.16 -1.34 -0.03 0.00 -0.40 0.00 0.00 41.96 40.03 1ibg s TYR 87 CO 0.02 0.30 -0.25 0.00 -1.57 0.00 0.00 175.55 174.05 1ibg s GLN 89 N -1.58 0.19 0.44 0.00 0.74 -0.64 -0.09 119.66 118.72 1ibg s GLN 89 Ca 0.11 0.06 0.03 0.00 0.05 0.00 0.00 55.36 55.61 1ibg s GLN 89 Cb -0.10 -0.33 0.00 0.00 1.10 0.00 0.00 33.01 33.68 1ibg s GLN 89 CO 0.04 -0.09 0.64 -3.38 -0.55 0.00 0.00 175.29 171.94 1ibg s HIS 90 N 0.72 3.08 -0.12 1.67 -3.43 -0.68 -1.02 115.29 115.51 1ibg s HIS 90 Ca -0.07 0.01 0.21 0.00 -0.80 0.00 0.00 55.06 54.41 1ibg s HIS 90 Cb -0.10 -2.34 0.40 0.00 -1.43 0.00 0.00 32.58 29.11 1ibg s HIS 90 CO -0.02 -0.40 1.16 -1.13 -2.00 0.00 0.00 174.74 172.36 1ibg n SER 91 N -2.01 0.73 0.13 7.38 3.41 -0.38 -4.20 113.62 118.68 1ibg n SER 91 Ca 0.03 -2.03 0.02 0.00 -0.26 0.00 0.00 58.87 56.63 1ibg n SER 91 Cb 0.58 -0.20 0.36 0.00 -0.26 0.00 0.00 64.21 64.69 1ibg n SER 91 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1ibg h ARG 92 N 1.44 0.18 -3.13 4.33 9.65 -1.87 -3.46 114.38 121.51 1ibg h ARG 92 Ca -0.26 -0.05 -0.00 0.00 -1.10 0.00 0.00 59.98 58.57 1ibg h ARG 92 Cb 1.57 -0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 30.10 1ibg h ARG 92 CO 0.05 0.41 0.19 -1.21 2.80 0.00 0.00 179.97 182.22 1ibg s GLU 93 N -4.51 1.98 -0.10 0.20 2.02 -1.26 -5.09 118.70 111.94 1ibg s GLU 93 Ca -0.05 -1.26 -0.14 0.00 0.02 0.00 0.00 54.97 53.54 1ibg s GLU 93 Cb 0.15 0.60 -0.05 0.00 0.10 0.00 0.00 34.13 34.93 1ibg s GLU 93 CO 0.74 -0.91 0.35 0.71 0.02 0.00 0.00 175.26 176.17 1ibg s TYR 94 N -3.15 3.57 0.48 1.61 2.02 -1.26 -3.74 117.35 116.88 1ibg s TYR 94 Ca 0.15 0.76 -0.05 0.00 -0.37 0.00 0.00 57.07 57.56 1ibg s TYR 94 Cb -0.05 -2.33 -0.04 0.00 -0.40 0.00 0.00 41.96 39.15 1ibg s TYR 94 CO 0.10 0.40 0.79 -1.25 -1.57 0.00 0.00 175.55 174.01 1ibg s PRO 95 N -0.12 3.54 -0.87 -1.71 0.04 -1.26 -4.88 135.00 129.75 1ibg s PRO 95 Ca 0.20 0.20 -0.24 0.00 0.04 0.00 0.00 61.00 61.21 1ibg s PRO 95 Cb -0.14 -2.37 0.05 0.00 0.04 0.00 0.00 34.50 32.08 1ibg s PRO 95 CO 0.08 -0.21 1.30 -0.51 0.04 0.00 0.00 177.00 177.71 1ibg s LEU 96 N -4.74 3.64 -0.05 -3.56 1.43 -1.25 -4.38 118.68 109.79 1ibg s LEU 96 Ca 0.47 -1.11 -0.04 0.00 -1.03 0.00 0.00 54.13 52.43 1ibg s LEU 96 Cb -0.10 -2.53 -0.04 0.00 0.03 0.00 0.00 46.19 43.55 1ibg s LEU 96 CO 0.45 -1.57 0.16 0.42 0.23 0.00 0.00 176.35 176.03 1ibg s THR 97 N 4.91 5.37 0.28 5.49 -4.23 -1.26 -4.98 115.64 121.21 1ibg s THR 97 Ca 0.38 -0.07 -0.01 0.00 -1.18 0.00 0.00 61.69 60.82 1ibg s THR 97 Cb -0.05 -3.45 -0.04 0.00 1.34 0.00 0.00 72.50 70.30 1ibg s THR 97 CO 0.01 0.43 0.48 -0.36 -0.54 0.00 0.00 174.62 174.64 1ibg s PHE 98 N -1.21 3.49 0.40 3.99 0.40 -1.26 -1.68 117.98 122.11 1ibg s PHE 98 Ca 0.23 0.38 0.05 0.00 -0.60 0.00 0.00 56.93 56.98 1ibg s PHE 98 Cb -0.12 -1.90 0.00 0.00 0.51 0.00 0.00 43.02 41.51 1ibg s PHE 98 CO 0.13 0.25 0.57 0.20 0.70 0.00 0.00 175.22 177.07 1ibg s GLY 99 N -3.55 1.69 0.26 4.36 0.00 0.88 -4.38 107.32 106.58 1ibg s GLY 99 Ca 0.40 -1.40 0.21 0.00 0.00 0.00 0.00 44.72 43.93 1ibg s GLY 99 CO 0.32 -1.26 1.65 0.00 0.00 0.00 0.00 173.10 173.81 1ibg n ALA 100 N -1.86 1.39 0.00 3.20 0.00 -1.26 -4.56 120.51 117.41 1ibg n ALA 100 Ca 0.03 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1ibg n ALA 100 Cb 0.58 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1ibg n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ibg n GLY 101 N -0.58 2.15 2.98 0.00 0.00 -1.25 -5.04 105.19 103.44 1ibg n GLY 101 Ca 0.01 -1.50 -0.30 0.00 0.00 0.00 0.00 46.02 44.22 1ibg n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ibg s THR 102 N -0.65 1.59 0.24 2.61 2.01 -0.64 -4.68 115.64 116.11 1ibg s THR 102 Ca 0.00 -1.01 -0.27 0.00 0.31 0.00 0.00 61.69 60.72 1ibg s THR 102 Cb 0.00 -1.70 -0.09 0.00 0.01 0.00 0.00 72.50 70.72 1ibg s THR 102 CO 0.00 0.13 0.88 -1.61 -0.69 0.00 0.00 174.62 173.32 1ibg s GLU 103 N 1.41 4.66 -0.05 4.92 2.02 0.01 -1.52 118.70 130.16 1ibg s GLU 103 Ca -0.02 1.30 0.01 0.00 0.02 0.00 0.00 54.97 56.29 1ibg s GLU 103 Cb -0.17 -3.12 -0.03 0.00 0.10 0.00 0.00 34.13 30.91 1ibg s GLU 103 CO -0.08 0.46 -0.05 -1.17 0.02 0.00 0.00 175.26 174.45 1ibg s LEU 104 N -1.46 3.28 -0.08 1.80 0.20 -0.52 0.08 118.68 121.98 1ibg s LEU 104 Ca 0.42 -0.02 0.01 0.00 0.69 0.00 0.00 54.13 55.23 1ibg s LEU 104 Cb -0.23 -1.78 0.02 0.00 -0.43 0.00 0.00 46.19 43.77 1ibg s LEU 104 CO 0.27 0.34 -0.09 -0.70 -0.29 0.00 0.00 176.35 175.89 1ibg s GLU 105 N -1.04 1.41 -0.20 1.98 -6.30 0.21 -3.86 118.70 110.90 1ibg s GLU 105 Ca 0.14 -0.28 -0.23 0.00 -2.50 0.00 0.00 54.97 52.11 1ibg s GLU 105 Cb -0.11 -1.32 -0.02 0.00 0.00 0.00 0.00 34.13 32.68 1ibg s GLU 105 CO 0.04 -0.10 0.75 -0.51 0.02 0.00 0.00 175.26 175.46 1ibg s LEU 106 N 1.10 4.13 0.54 2.70 1.02 -1.26 -2.18 118.68 124.73 1ibg s LEU 106 Ca -0.07 0.99 -0.19 0.00 0.02 0.00 0.00 54.13 54.89 1ibg s LEU 106 Cb -0.14 -3.08 -0.06 0.00 0.02 0.00 0.00 46.19 42.92 1ibg s LEU 106 CO -0.01 -0.39 1.08 -0.54 0.02 0.00 0.00 176.35 176.51 1ibg s LYS 107 N 2.30 3.47 0.34 1.70 1.02 -0.88 -4.89 119.74 122.80 1ibg s LYS 107 Ca 0.33 1.41 -0.16 0.00 0.02 0.00 0.00 55.97 57.57 1ibg s LYS 107 Cb -0.16 -2.04 0.03 0.00 -0.52 0.00 0.00 37.83 35.14 1ibg s LYS 107 CO 0.10 -0.71 0.71 0.50 -0.92 0.00 0.00 175.35 175.03 1ibg s ARG 108 N -3.50 2.01 0.58 1.68 3.00 -1.26 -4.34 118.95 117.11 1ibg s ARG 108 Ca 0.68 -1.32 -0.16 0.00 -1.00 0.00 0.00 55.73 53.94 1ibg s ARG 108 Cb -0.19 0.59 -0.04 0.00 0.00 0.00 0.00 34.95 35.31 1ibg s ARG 108 CO 0.28 -0.92 1.04 0.00 0.00 0.00 0.00 175.30 175.70 1ibg s ALA 109 N -3.04 2.81 0.34 6.12 0.00 -1.26 -4.98 121.76 121.75 1ibg s ALA 109 Ca 0.16 0.34 -0.29 0.00 0.00 0.00 0.00 51.96 52.17 1ibg s ALA 109 Cb -0.05 -3.21 -0.11 0.00 0.00 0.00 0.00 23.12 19.76 1ibg s ALA 109 CO 0.11 -0.70 1.38 -0.51 0.00 0.00 0.00 175.76 176.03 1ibg s ASP 110 N -2.88 6.62 -0.01 0.00 1.01 -1.26 -4.76 116.67 115.39 1ibg s ASP 110 Ca 0.62 2.81 0.01 0.00 0.71 0.00 0.00 52.55 56.70 1ibg s ASP 110 Cb -0.15 -2.65 0.01 0.00 1.01 0.00 0.00 42.92 41.14 1ibg s ASP 110 CO 0.36 -0.66 -0.03 0.00 0.21 0.00 0.00 175.17 175.06 1ibg s ALA 111 N -1.03 0.33 0.17 5.23 0.00 0.57 -4.92 121.76 122.12 1ibg s ALA 111 Ca 0.51 -0.06 -0.03 0.00 0.00 0.00 0.00 51.96 52.39 1ibg s ALA 111 Cb -0.42 -0.17 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 1ibg s ALA 111 CO 0.55 0.03 0.38 0.00 0.00 0.00 0.00 175.76 176.72 1ibg s ALA 112 N 0.29 3.81 0.44 0.00 0.00 -1.26 -0.98 121.76 124.06 1ibg s ALA 112 Ca -0.03 -0.69 -0.22 0.00 0.00 0.00 0.00 51.96 51.03 1ibg s ALA 112 Cb -0.06 -2.06 -0.10 0.00 0.00 0.00 0.00 23.12 20.90 1ibg s ALA 112 CO -0.01 0.56 1.00 -1.25 0.00 0.00 0.00 175.76 176.06 1ibg s PRO 113 N -2.98 4.09 -0.54 0.00 0.04 -1.26 -4.55 135.00 129.80 1ibg s PRO 113 Ca 0.40 1.29 -0.14 0.00 0.04 0.00 0.00 61.00 62.58 1ibg s PRO 113 Cb -0.12 -2.25 0.13 0.00 0.04 0.00 0.00 34.50 32.30 1ibg s PRO 113 CO 0.27 -0.17 0.47 0.99 0.04 0.00 0.00 177.00 178.60 1ibg s THR 114 N -1.98 4.98 0.34 1.26 2.01 0.27 -4.87 115.64 117.64 1ibg s THR 114 Ca 0.62 -1.62 -0.26 0.00 0.31 0.00 0.00 61.69 60.74 1ibg s THR 114 Cb -0.15 -4.20 -0.09 0.00 0.01 0.00 0.00 72.50 68.07 1ibg s THR 114 CO 0.19 -0.85 1.03 0.68 -0.69 0.00 0.00 174.62 174.97 1ibg s VAL 115 N 1.47 3.79 -0.02 3.82 -7.23 -1.26 -0.79 120.40 120.19 1ibg s VAL 115 Ca 0.04 1.55 0.03 0.00 -1.81 0.00 0.00 61.98 61.80 1ibg s VAL 115 Cb -0.28 -3.89 -0.01 0.00 0.56 0.00 0.00 36.38 32.77 1ibg s VAL 115 CO 0.02 0.18 -0.12 -0.44 -0.31 0.00 0.00 175.10 174.43 1ibg s SER 116 N -1.35 1.40 -0.03 4.85 0.01 0.35 -4.93 113.70 114.00 1ibg s SER 116 Ca 0.51 -0.22 0.05 0.00 1.31 0.00 0.00 55.95 57.60 1ibg s SER 116 Cb -0.24 -0.23 -0.01 0.00 0.21 0.00 0.00 66.02 65.75 1ibg s SER 116 CO 0.31 0.13 -0.19 -0.51 0.41 0.00 0.00 173.24 173.38 1ibg s ILE 117 N -0.14 1.55 -0.09 1.44 2.07 -1.26 -1.34 121.20 123.43 1ibg s ILE 117 Ca 0.02 -0.81 0.03 0.00 -1.41 0.00 0.00 60.65 58.48 1ibg s ILE 117 Cb -0.06 -1.31 0.01 0.00 0.13 0.00 0.00 42.46 41.23 1ibg s ILE 117 CO -0.00 0.44 -0.18 -0.36 -1.91 0.00 0.00 174.94 172.93 1ibg s PHE 118 N -0.23 2.04 1.18 3.50 0.08 0.18 -5.00 117.98 119.73 1ibg s PHE 118 Ca 0.02 -0.82 -0.15 0.00 0.12 0.00 0.00 56.93 56.09 1ibg s PHE 118 Cb -0.10 -1.41 0.24 0.00 -0.57 0.00 0.00 43.02 41.18 1ibg s PHE 118 CO 0.01 -0.37 0.65 -2.30 -0.10 0.00 0.00 175.22 173.11 1ibg n PRO 119 N 3.71 -2.36 -1.88 0.24 -0.02 -1.26 -1.71 135.00 131.71 1ibg n PRO 119 Ca -0.21 -0.67 -0.31 0.00 -2.02 0.00 0.00 63.50 60.30 1ibg n PRO 119 Cb 0.52 -1.99 0.02 0.00 -0.02 0.00 0.00 33.50 32.03 1ibg n PRO 119 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1ibg s PRO 120 N -4.05 3.42 0.45 0.52 0.04 -0.99 -4.61 135.00 129.78 1ibg s PRO 120 Ca 0.64 0.68 -0.09 0.00 0.04 0.00 0.00 61.00 62.27 1ibg s PRO 120 Cb -0.21 -2.07 -0.05 0.00 0.04 0.00 0.00 34.50 32.21 1ibg s PRO 120 CO 0.66 -0.68 0.80 -1.54 0.04 0.00 0.00 177.00 176.28 1ibg s SER 121 N -4.22 6.42 0.14 6.66 1.04 -1.26 -4.96 113.70 117.52 1ibg s SER 121 Ca 0.56 1.09 -0.17 0.00 0.48 0.00 0.00 55.95 57.91 1ibg s SER 121 Cb -0.11 -2.31 0.03 0.00 0.10 0.00 0.00 66.02 63.72 1ibg s SER 121 CO 0.53 -0.49 1.74 0.77 0.98 0.00 0.00 173.24 176.78 1ibg h SER 122 N 0.81 0.08 -0.82 7.02 4.64 -1.99 0.14 113.55 123.44 1ibg h SER 122 Ca -0.47 0.04 0.17 0.00 -0.47 0.00 0.00 61.79 61.05 1ibg h SER 122 Cb 1.19 0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 63.26 1ibg h SER 122 CO 0.63 0.08 0.54 -0.33 -0.87 0.00 0.00 176.83 176.88 1ibg h GLU 123 N 0.22 0.43 -0.17 4.77 5.08 -2.00 -1.83 114.58 121.08 1ibg h GLU 123 Ca 0.14 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.34 1ibg h GLU 123 Cb 0.12 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1ibg h GLU 123 CO -0.15 0.29 -0.40 0.37 -1.00 0.00 0.00 179.01 178.11 1ibg h GLN 124 N 0.45 0.57 -0.75 2.33 4.15 -1.04 -3.06 115.11 117.76 1ibg h GLN 124 Ca 0.41 -0.39 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 1ibg h GLN 124 Cb 0.93 0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.64 1ibg h GLN 124 CO -0.15 1.00 0.46 -0.07 -1.93 0.00 0.00 178.83 178.14 1ibg h LEU 125 N 0.22 0.89 -1.27 -2.39 3.38 -1.06 0.15 115.31 115.23 1ibg h LEU 125 Ca -0.00 -0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.01 1ibg h LEU 125 Cb 1.01 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.48 1ibg h LEU 125 CO 0.09 0.67 0.54 0.74 0.09 0.00 0.00 178.44 180.58 1ibg h THR 126 N 1.03 0.98 0.00 0.22 2.02 -1.25 0.27 112.91 116.17 1ibg h THR 126 Ca 0.27 -0.29 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1ibg h THR 126 Cb -0.05 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.43 1ibg h THR 126 CO -0.05 0.15 0.00 -1.20 0.37 0.00 0.00 175.52 174.79 1ibg n SER 127 N -4.51 0.08 -0.08 4.18 7.64 0.52 -4.84 113.62 116.62 1ibg n SER 127 Ca 0.14 -1.66 -0.01 0.00 1.01 0.00 0.00 58.87 58.34 1ibg n SER 127 Cb 0.29 -0.04 -0.00 0.00 -1.01 0.00 0.00 64.21 63.44 1ibg n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ibg n GLY 128 N 0.31 0.47 3.54 0.23 0.00 0.93 -5.05 105.19 105.61 1ibg n GLY 128 Ca 0.00 -0.20 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 1ibg n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ibg s GLY 129 N -2.22 2.21 -0.04 -0.02 0.00 -1.16 -1.12 107.32 104.97 1ibg s GLY 129 Ca 0.00 -2.12 -0.01 0.00 0.00 0.00 0.00 44.72 42.59 1ibg s GLY 129 CO 0.00 -2.00 0.04 0.00 0.00 0.00 0.00 173.10 171.14 1ibg s ALA 130 N -2.77 0.27 -0.07 3.20 0.00 -0.12 -2.98 121.76 119.28 1ibg s ALA 130 Ca 0.33 0.18 0.05 0.00 0.00 0.00 0.00 51.96 52.52 1ibg s ALA 130 Cb 0.05 -0.50 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 1ibg s ALA 130 CO 0.16 -0.33 -0.24 -1.12 0.00 0.00 0.00 175.76 174.24 1ibg s SER 131 N 1.69 3.16 -0.12 0.00 0.01 -1.26 -0.39 113.70 116.79 1ibg s SER 131 Ca -0.01 -0.50 0.00 0.00 1.31 0.00 0.00 55.95 56.76 1ibg s SER 131 Cb -0.13 -0.99 -0.02 0.00 0.21 0.00 0.00 66.02 65.10 1ibg s SER 131 CO -0.03 0.23 -0.13 -0.69 0.41 0.00 0.00 173.24 173.03 1ibg s VAL 132 N -0.07 3.06 0.00 3.43 1.01 -0.01 -2.34 120.40 125.48 1ibg s VAL 132 Ca -0.06 -0.66 0.07 0.00 0.00 0.00 0.00 61.98 61.32 1ibg s VAL 132 Cb -0.15 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 1ibg s VAL 132 CO 0.05 0.53 -0.21 -0.69 0.00 0.00 0.00 175.10 174.77 1ibg s VAL 133 N 0.22 1.70 -0.06 2.92 1.01 -0.70 -0.65 120.40 124.84 1ibg s VAL 133 Ca -0.08 -1.01 0.01 0.00 0.00 0.00 0.00 61.98 60.90 1ibg s VAL 133 Cb -0.15 -1.43 0.02 0.00 0.00 0.00 0.00 36.38 34.82 1ibg s VAL 133 CO 0.05 0.39 -0.07 0.00 0.00 0.00 0.00 175.10 175.48 1ibg s PHE 135 N 0.98 3.16 -0.69 0.00 0.08 -0.45 -1.25 117.98 119.81 1ibg s PHE 135 Ca -0.10 -0.77 -0.20 0.00 0.12 0.00 0.00 56.93 55.99 1ibg s PHE 135 Cb -0.14 -2.31 0.10 0.00 -0.57 0.00 0.00 43.02 40.10 1ibg s PHE 135 CO 0.00 -0.51 0.87 -0.51 -0.10 0.00 0.00 175.22 174.97 1ibg s LEU 136 N 1.56 5.07 -0.08 -0.37 1.43 0.43 -0.50 118.68 126.22 1ibg s LEU 136 Ca 0.04 -1.47 -0.00 0.00 -1.03 0.00 0.00 54.13 51.66 1ibg s LEU 136 Cb -0.17 -2.35 -0.03 0.00 0.03 0.00 0.00 46.19 43.66 1ibg s LEU 136 CO 0.04 -1.19 -0.05 0.20 0.23 0.00 0.00 176.35 175.58 1ibg s ASN 137 N 3.57 4.78 -0.60 2.29 0.01 0.03 -0.65 114.94 124.37 1ibg s ASN 137 Ca 0.19 0.01 -0.03 0.00 -0.71 0.00 0.00 52.86 52.32 1ibg s ASN 137 Cb -0.17 -1.27 -0.04 0.00 0.41 0.00 0.00 41.25 40.18 1ibg s ASN 137 CO 0.04 0.35 0.53 0.59 -1.51 0.00 0.00 177.10 177.10 1ibg n ASN 138 N 2.29 -4.91 -4.48 -1.22 3.02 -0.83 -0.57 115.26 108.56 1ibg n ASN 138 Ca -0.18 -0.36 -0.24 0.00 -0.03 0.00 0.00 54.58 53.76 1ibg n ASN 138 Cb 0.53 -3.38 -0.10 0.00 -0.61 0.00 0.00 39.78 36.22 1ibg n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 1ibg s PHE 139 N -3.20 2.30 -0.10 3.10 -0.71 0.24 -4.63 117.98 114.98 1ibg s PHE 139 Ca 0.23 -0.36 -0.09 0.00 -1.04 0.00 0.00 56.93 55.67 1ibg s PHE 139 Cb -0.03 -1.05 0.03 0.00 -1.21 0.00 0.00 43.02 40.76 1ibg s PHE 139 CO 0.45 0.69 0.27 -0.47 -1.34 0.00 0.00 175.22 174.82 1ibg s TYR 140 N -2.53 -0.31 0.19 3.49 5.04 -0.15 -0.89 117.35 122.19 1ibg s TYR 140 Ca 0.30 0.74 -0.03 0.00 -2.44 0.00 0.00 57.07 55.64 1ibg s TYR 140 Cb -0.04 0.10 0.05 0.00 0.35 0.00 0.00 41.96 42.42 1ibg s TYR 140 CO 0.15 -0.15 0.16 -2.30 -1.34 0.00 0.00 175.55 172.07 1ibg n PRO 141 N 3.00 -1.41 -0.02 4.97 -0.02 -1.26 -0.32 135.00 139.94 1ibg n PRO 141 Ca -0.13 -0.26 -0.11 0.00 -2.02 0.00 0.00 63.50 60.97 1ibg n PRO 141 Cb 0.58 -0.25 0.02 0.00 -0.02 0.00 0.00 33.50 33.83 1ibg n PRO 141 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1ibg h LYS 142 N 0.00 0.64 -6.30 -0.52 3.64 -1.97 -3.45 116.57 108.61 1ibg h LYS 142 Ca -0.06 -0.42 -0.54 0.00 -1.27 0.00 0.00 60.65 58.36 1ibg h LYS 142 Cb 0.19 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1ibg h LYS 142 CO 0.04 1.03 1.11 -0.51 -2.27 0.00 0.00 179.45 178.85 1ibg s ASP 143 N -6.94 6.62 0.02 4.20 1.11 -1.26 -4.95 116.67 115.47 1ibg s ASP 143 Ca -0.08 2.35 -0.19 0.00 0.18 0.00 0.00 52.55 54.81 1ibg s ASP 143 Cb 0.11 -2.54 0.04 0.00 1.07 0.00 0.00 42.92 41.60 1ibg s ASP 143 CO 0.86 -0.95 0.42 -0.51 1.18 0.00 0.00 175.17 176.17 1ibg s ILE 144 N 4.00 0.05 -0.10 0.77 2.07 -1.26 -4.67 121.20 122.05 1ibg s ILE 144 Ca 0.76 -0.41 -0.04 0.00 -1.41 0.00 0.00 60.65 59.55 1ibg s ILE 144 Cb -0.36 -0.88 0.05 0.00 0.13 0.00 0.00 42.46 41.40 1ibg s ILE 144 CO 0.32 -0.23 0.21 0.21 -1.91 0.00 0.00 174.94 173.55 1ibg s ASN 145 N -1.77 0.16 0.23 4.50 2.47 -1.23 -5.02 114.94 114.27 1ibg s ASN 145 Ca -0.08 0.46 0.05 0.00 0.42 0.00 0.00 52.86 53.72 1ibg s ASN 145 Cb -0.02 0.43 -0.03 0.00 -1.45 0.00 0.00 41.25 40.18 1ibg s ASN 145 CO 0.00 -0.20 0.27 0.54 -3.72 0.00 0.00 177.10 174.00 1ibg s VAL 146 N 1.80 4.91 0.02 -5.21 0.11 -1.26 -1.76 120.40 119.02 1ibg s VAL 146 Ca -0.04 -1.10 0.01 0.00 -2.93 0.00 0.00 61.98 57.92 1ibg s VAL 146 Cb -0.11 -3.63 -0.02 0.00 -1.53 0.00 0.00 36.38 31.08 1ibg s VAL 146 CO -0.07 -0.29 -0.05 -0.54 -3.33 0.00 0.00 175.10 170.82 1ibg s LYS 147 N -3.76 0.37 -0.16 1.54 1.02 0.16 -4.96 119.74 113.96 1ibg s LYS 147 Ca 0.33 -0.56 -0.04 0.00 0.02 0.00 0.00 55.97 55.72 1ibg s LYS 147 Cb -0.09 -0.09 -0.03 0.00 -0.52 0.00 0.00 37.83 37.10 1ibg s LYS 147 CO 0.27 0.01 -0.03 -1.58 -0.92 0.00 0.00 175.35 173.10 1ibg s TRP 148 N -1.16 3.05 -0.12 3.18 0.52 -1.26 -0.86 118.94 122.29 1ibg s TRP 148 Ca -0.11 -0.24 0.03 0.00 0.02 0.00 0.00 56.10 55.81 1ibg s TRP 148 Cb -0.08 -1.96 0.01 0.00 -1.15 0.00 0.00 33.47 30.28 1ibg s TRP 148 CO -0.00 0.01 -0.23 0.15 0.02 0.00 0.00 176.95 176.90 1ibg s LYS 149 N 0.31 2.98 -0.24 4.98 3.01 -0.78 -3.44 119.74 126.56 1ibg s LYS 149 Ca -0.03 -0.85 0.01 0.00 -1.01 0.00 0.00 55.97 54.09 1ibg s LYS 149 Cb -0.14 -2.33 0.06 0.00 -1.01 0.00 0.00 37.83 34.42 1ibg s LYS 149 CO 0.03 0.08 -0.06 -1.50 0.51 0.00 0.00 175.35 174.41 1ibg s ILE 150 N 0.58 1.62 0.00 2.17 2.07 0.10 -0.59 121.20 127.15 1ibg s ILE 150 Ca -0.13 -1.31 0.00 0.00 -1.41 0.00 0.00 60.65 57.80 1ibg s ILE 150 Cb -0.17 -1.88 0.00 0.00 0.13 0.00 0.00 42.46 40.54 1ibg s ILE 150 CO 0.04 -0.12 0.00 -0.67 -1.91 0.00 0.00 174.94 172.28 1ibg n ASP 151 N 4.63 0.00 -0.73 4.50 -0.08 0.22 -3.97 116.55 121.12 1ibg n ASP 151 Ca -0.12 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.16 1ibg n ASP 151 Cb 0.44 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.90 1ibg n ASP 151 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1ibg n GLY 152 N 0.00 5.95 2.19 0.27 0.00 -1.26 -4.55 105.19 107.79 1ibg n GLY 152 Ca 0.00 -1.97 -0.27 0.00 0.00 0.00 0.00 46.02 43.78 1ibg n GLY 152 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ibg n SER 153 N -0.61 7.21 -4.74 1.61 7.64 -1.26 -4.77 113.62 118.70 1ibg n SER 153 Ca 0.00 -2.57 -0.37 0.00 1.01 0.00 0.00 58.87 56.94 1ibg n SER 153 Cb 0.00 -1.48 -0.06 0.00 -1.01 0.00 0.00 64.21 61.65 1ibg n SER 153 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1ibg s GLU 154 N 1.44 4.24 0.57 1.43 2.02 -1.25 -4.97 118.70 122.18 1ibg s GLU 154 Ca 0.68 0.28 0.08 0.00 0.02 0.00 0.00 54.97 56.03 1ibg s GLU 154 Cb 0.24 -3.40 0.08 0.00 0.10 0.00 0.00 34.13 31.15 1ibg s GLU 154 CO -0.04 0.26 0.79 1.03 0.02 0.00 0.00 175.26 177.32 1ibg s ARG 155 N 0.33 2.29 0.28 1.61 0.52 -1.26 -0.72 118.95 122.01 1ibg s ARG 155 Ca 0.21 -1.54 0.02 0.00 -0.52 0.00 0.00 55.73 53.91 1ibg s ARG 155 Cb -0.14 -2.62 -0.04 0.00 0.52 0.00 0.00 34.95 32.66 1ibg s ARG 155 CO 0.08 -0.86 0.14 -0.65 0.02 0.00 0.00 175.30 174.03 1ibg s GLN 156 N -4.69 1.51 0.04 3.54 -1.52 -1.22 -4.78 119.66 112.54 1ibg s GLN 156 Ca 0.62 -1.84 -0.00 0.00 -1.95 0.00 0.00 55.36 52.18 1ibg s GLN 156 Cb -0.06 -0.10 -0.03 0.00 -0.22 0.00 0.00 33.01 32.60 1ibg s GLN 156 CO 0.39 -0.41 -0.04 1.21 -0.25 0.00 0.00 175.29 176.20 1ibg s ASN 157 N -3.34 0.49 0.00 5.90 3.84 -1.26 -4.92 114.94 115.65 1ibg s ASN 157 Ca 0.37 -0.76 0.00 0.00 0.21 0.00 0.00 52.86 52.67 1ibg s ASN 157 Cb 0.06 0.13 0.00 0.00 -0.55 0.00 0.00 41.25 40.89 1ibg s ASN 157 CO 0.16 -0.43 0.00 0.61 -2.79 0.00 0.00 177.10 174.65 1ibg n GLY 158 N 0.81 1.32 3.78 1.21 0.00 -1.26 -4.96 105.19 106.09 1ibg n GLY 158 Ca -0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 1ibg n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ibg s VAL 159 N -2.00 4.86 -0.14 1.61 1.01 -1.26 -2.45 120.40 122.04 1ibg s VAL 159 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.92 1ibg s VAL 159 Cb 0.00 -3.10 0.02 0.00 0.00 0.00 0.00 36.38 33.30 1ibg s VAL 159 CO 0.00 0.59 -0.18 -0.22 0.00 0.00 0.00 175.10 175.29 1ibg s LEU 160 N -1.04 1.90 -0.12 3.92 2.96 0.55 -4.93 118.68 121.91 1ibg s LEU 160 Ca 0.15 -0.53 0.01 0.00 -0.22 0.00 0.00 54.13 53.54 1ibg s LEU 160 Cb -0.12 -1.28 0.02 0.00 0.50 0.00 0.00 46.19 45.31 1ibg s LEU 160 CO 0.04 0.02 -0.15 0.20 -1.32 0.00 0.00 176.35 175.14 1ibg s ASN 161 N 1.08 2.53 -0.04 3.68 0.01 -1.26 -0.51 114.94 120.44 1ibg s ASN 161 Ca -0.03 -0.45 0.01 0.00 -0.71 0.00 0.00 52.86 51.69 1ibg s ASN 161 Cb -0.14 -1.13 0.02 0.00 0.41 0.00 0.00 41.25 40.41 1ibg s ASN 161 CO -0.05 -0.00 -0.05 -0.55 -1.51 0.00 0.00 177.10 174.94 1ibg s SER 162 N 1.12 0.89 -0.17 -1.22 0.15 -0.28 -5.01 113.70 109.18 1ibg s SER 162 Ca -0.03 -0.12 -0.05 0.00 0.70 0.00 0.00 55.95 56.45 1ibg s SER 162 Cb -0.14 -0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 63.75 1ibg s SER 162 CO -0.04 -0.03 -0.01 0.26 1.20 0.00 0.00 173.24 174.61 1ibg s TRP 163 N 0.74 3.05 0.67 3.44 0.51 -1.26 -1.17 118.94 124.93 1ibg s TRP 163 Ca -0.10 -0.31 -0.13 0.00 -2.12 0.00 0.00 56.10 53.44 1ibg s TRP 163 Cb -0.13 -2.01 0.00 0.00 -0.81 0.00 0.00 33.47 30.52 1ibg s TRP 163 CO 0.00 -0.08 1.08 0.95 -0.51 0.00 0.00 176.95 178.39 1ibg s THR 164 N 0.57 3.61 0.93 2.01 -4.23 -0.66 -5.03 115.64 112.84 1ibg s THR 164 Ca -0.02 0.65 -0.15 0.00 -1.18 0.00 0.00 61.69 60.99 1ibg s THR 164 Cb -0.14 -3.21 0.17 0.00 1.34 0.00 0.00 72.50 70.66 1ibg s THR 164 CO 0.02 -0.56 1.29 -1.81 -0.54 0.00 0.00 174.62 173.02 1ibg s ASP 165 N -3.10 3.42 -0.01 3.99 1.11 -1.26 -4.49 116.67 116.32 1ibg s ASP 165 Ca 0.63 0.35 -0.30 0.00 0.18 0.00 0.00 52.55 53.41 1ibg s ASP 165 Cb -0.17 -0.49 -0.06 0.00 1.07 0.00 0.00 42.92 43.27 1ibg s ASP 165 CO 0.47 -2.55 1.57 -1.58 1.18 0.00 0.00 175.17 174.25 1ibg s GLN 166 N -5.81 4.21 0.33 8.23 0.74 -1.26 -4.71 119.66 121.40 1ibg s GLN 166 Ca 0.71 2.14 -0.29 0.00 0.05 0.00 0.00 55.36 57.98 1ibg s GLN 166 Cb -0.05 -3.77 -0.11 0.00 1.10 0.00 0.00 33.01 30.18 1ibg s GLN 166 CO 0.52 -0.74 1.48 0.34 -0.55 0.00 0.00 175.29 176.34 1ibg s ASP 167 N 2.66 6.45 0.00 6.67 -1.08 -0.10 -4.94 116.67 126.32 1ibg s ASP 167 Ca 0.70 2.93 0.26 0.00 -0.52 0.00 0.00 52.55 55.92 1ibg s ASP 167 Cb -0.34 -2.65 0.73 0.00 -1.46 0.00 0.00 42.92 39.20 1ibg s ASP 167 CO 0.29 -0.81 1.57 -1.54 0.52 0.00 0.00 175.17 175.19 1ibg n SER 168 N 1.13 0.40 -0.08 -0.34 3.41 -1.26 -4.00 113.62 112.88 1ibg n SER 168 Ca 0.03 -0.11 -0.08 0.00 -0.26 0.00 0.00 58.87 58.46 1ibg n SER 168 Cb 0.39 0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.36 1ibg n SER 168 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1ibg n LYS 169 N -1.44 0.50 -4.49 4.33 3.00 -1.26 -2.90 118.16 115.90 1ibg n LYS 169 Ca 0.07 0.28 -0.31 0.00 -0.00 0.00 0.00 58.31 58.34 1ibg n LYS 169 Cb 0.33 -1.47 -0.11 0.00 0.00 0.00 0.00 35.03 33.78 1ibg n LYS 169 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1ibg s ASP 170 N -5.83 4.37 -0.23 3.14 1.47 -1.26 -4.88 116.67 113.46 1ibg s ASP 170 Ca -0.25 -0.25 -0.02 0.00 1.18 0.00 0.00 52.55 53.21 1ibg s ASP 170 Cb 0.03 -0.92 0.08 0.00 -0.34 0.00 0.00 42.92 41.77 1ibg s ASP 170 CO 0.37 0.26 2.33 -1.20 0.68 0.00 0.00 175.17 177.61 1ibg n SER 171 N 1.45 6.06 -4.95 2.11 7.64 -1.26 -4.24 113.62 120.44 1ibg n SER 171 Ca -0.15 -2.86 -0.23 0.00 1.01 0.00 0.00 58.87 56.63 1ibg n SER 171 Cb 0.52 -1.15 0.05 0.00 -1.01 0.00 0.00 64.21 62.63 1ibg n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1ibg s THR 172 N -1.35 2.54 0.15 0.44 -4.23 -1.26 -4.66 115.64 107.27 1ibg s THR 172 Ca 0.32 -0.45 0.09 0.00 -1.18 0.00 0.00 61.69 60.47 1ibg s THR 172 Cb 0.22 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.99 1ibg s THR 172 CO -0.04 -0.02 -0.21 -0.31 -0.54 0.00 0.00 174.62 173.50 1ibg s TYR 173 N -3.00 1.93 0.08 3.99 1.51 -0.07 -0.93 117.35 120.87 1ibg s TYR 173 Ca 0.58 -0.43 0.03 0.00 -1.01 0.00 0.00 57.07 56.24 1ibg s TYR 173 Cb -0.11 -0.99 -0.03 0.00 -0.11 0.00 0.00 41.96 40.72 1ibg s TYR 173 CO 0.42 0.32 -0.09 -1.12 -1.11 0.00 0.00 175.55 173.97 1ibg s SER 174 N -2.40 1.23 0.01 2.29 0.01 -1.26 -0.59 113.70 112.99 1ibg s SER 174 Ca 0.14 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.59 1ibg s SER 174 Cb -0.08 0.04 -0.01 0.00 0.21 0.00 0.00 66.02 66.18 1ibg s SER 174 CO 0.06 -0.30 -0.02 -0.32 0.41 0.00 0.00 173.24 173.07 1ibg s MET 175 N -2.79 0.21 -0.07 12.44 1.75 0.18 -1.65 119.30 129.37 1ibg s MET 175 Ca 0.04 -0.41 0.05 0.00 -1.25 0.00 0.00 55.69 54.12 1ibg s MET 175 Cb -0.02 0.07 -0.00 0.00 2.84 0.00 0.00 34.83 37.71 1ibg s MET 175 CO -0.01 -0.03 -0.22 0.45 -0.65 0.00 0.00 175.02 174.55 1ibg s SER 176 N -0.98 2.81 -0.07 1.11 0.15 -0.32 0.16 113.70 116.58 1ibg s SER 176 Ca -0.11 -0.48 0.01 0.00 0.70 0.00 0.00 55.95 56.07 1ibg s SER 176 Cb -0.07 -0.94 0.02 0.00 -1.71 0.00 0.00 66.02 63.33 1ibg s SER 176 CO -0.01 0.19 -0.07 -0.55 1.20 0.00 0.00 173.24 174.01 1ibg s SER 177 N 0.06 1.49 -0.18 5.45 0.15 -0.38 -1.13 113.70 119.16 1ibg s SER 177 Ca -0.08 -0.21 0.01 0.00 0.70 0.00 0.00 55.95 56.37 1ibg s SER 177 Cb -0.15 -0.63 0.04 0.00 -1.71 0.00 0.00 66.02 63.57 1ibg s SER 177 CO 0.05 -0.05 -0.11 -0.89 1.20 0.00 0.00 173.24 173.43 1ibg s THR 178 N 1.10 1.57 -0.15 6.45 2.01 0.34 -1.07 115.64 125.88 1ibg s THR 178 Ca -0.08 -0.86 -0.21 0.00 0.31 0.00 0.00 61.69 60.85 1ibg s THR 178 Cb -0.14 -1.60 -0.03 0.00 0.01 0.00 0.00 72.50 70.73 1ibg s THR 178 CO -0.01 0.25 0.64 -0.22 -0.69 0.00 0.00 174.62 174.59 1ibg s LEU 179 N 1.45 4.21 -0.23 4.42 2.96 0.17 -0.33 118.68 131.33 1ibg s LEU 179 Ca 0.01 0.96 -0.00 0.00 -0.22 0.00 0.00 54.13 54.87 1ibg s LEU 179 Cb -0.15 -2.94 0.03 0.00 0.50 0.00 0.00 46.19 43.63 1ibg s LEU 179 CO -0.09 -0.20 -0.11 -0.89 -1.32 0.00 0.00 176.35 173.74 1ibg s THR 180 N 1.42 2.53 0.42 3.68 2.01 -1.02 -0.83 115.64 123.84 1ibg s THR 180 Ca 0.31 -1.07 0.08 0.00 0.31 0.00 0.00 61.69 61.32 1ibg s THR 180 Cb -0.16 -2.24 -0.02 0.00 0.01 0.00 0.00 72.50 70.08 1ibg s THR 180 CO 0.13 0.28 0.39 -0.76 -0.69 0.00 0.00 174.62 173.97 1ibg s LEU 181 N 1.29 3.41 0.45 4.42 1.43 0.47 -4.91 118.68 125.25 1ibg s LEU 181 Ca 0.00 -0.72 -0.12 0.00 -1.03 0.00 0.00 54.13 52.27 1ibg s LEU 181 Cb -0.16 -2.10 -0.06 0.00 0.03 0.00 0.00 46.19 43.89 1ibg s LEU 181 CO -0.07 -0.66 0.84 0.42 0.23 0.00 0.00 176.35 177.11 1ibg s THR 182 N -2.46 4.73 0.18 5.49 -4.23 -1.26 -0.95 115.64 117.13 1ibg s THR 182 Ca 0.49 0.75 -0.14 0.00 -1.18 0.00 0.00 61.69 61.61 1ibg s THR 182 Cb -0.04 -3.75 0.08 0.00 1.34 0.00 0.00 72.50 70.13 1ibg s THR 182 CO 0.28 -0.63 1.73 0.50 -0.54 0.00 0.00 174.62 175.97 1ibg h LYS 183 N 0.98 0.27 -0.22 3.99 3.64 -1.30 0.56 116.57 124.49 1ibg h LYS 183 Ca -0.47 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 1ibg h LYS 183 Cb 1.19 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1ibg h LYS 183 CO 0.63 0.18 0.00 -0.25 -2.27 0.00 0.00 179.45 177.74 1ibg n ASP 184 N -5.06 0.22 0.00 4.20 8.00 -1.26 0.30 116.55 122.96 1ibg n ASP 184 Ca 0.04 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.77 1ibg n ASP 184 Cb 0.20 -0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 1ibg n ASP 184 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 1ibg n GLU 185 N -0.03 0.00 0.35 -1.24 0.28 -1.11 -4.84 120.64 114.05 1ibg n GLU 185 Ca 0.00 0.00 -0.19 0.00 -0.16 0.00 0.00 57.16 56.81 1ibg n GLU 185 Cb 0.06 -0.22 -0.10 0.00 1.43 0.00 0.00 31.44 32.61 1ibg n GLU 185 CO 0.00 0.00 0.00 -0.92 -0.16 0.00 0.00 177.13 176.05 1ibg h TYR 186 N 0.00 -1.30 -1.57 -1.84 3.20 0.16 -3.13 116.97 112.50 1ibg h TYR 186 Ca 0.00 -0.00 0.45 0.00 3.14 0.00 0.00 58.73 62.32 1ibg h TYR 186 Cb 0.00 0.48 -0.06 0.00 1.54 0.00 0.00 36.73 38.69 1ibg h TYR 186 CO 0.00 -0.68 1.33 -1.91 -1.64 0.00 0.00 178.16 175.26 1ibg n GLU 187 N -5.58 0.01 -1.76 1.82 4.07 0.15 -2.41 120.64 116.93 1ibg n GLU 187 Ca -0.13 1.04 -0.29 0.00 -0.06 0.00 0.00 57.16 57.73 1ibg n GLU 187 Cb 0.47 -2.48 0.04 0.00 -0.06 0.00 0.00 31.44 29.41 1ibg n GLU 187 CO 0.00 0.00 0.00 2.89 -0.06 0.00 0.00 177.13 179.96 1ibg n ARG 188 N -3.60 3.24 -3.67 5.31 1.85 -1.18 -4.99 116.66 113.62 1ibg n ARG 188 Ca 0.35 -3.83 -0.12 0.00 -1.00 0.00 0.00 57.85 53.26 1ibg n ARG 188 Cb 1.80 -2.28 -0.06 0.00 -1.05 0.00 0.00 32.46 30.86 1ibg n ARG 188 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 1ibg s HIS 189 N -3.70 -0.22 -0.11 2.89 3.76 -1.01 -5.05 115.29 111.85 1ibg s HIS 189 Ca 0.56 0.07 -0.06 0.00 -0.15 0.00 0.00 55.06 55.48 1ibg s HIS 189 Cb 0.45 0.22 -0.05 0.00 1.11 0.00 0.00 32.58 34.30 1ibg s HIS 189 CO 0.01 -0.61 -0.16 -1.71 -0.85 0.00 0.00 174.74 171.42 1ibg n ASN 190 N 0.24 0.92 -4.74 1.40 5.15 -1.26 -4.79 115.26 112.19 1ibg n ASN 190 Ca -0.18 0.16 -0.36 0.00 -0.60 0.00 0.00 54.58 53.61 1ibg n ASN 190 Cb 0.61 -0.38 -0.08 0.00 -0.53 0.00 0.00 39.78 39.40 1ibg n ASN 190 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1ibg s SER 191 N -6.08 5.62 -0.12 1.20 0.01 -1.26 -1.75 113.70 111.32 1ibg s SER 191 Ca -0.17 0.24 -0.04 0.00 1.31 0.00 0.00 55.95 57.30 1ibg s SER 191 Cb 0.06 -1.69 0.05 0.00 0.21 0.00 0.00 66.02 64.65 1ibg s SER 191 CO 0.21 0.38 0.11 -0.31 0.41 0.00 0.00 173.24 174.04 1ibg s TYR 192 N -0.86 0.01 0.13 2.43 2.02 -0.95 0.72 117.35 120.86 1ibg s TYR 192 Ca 0.13 0.11 0.06 0.00 -0.37 0.00 0.00 57.07 57.00 1ibg s TYR 192 Cb -0.12 -0.50 -0.04 0.00 -0.40 0.00 0.00 41.96 40.90 1ibg s TYR 192 CO 0.03 -0.39 0.02 0.99 -1.57 0.00 0.00 175.55 174.63 1ibg s THR 193 N 2.21 4.01 -0.15 -0.71 2.01 0.24 -1.13 115.64 122.13 1ibg s THR 193 Ca 0.04 -1.13 -0.02 0.00 0.31 0.00 0.00 61.69 60.89 1ibg s THR 193 Cb -0.14 -2.97 0.05 0.00 0.01 0.00 0.00 72.50 69.45 1ibg s THR 193 CO -0.07 0.02 0.00 0.00 -0.69 0.00 0.00 174.62 173.88 1ibg s GLU 195 N 1.84 1.63 -0.17 0.00 2.12 -0.04 -1.46 118.70 122.61 1ibg s GLU 195 Ca 0.01 -0.66 -0.07 0.00 0.36 0.00 0.00 54.97 54.61 1ibg s GLU 195 Cb -0.15 -2.19 -0.04 0.00 0.26 0.00 0.00 34.13 32.01 1ibg s GLU 195 CO -0.07 -0.45 0.09 0.00 -0.54 0.00 0.00 175.26 174.29 1ibg s ALA 196 N 1.54 3.56 -0.25 6.30 0.00 0.30 0.40 121.76 133.60 1ibg s ALA 196 Ca -0.00 -0.72 0.02 0.00 0.00 0.00 0.00 51.96 51.26 1ibg s ALA 196 Cb -0.16 -1.95 0.05 0.00 0.00 0.00 0.00 23.12 21.06 1ibg s ALA 196 CO -0.08 0.30 -0.11 0.99 0.00 0.00 0.00 175.76 176.86 1ibg s THR 197 N -0.02 2.29 -0.05 0.00 2.01 -0.72 -0.18 115.64 118.97 1ibg s THR 197 Ca 0.08 -1.48 -0.00 0.00 0.31 0.00 0.00 61.69 60.59 1ibg s THR 197 Cb -0.12 -2.29 0.03 0.00 0.01 0.00 0.00 72.50 70.13 1ibg s THR 197 CO 0.00 0.05 -0.01 -2.28 -0.69 0.00 0.00 174.62 171.69 1ibg s HIS 198 N 1.16 0.57 0.00 4.92 5.04 -1.26 -3.52 115.29 122.20 1ibg s HIS 198 Ca -0.06 -0.12 0.00 0.00 -1.54 0.00 0.00 55.06 53.34 1ibg s HIS 198 Cb -0.19 -0.64 0.00 0.00 0.04 0.00 0.00 32.58 31.80 1ibg s HIS 198 CO -0.06 -0.22 0.00 1.63 -2.34 0.00 0.00 174.74 173.75 1ibg n LYS 199 N 4.51 0.00 0.17 2.88 5.02 -1.26 -2.34 118.16 127.13 1ibg n LYS 199 Ca -0.18 0.00 0.12 0.00 -2.02 0.00 0.00 58.31 56.22 1ibg n LYS 199 Cb 0.50 0.00 0.60 0.00 -0.02 0.00 0.00 35.03 36.12 1ibg n LYS 199 CO 0.00 0.00 0.00 1.15 -0.52 0.00 0.00 177.40 178.03 1ibg h THR 200 N 0.00 0.00 -2.51 -0.18 2.02 -1.92 -3.44 112.91 106.88 1ibg h THR 200 Ca 0.00 -0.03 -0.08 0.00 0.77 0.00 0.00 66.41 67.07 1ibg h THR 200 Cb 0.00 0.56 -0.19 0.00 -1.74 0.00 0.00 68.15 66.78 1ibg h THR 200 CO 0.00 0.00 -0.01 -0.55 0.37 0.00 0.00 175.52 175.33 1ibg s SER 201 N -4.11 -0.44 0.01 4.18 0.15 -0.99 -5.02 113.70 107.48 1ibg s SER 201 Ca -0.02 0.40 -0.19 0.00 0.70 0.00 0.00 55.95 56.84 1ibg s SER 201 Cb 0.07 0.44 -0.26 0.00 -1.71 0.00 0.00 66.02 64.56 1ibg s SER 201 CO 0.23 -0.56 1.07 0.71 1.20 0.00 0.00 173.24 175.89 1ibg h THR 202 N 3.31 1.40 -1.95 6.45 1.35 -1.89 -3.41 112.91 118.17 1ibg h THR 202 Ca -0.29 -2.25 -0.61 0.00 -0.55 0.00 0.00 66.41 62.72 1ibg h THR 202 Cb 1.16 2.70 0.01 0.00 -1.73 0.00 0.00 68.15 70.29 1ibg h THR 202 CO 0.40 0.66 1.22 -1.20 -0.25 0.00 0.00 175.52 176.35 1ibg n SER 203 N -4.08 3.37 -4.76 5.36 7.64 -1.26 -4.94 113.62 114.95 1ibg n SER 203 Ca -0.12 0.78 -0.40 0.00 1.01 0.00 0.00 58.87 60.15 1ibg n SER 203 Cb 0.78 -1.41 0.02 0.00 -1.01 0.00 0.00 64.21 62.59 1ibg n SER 203 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1ibg s PRO 204 N 4.75 3.61 0.48 1.43 0.04 -1.26 -4.80 135.00 139.25 1ibg s PRO 204 Ca 0.96 2.38 -0.15 0.00 0.04 0.00 0.00 61.00 64.23 1ibg s PRO 204 Cb -0.62 -2.60 -0.07 0.00 0.04 0.00 0.00 34.50 31.25 1ibg s PRO 204 CO 0.48 -0.86 0.91 0.42 0.04 0.00 0.00 177.00 177.99 1ibg s ILE 205 N -1.22 4.62 -0.09 0.56 -1.09 0.74 -4.86 121.20 119.86 1ibg s ILE 205 Ca 0.62 1.02 -0.07 0.00 -2.23 0.00 0.00 60.65 59.99 1ibg s ILE 205 Cb -0.43 -3.72 0.03 0.00 -1.58 0.00 0.00 42.46 36.75 1ibg s ILE 205 CO 0.55 -0.63 0.23 -0.69 -1.23 0.00 0.00 174.94 173.16 1ibg s VAL 206 N -2.54 -0.01 0.08 2.92 1.01 -1.26 -0.54 120.40 120.06 1ibg s VAL 206 Ca 0.56 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.62 1ibg s VAL 206 Cb -0.10 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 1ibg s VAL 206 CO 0.31 0.02 -0.11 -0.75 0.00 0.00 0.00 175.10 174.57 1ibg s LYS 207 N 0.42 0.76 -0.20 2.72 2.36 -0.53 -5.02 119.74 120.25 1ibg s LYS 207 Ca -0.02 -1.01 -0.28 0.00 -2.55 0.00 0.00 55.97 52.10 1ibg s LYS 207 Cb -0.04 -0.54 0.13 0.00 -1.05 0.00 0.00 37.83 36.32 1ibg s LYS 207 CO -0.02 0.10 1.01 0.45 1.55 0.00 0.00 175.35 178.44 1ibg s SER 208 N -2.07 -0.39 0.09 1.43 0.15 -1.26 -0.83 113.70 110.82 1ibg s SER 208 Ca -0.00 0.55 0.02 0.00 0.70 0.00 0.00 55.95 57.22 1ibg s SER 208 Cb -0.06 0.49 -0.04 0.00 -1.71 0.00 0.00 66.02 64.70 1ibg s SER 208 CO 0.01 -0.28 -0.07 0.72 1.20 0.00 0.00 173.24 174.82 1ibg s PHE 209 N -0.66 0.87 -0.21 3.44 -0.71 -0.28 -4.98 117.98 115.46 1ibg s PHE 209 Ca -0.00 -0.82 -0.06 0.00 -1.04 0.00 0.00 56.93 55.01 1ibg s PHE 209 Cb -0.02 -0.50 -0.03 0.00 -1.21 0.00 0.00 43.02 41.26 1ibg s PHE 209 CO -0.01 -0.12 0.03 1.21 -1.34 0.00 0.00 175.22 174.99 1ibg s ASN 210 N -2.76 5.04 -0.32 1.98 3.04 -1.26 -2.24 114.94 118.42 1ibg s ASN 210 Ca 0.08 -0.16 -0.29 0.00 0.04 0.00 0.00 52.86 52.53 1ibg s ASN 210 Cb 0.02 -1.88 -0.07 0.00 -1.54 0.00 0.00 41.25 37.79 1ibg s ASN 210 CO -0.03 0.05 2.28 0.54 -3.04 0.00 0.00 177.10 176.89 1ibg n ARG 211 N 4.36 1.58 -3.29 0.43 1.74 -0.72 -4.87 116.66 115.89 1ibg n ARG 211 Ca -0.17 0.36 -0.46 0.00 -0.77 0.00 0.00 57.85 56.81 1ibg n ARG 211 Cb 0.52 -3.13 -0.03 0.00 -1.02 0.00 0.00 32.46 28.79 1ibg n ARG 211 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1ibg s ASN 212 N 9.08 6.54 -0.83 0.55 3.84 -1.26 -4.00 114.94 128.86 1ibg s ASN 212 Ca 1.02 -2.31 -0.01 0.00 0.21 0.00 0.00 52.86 51.78 1ibg s ASN 212 Cb -0.40 -2.22 0.00 0.00 -0.55 0.00 0.00 41.25 38.08 1ibg s ASN 212 CO 0.36 -0.72 0.14 1.21 -2.79 0.00 0.00 177.10 175.30 1ibg n GLU 213 N 4.62 -1.58 -0.86 0.43 4.07 -1.26 -5.31 120.64 120.75 1ibg n GLU 213 Ca 0.04 0.48 0.00 0.00 -0.06 0.00 0.00 57.16 57.62 1ibg n GLU 213 Cb 0.45 -4.47 0.00 0.00 -0.06 0.00 0.00 31.44 27.36 1ibg n GLU 213 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07