#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ici h SER -9 N 0.00 0.00 -0.34 1.61 0.87 -2.06 -1.69 113.55 111.95 1ici h SER -9 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1ici h SER -9 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1ici h SER -9 CO 0.00 0.00 0.00 1.41 -0.53 0.00 0.00 176.83 177.71 1ici n HIS -8 N -2.96 0.44 -2.57 2.24 -0.00 -1.26 -4.41 115.22 106.69 1ici n HIS -8 Ca 0.02 -0.29 -0.09 0.00 -0.00 0.00 0.00 57.72 57.35 1ici n HIS -8 Cb 0.35 -0.01 0.04 0.00 -0.00 0.00 0.00 29.99 30.37 1ici n HIS -8 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1ici n HIS -7 N 1.07 1.78 -1.87 4.41 -0.00 -0.66 -5.09 115.22 114.87 1ici n HIS -7 Ca 0.15 -2.29 -0.41 0.00 -0.00 0.00 0.00 57.72 55.17 1ici n HIS -7 Cb 0.50 -0.27 -0.02 0.00 -0.00 0.00 0.00 29.99 30.20 1ici n HIS -7 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1ici s HIS -6 N -3.66 2.87 -0.12 1.57 4.02 -1.06 -3.76 115.29 115.15 1ici s HIS -6 Ca 0.35 0.84 0.01 0.00 1.02 0.00 0.00 55.06 57.27 1ici s HIS -6 Cb 0.37 -3.98 -0.01 0.00 -1.02 0.00 0.00 32.58 27.94 1ici s HIS -6 CO -0.02 -3.29 -0.16 -1.58 1.02 0.00 0.00 174.74 170.72 1ici s HIS -5 N 0.12 2.75 -0.06 1.40 5.65 -1.26 -5.06 115.29 118.84 1ici s HIS -5 Ca 0.63 -0.74 -0.01 0.00 0.25 0.00 0.00 55.06 55.18 1ici s HIS -5 Cb -0.46 -1.81 -0.03 0.00 -1.18 0.00 0.00 32.58 29.10 1ici s HIS -5 CO 0.44 -0.26 0.02 -1.01 -0.65 0.00 0.00 174.74 173.28 1ici s HIS -4 N 0.35 3.18 0.18 3.88 4.02 -1.26 -4.89 115.29 120.74 1ici s HIS -4 Ca -0.13 0.18 0.08 0.00 1.02 0.00 0.00 55.06 56.22 1ici s HIS -4 Cb -0.16 -1.76 -0.04 0.00 -1.02 0.00 0.00 32.58 29.59 1ici s HIS -4 CO 0.07 0.49 -0.17 -3.38 1.02 0.00 0.00 174.74 172.76 1ici s HIS -3 N -0.98 1.80 0.51 1.40 0.00 -1.26 -4.95 115.29 111.82 1ici s HIS -3 Ca 0.16 -0.49 -0.21 0.00 -3.00 0.00 0.00 55.06 51.52 1ici s HIS -3 Cb -0.11 -0.88 -0.07 0.00 -4.00 0.00 0.00 32.58 27.52 1ici s HIS -3 CO 0.06 0.35 1.14 0.20 -1.00 0.00 0.00 174.74 175.49 1ici s GLY -2 N -2.84 2.69 -0.02 -1.38 0.00 -0.54 -4.81 107.32 100.43 1ici s GLY -2 Ca 0.18 0.87 0.03 0.00 0.00 0.00 0.00 44.72 45.79 1ici s GLY -2 CO 0.07 1.27 0.89 -1.14 0.00 0.00 0.00 173.10 174.19 1ici n SER -1 N -0.95 1.41 -4.31 1.64 3.41 -1.26 -1.63 113.62 111.93 1ici n SER -1 Ca 0.10 -1.89 -0.16 0.00 -0.26 0.00 0.00 58.87 56.65 1ici n SER -1 Cb 0.50 -0.07 -0.10 0.00 -0.26 0.00 0.00 64.21 64.27 1ici n SER -1 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1ici s HIS 0 N -0.94 1.48 -1.33 7.33 4.02 -1.26 -4.69 115.29 119.91 1ici s HIS 0 Ca 0.04 -1.01 -0.14 0.00 1.02 0.00 0.00 55.06 54.97 1ici s HIS 0 Cb 0.04 -0.86 0.10 0.00 -1.02 0.00 0.00 32.58 30.83 1ici s HIS 0 CO 0.00 -0.15 1.87 -1.33 1.02 0.00 0.00 174.74 176.15 1ici n MET 1 N -0.39 3.22 -2.06 1.40 2.81 -1.26 -4.84 117.12 115.98 1ici n MET 1 Ca -0.04 -3.23 -0.15 0.00 -1.81 0.00 0.00 57.70 52.47 1ici n MET 1 Cb 0.64 -3.22 0.07 0.00 -0.71 0.00 0.00 33.22 30.00 1ici n MET 1 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 1ici n ASP 2 N 6.18 1.09 0.13 7.83 3.85 -1.26 -4.95 116.55 129.41 1ici n ASP 2 Ca 0.46 -1.86 -0.02 0.00 -0.71 0.00 0.00 54.79 52.66 1ici n ASP 2 Cb 0.41 -0.38 0.18 0.00 -1.35 0.00 0.00 41.12 39.98 1ici n ASP 2 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.20 175.86 1ici h GLU 3 N 0.00 0.06 -0.53 0.11 5.08 -1.99 -2.79 114.58 114.52 1ici h GLU 3 Ca -0.21 -0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 58.00 1ici h GLU 3 Cb 0.82 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1ici h GLU 3 CO 0.25 0.62 -0.13 -0.22 -1.00 0.00 0.00 179.01 178.53 1ici h LYS 4 N 0.04 1.01 0.19 2.33 3.64 -1.96 0.41 116.57 122.22 1ici h LYS 4 Ca -0.01 -0.38 -0.01 0.00 -1.27 0.00 0.00 60.65 58.98 1ici h LYS 4 Cb 1.04 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 1ici h LYS 4 CO 0.08 1.06 -0.09 1.25 -2.27 0.00 0.00 179.45 179.48 1ici h LEU 5 N 0.89 -0.21 -1.30 5.20 5.85 -1.87 0.79 115.31 124.66 1ici h LEU 5 Ca 0.13 -0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.81 1ici h LEU 5 Cb 0.70 0.05 -0.04 0.00 0.37 0.00 0.00 40.66 41.74 1ici h LEU 5 CO 0.05 -0.06 0.48 -0.07 -0.34 0.00 0.00 178.44 178.50 1ici h LEU 6 N -0.34 0.79 -0.66 2.25 3.38 -1.42 -1.09 115.31 118.21 1ici h LEU 6 Ca -0.03 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 1ici h LEU 6 Cb 0.27 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1ici h LEU 6 CO 0.04 0.55 -0.12 0.50 0.09 0.00 0.00 178.44 179.51 1ici h LYS 7 N 0.92 0.92 -0.71 1.13 3.64 -0.48 0.07 116.57 122.06 1ici h LYS 7 Ca 0.29 -0.33 -0.06 0.00 -1.27 0.00 0.00 60.65 59.27 1ici h LYS 7 Cb 0.01 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1ici h LYS 7 CO -0.08 0.99 0.20 1.15 -2.27 0.00 0.00 179.45 179.44 1ici h THR 8 N 0.82 1.26 -0.05 1.00 2.02 0.36 -0.07 112.91 118.26 1ici h THR 8 Ca 0.13 -0.93 -0.13 0.00 0.77 0.00 0.00 66.41 66.25 1ici h THR 8 Cb 0.65 0.50 0.01 0.00 -1.74 0.00 0.00 68.15 67.57 1ici h THR 8 CO 0.05 0.36 -0.49 0.40 0.37 0.00 0.00 175.52 176.21 1ici h ILE 9 N 1.07 1.41 -0.34 3.11 2.04 -1.14 -2.71 117.51 120.95 1ici h ILE 9 Ca 0.23 -1.91 -0.09 0.00 1.00 0.00 0.00 64.86 64.09 1ici h ILE 9 Cb 0.33 2.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.80 1ici h ILE 9 CO -0.00 0.56 -0.18 0.00 0.00 0.00 0.00 178.15 178.53 1ici h ALA 10 N 0.39 1.05 -0.39 1.87 0.00 -0.93 -3.08 119.26 118.18 1ici h ALA 10 Ca -0.05 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1ici h ALA 10 Cb 1.17 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1ici h ALA 10 CO 0.10 0.58 0.00 0.39 0.00 0.00 0.00 179.25 180.31 1ici n GLU 11 N -4.15 2.25 -2.09 0.00 1.02 -0.05 -4.96 120.64 112.67 1ici n GLU 11 Ca 0.00 -1.91 -0.38 0.00 -0.02 0.00 0.00 57.16 54.85 1ici n GLU 11 Cb 0.38 -1.46 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 1ici n GLU 11 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1ici s SER 12 N -1.35 6.01 0.08 1.62 1.04 -1.02 -4.94 113.70 115.13 1ici s SER 12 Ca 0.37 2.50 0.21 0.00 0.48 0.00 0.00 55.95 59.51 1ici s SER 12 Cb 0.20 -2.62 -0.15 0.00 0.10 0.00 0.00 66.02 63.55 1ici s SER 12 CO 0.28 -1.04 0.76 0.29 0.98 0.00 0.00 173.24 174.51 1ici n LYS 13 N -0.43 0.63 -2.83 4.02 5.02 -1.26 -4.73 118.16 118.58 1ici n LYS 13 Ca 0.07 0.03 -0.08 0.00 -2.02 0.00 0.00 58.31 56.32 1ici n LYS 13 Cb 0.46 -1.71 0.01 0.00 -0.02 0.00 0.00 35.03 33.77 1ici n LYS 13 CO 0.00 0.00 0.00 0.98 -0.52 0.00 0.00 177.40 177.86 1ici n TYR 14 N -2.59 -3.34 -2.98 2.13 9.36 -1.26 -5.01 117.16 113.47 1ici n TYR 14 Ca -0.05 -1.71 -0.40 0.00 3.32 0.00 0.00 57.90 59.05 1ici n TYR 14 Cb 0.66 1.34 -0.05 0.00 -0.63 0.00 0.00 39.34 40.65 1ici n TYR 14 CO 0.00 0.00 0.00 -1.17 0.22 0.00 0.00 176.86 175.91 1ici s LEU 15 N 0.31 4.42 0.32 2.98 0.20 -1.25 -2.09 118.68 123.56 1ici s LEU 15 Ca 0.31 1.41 0.03 0.00 0.69 0.00 0.00 54.13 56.58 1ici s LEU 15 Cb 0.07 -3.23 -0.06 0.00 -0.43 0.00 0.00 46.19 42.55 1ici s LEU 15 CO -0.12 -0.03 0.08 0.68 -0.29 0.00 0.00 176.35 176.67 1ici s VAL 16 N 0.18 0.98 0.05 1.68 -7.23 -0.76 -0.23 120.40 115.06 1ici s VAL 16 Ca 0.39 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.59 1ici s VAL 16 Cb -0.20 -2.71 -0.03 0.00 0.56 0.00 0.00 36.38 34.01 1ici s VAL 16 CO 0.22 0.00 -0.08 0.00 -0.31 0.00 0.00 175.10 174.93 1ici s ALA 17 N -3.39 0.67 -0.13 1.32 0.00 -0.79 -1.19 121.76 118.25 1ici s ALA 17 Ca 0.35 -0.86 -0.01 0.00 0.00 0.00 0.00 51.96 51.45 1ici s ALA 17 Cb 0.08 0.05 0.03 0.00 0.00 0.00 0.00 23.12 23.28 1ici s ALA 17 CO 0.15 -0.03 -0.06 -1.17 0.00 0.00 0.00 175.76 174.65 1ici s LEU 18 N -1.77 1.33 0.14 0.00 2.96 0.76 -0.36 118.68 121.73 1ici s LEU 18 Ca -0.07 -0.44 0.09 0.00 -0.22 0.00 0.00 54.13 53.49 1ici s LEU 18 Cb -0.08 -0.85 -0.04 0.00 0.50 0.00 0.00 46.19 45.72 1ici s LEU 18 CO -0.00 -0.15 -0.14 0.42 -1.32 0.00 0.00 176.35 175.16 1ici s THR 19 N 1.69 3.02 0.48 3.68 -4.23 -0.42 -1.44 115.64 118.42 1ici s THR 19 Ca 0.03 -1.56 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 1ici s THR 19 Cb -0.14 -2.43 -0.00 0.00 1.34 0.00 0.00 72.50 71.27 1ici s THR 19 CO -0.08 0.01 0.01 0.61 -0.54 0.00 0.00 174.62 174.64 1ici n GLY 20 N 0.48 3.55 0.36 3.99 0.00 -0.49 -1.42 105.19 111.65 1ici n GLY 20 Ca -0.13 -2.34 0.18 0.00 0.00 0.00 0.00 46.02 43.72 1ici n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ici h ALA 21 N 1.29 1.67 0.00 4.61 0.00 -1.79 -1.86 119.26 123.18 1ici h ALA 21 Ca -0.40 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 1ici h ALA 21 Cb 1.23 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1ici h ALA 21 CO 0.66 -0.44 -0.09 0.78 0.00 0.00 0.00 179.25 180.16 1ici h GLY 22 N 0.00 0.00 2.00 0.00 0.00 -1.22 -2.19 103.07 101.66 1ici h GLY 22 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.41 1ici h GLY 22 CO -0.00 0.00 0.00 -2.08 0.00 0.00 0.00 176.54 174.46 1ici h VAL 23 N 0.00 0.00 -0.00 4.60 2.07 -1.50 -2.77 116.25 118.65 1ici h VAL 23 Ca -0.00 -0.36 0.00 0.00 0.82 0.00 0.00 66.70 67.16 1ici h VAL 23 Cb 0.27 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 1ici h VAL 23 CO 0.01 0.00 -0.42 -1.20 0.02 0.00 0.00 177.57 175.98 1ici n SER 24 N -2.78 0.97 -0.22 0.57 7.64 -0.84 -4.53 113.62 114.43 1ici n SER 24 Ca 0.01 -0.99 0.19 0.00 1.01 0.00 0.00 58.87 59.09 1ici n SER 24 Cb 0.25 0.74 0.52 0.00 -1.01 0.00 0.00 64.21 64.71 1ici n SER 24 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ici h ALA 25 N 1.94 2.23 -0.10 -0.43 0.00 -1.33 0.30 119.26 121.87 1ici h ALA 25 Ca 0.00 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ici h ALA 25 Cb 0.36 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1ici h ALA 25 CO 0.00 -0.49 0.00 0.39 0.00 0.00 0.00 179.25 179.15 1ici n GLU 26 N -4.49 1.23 -0.04 0.00 1.02 -1.26 -2.69 120.64 114.41 1ici n GLU 26 Ca 0.18 -0.36 0.07 0.00 -0.02 0.00 0.00 57.16 57.03 1ici n GLU 26 Cb 0.68 -1.09 0.08 0.00 -0.02 0.00 0.00 31.44 31.09 1ici n GLU 26 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1ici n SER 27 N -0.22 2.33 0.00 1.62 7.64 0.11 -4.75 113.62 120.35 1ici n SER 27 Ca 0.04 -1.65 0.00 0.00 1.01 0.00 0.00 58.87 58.27 1ici n SER 27 Cb 0.09 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 1ici n SER 27 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ici n GLY 28 N 0.76 0.78 3.20 0.23 0.00 -1.10 -4.12 105.19 104.93 1ici n GLY 28 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 1ici n GLY 28 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ici s ILE 29 N -2.00 4.53 0.75 -0.61 -1.09 -1.17 -5.05 121.20 116.55 1ici s ILE 29 Ca 0.00 -2.73 -0.14 0.00 -2.23 0.00 0.00 60.65 55.55 1ici s ILE 29 Cb 0.00 -3.87 0.05 0.00 -1.58 0.00 0.00 42.46 37.06 1ici s ILE 29 CO 0.00 -0.94 1.19 -2.84 -1.23 0.00 0.00 174.94 171.12 1ici s PRO 30 N 0.06 2.06 0.54 2.79 0.02 -1.26 -3.33 135.00 135.88 1ici s PRO 30 Ca 0.17 1.70 -0.18 0.00 0.02 0.00 0.00 61.00 62.72 1ici s PRO 30 Cb -0.16 -1.83 -0.06 0.00 0.02 0.00 0.00 34.50 32.47 1ici s PRO 30 CO -0.06 -1.89 1.04 0.95 -0.33 0.00 0.00 177.00 176.72 1ici s THR 31 N -2.10 3.91 -0.12 0.99 -4.23 -1.26 -4.95 115.64 107.88 1ici s THR 31 Ca 0.73 1.01 0.23 0.00 -1.18 0.00 0.00 61.69 62.48 1ici s THR 31 Cb -0.28 -3.45 0.25 0.00 1.34 0.00 0.00 72.50 70.36 1ici s THR 31 CO 0.47 -0.43 1.69 -0.26 -0.54 0.00 0.00 174.62 175.54 1ici h PHE 32 N 0.92 0.00 -6.84 3.99 -1.00 -1.94 -3.47 116.94 108.60 1ici h PHE 32 Ca -0.48 0.00 -0.57 0.00 2.81 0.00 0.00 57.97 59.73 1ici h PHE 32 Cb 1.21 0.00 -0.24 0.00 3.61 0.00 0.00 35.95 40.53 1ici h PHE 32 CO 0.59 0.19 -0.85 0.54 -1.61 0.00 0.00 178.31 177.16 1ici n ARG 33 N -3.21 -2.67 -0.17 1.51 1.74 -1.26 -1.00 116.66 111.60 1ici n ARG 33 Ca 0.02 0.33 0.00 0.00 -0.77 0.00 0.00 57.85 57.42 1ici n ARG 33 Cb 0.52 -5.01 0.00 0.00 -1.02 0.00 0.00 32.46 26.94 1ici n ARG 33 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ici n GLY 34 N -1.34 1.53 3.32 -0.13 0.00 -1.26 -5.04 105.19 102.27 1ici n GLY 34 Ca 0.08 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.80 1ici n GLY 34 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ici s LYS 35 N -0.40 1.88 0.41 1.61 1.02 -0.17 -3.80 119.74 120.29 1ici s LYS 35 Ca 0.00 -1.01 0.28 0.00 0.02 0.00 0.00 55.97 55.26 1ici s LYS 35 Cb 0.00 -1.95 1.45 0.00 -0.52 0.00 0.00 37.83 36.82 1ici s LYS 35 CO 0.00 0.52 1.87 0.38 -0.92 0.00 0.00 175.35 177.19 1ici h ASP 36 N 5.10 0.00 0.00 2.83 3.04 -0.88 -3.43 116.42 123.08 1ici h ASP 36 Ca -0.44 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.35 1ici h ASP 36 Cb 1.13 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.42 1ici h ASP 36 CO 0.45 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 178.26 1ici n GLY 37 N -0.90 2.48 0.53 7.15 0.00 -1.26 -4.77 105.19 108.43 1ici n GLY 37 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 1ici n GLY 37 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ici n LEU 38 N 0.00 1.12 -0.01 0.99 7.94 -1.26 -4.76 117.00 121.03 1ici n LEU 38 Ca 0.00 0.17 -0.01 0.00 -1.11 0.00 0.00 56.01 55.06 1ici n LEU 38 Cb 0.00 -0.47 -0.12 0.00 0.53 0.00 0.00 43.42 43.36 1ici n LEU 38 CO 0.00 -0.50 -0.59 0.79 -1.11 0.00 0.00 177.39 175.98 1ici n TRP 39 N -3.59 0.58 -3.56 1.96 8.01 -1.26 -5.00 117.44 114.58 1ici n TRP 39 Ca -0.05 0.19 -0.23 0.00 -1.31 0.00 0.00 57.50 56.10 1ici n TRP 39 Cb 0.20 -0.97 0.08 0.00 -2.01 0.00 0.00 31.31 28.60 1ici n TRP 39 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 1ici n ASN 40 N -2.75 -5.79 0.00 -0.99 3.02 -1.26 -4.90 115.26 102.58 1ici n ASN 40 Ca -0.15 -0.54 0.00 0.00 -0.03 0.00 0.00 54.58 53.86 1ici n ASN 40 Cb 0.88 -4.98 0.00 0.00 -0.61 0.00 0.00 39.78 35.06 1ici n ASN 40 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1ici n ARG 41 N -4.84 3.57 -4.43 3.52 1.85 -1.26 -4.88 116.66 110.19 1ici n ARG 41 Ca -0.03 -0.09 -0.29 0.00 -1.00 0.00 0.00 57.85 56.43 1ici n ARG 41 Cb 0.57 -0.49 -0.12 0.00 -1.05 0.00 0.00 32.46 31.37 1ici n ARG 41 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1ici s TYR 42 N -0.54 2.43 0.41 2.89 1.51 -1.26 -4.99 117.35 117.80 1ici s TYR 42 Ca 0.00 -0.32 -0.23 0.00 -1.01 0.00 0.00 57.07 55.51 1ici s TYR 42 Cb 0.00 -1.33 -0.10 0.00 -0.11 0.00 0.00 41.96 40.43 1ici s TYR 42 CO 0.00 0.33 1.00 1.03 -1.11 0.00 0.00 175.55 176.80 1ici s ARG 43 N -1.95 4.19 0.27 -0.62 0.52 -1.25 -0.23 118.95 119.89 1ici s ARG 43 Ca 0.16 1.35 0.00 0.00 -0.52 0.00 0.00 55.73 56.72 1ici s ARG 43 Cb -0.10 -2.42 0.61 0.00 0.52 0.00 0.00 34.95 33.56 1ici s ARG 43 CO 0.07 -0.09 1.71 -1.35 0.02 0.00 0.00 175.30 175.66 1ici h PRO 44 N 2.30 0.40 -0.01 3.54 0.11 -1.82 -0.57 132.00 135.94 1ici h PRO 44 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1ici h PRO 44 Cb 1.20 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1ici h PRO 44 CO 0.62 0.26 0.29 1.05 -0.21 0.00 0.00 178.00 180.01 1ici h GLU 45 N 0.41 0.00 0.00 1.05 4.11 -1.91 0.44 114.58 118.68 1ici h GLU 45 Ca 0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.93 1ici h GLU 45 Cb 0.88 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1ici h GLU 45 CO -0.49 0.00 0.00 0.93 0.07 0.00 0.00 179.01 179.52 1ici h GLU 46 N 0.00 0.00 0.00 1.06 5.08 -1.46 -3.34 114.58 115.91 1ici h GLU 46 Ca 0.01 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.16 1ici h GLU 46 Cb 0.58 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.80 1ici h GLU 46 CO -0.00 0.00 -1.79 1.28 -1.00 0.00 0.00 179.01 177.50 1ici n LEU 47 N -2.47 2.30 -3.72 1.33 4.77 0.06 -4.67 117.00 114.60 1ici n LEU 47 Ca 0.05 -0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.55 1ici n LEU 47 Cb 0.43 -0.32 -0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1ici n LEU 47 CO 0.30 0.63 2.45 0.00 -1.33 0.00 0.00 177.39 179.45 1ici n ALA 48 N -2.80 5.78 -3.41 -1.18 0.00 -0.67 -4.55 120.51 113.70 1ici n ALA 48 Ca -0.23 -4.03 -0.13 0.00 0.00 0.00 0.00 53.44 49.05 1ici n ALA 48 Cb 0.79 -3.25 -0.10 0.00 0.00 0.00 0.00 19.45 16.89 1ici n ALA 48 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1ici s ASN 49 N 1.95 -0.49 0.24 0.00 3.84 -1.26 -3.45 114.94 115.78 1ici s ASN 49 Ca 0.47 0.92 -0.05 0.00 0.21 0.00 0.00 52.86 54.41 1ici s ASN 49 Cb 0.13 0.91 0.25 0.00 -0.55 0.00 0.00 41.25 41.99 1ici s ASN 49 CO -0.05 -0.16 1.79 1.55 -2.79 0.00 0.00 177.10 177.43 1ici h PRO 50 N 5.72 1.05 0.05 0.43 0.13 -1.88 -0.84 132.00 136.65 1ici h PRO 50 Ca -0.29 -0.21 -0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1ici h PRO 50 Cb 1.18 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 32.15 1ici h PRO 50 CO 0.23 0.89 -0.02 1.96 -0.23 0.00 0.00 178.00 180.83 1ici h GLN 51 N 1.01 -0.06 -0.84 0.86 7.50 -1.96 0.20 115.11 121.82 1ici h GLN 51 Ca 0.22 0.00 0.04 0.00 0.50 0.00 0.00 58.65 59.42 1ici h GLN 51 Cb 0.28 0.01 -0.05 0.00 0.05 0.00 0.00 27.48 27.77 1ici h GLN 51 CO -0.01 0.02 0.53 0.00 -1.50 0.00 0.00 178.83 177.87 1ici h ALA 52 N 0.82 1.11 -0.54 3.87 0.00 -1.80 0.13 119.26 122.85 1ici h ALA 52 Ca -0.01 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1ici h ALA 52 Cb 0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1ici h ALA 52 CO 0.01 0.34 0.10 0.35 0.00 0.00 0.00 179.25 180.05 1ici h PHE 53 N 1.02 0.93 -0.56 0.00 3.57 -0.80 0.16 116.94 121.26 1ici h PHE 53 Ca 0.34 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.70 1ici h PHE 53 Cb 0.05 -0.26 -0.03 0.00 2.79 0.00 0.00 35.95 38.51 1ici h PHE 53 CO -0.03 0.82 0.29 0.00 -2.23 0.00 0.00 178.31 177.17 1ici h ALA 54 N 1.00 0.71 -0.27 2.41 0.00 0.09 -1.39 119.26 121.82 1ici h ALA 54 Ca 0.17 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1ici h ALA 54 Cb 0.38 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1ici h ALA 54 CO 0.01 0.25 -0.12 -0.22 0.00 0.00 0.00 179.25 179.17 1ici h LYS 55 N 0.75 0.56 -2.10 0.00 3.64 -0.50 -3.40 116.57 115.52 1ici h LYS 55 Ca 0.19 -0.24 -0.54 0.00 -1.27 0.00 0.00 60.65 58.80 1ici h LYS 55 Cb 0.07 -0.02 -0.36 0.00 -0.41 0.00 0.00 32.23 31.51 1ici h LYS 55 CO -0.03 0.80 -0.96 -3.47 -2.27 0.00 0.00 179.45 173.52 1ici n ASP 56 N -4.46 -0.66 -0.26 4.20 -0.08 0.02 -4.98 116.55 110.32 1ici n ASP 56 Ca -0.04 -2.51 0.16 0.00 -1.51 0.00 0.00 54.79 50.89 1ici n ASP 56 Cb 0.35 -0.31 0.45 0.00 2.34 0.00 0.00 41.12 43.94 1ici n ASP 56 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 1ici h PRO 57 N 5.16 0.52 -0.54 -0.67 0.11 -1.46 -1.94 132.00 133.18 1ici h PRO 57 Ca 0.20 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 66.17 1ici h PRO 57 Cb 0.92 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.90 1ici h PRO 57 CO 0.36 0.34 -0.06 1.49 -0.21 0.00 0.00 178.00 179.92 1ici h GLU 58 N 0.54 1.00 0.18 1.05 4.81 -1.94 -0.15 114.58 120.06 1ici h GLU 58 Ca 0.48 -0.35 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1ici h GLU 58 Cb 1.00 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.31 1ici h GLU 58 CO -0.21 1.03 -0.09 -0.22 -0.73 0.00 0.00 179.01 178.79 1ici h LYS 59 N 0.87 -0.23 -0.78 1.92 3.64 -1.76 0.68 116.57 120.90 1ici h LYS 59 Ca 0.15 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.60 1ici h LYS 59 Cb 0.62 0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 32.44 1ici h LYS 59 CO 0.04 0.13 0.51 0.28 -2.27 0.00 0.00 179.45 178.14 1ici h VAL 60 N -0.64 1.05 -0.06 2.00 2.07 -1.48 -0.85 116.25 118.34 1ici h VAL 60 Ca -0.02 -0.29 -0.14 0.00 0.82 0.00 0.00 66.70 67.06 1ici h VAL 60 Cb 0.47 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.34 1ici h VAL 60 CO 0.04 0.16 -0.60 -0.50 0.02 0.00 0.00 177.57 176.69 1ici h TRP 61 N 0.85 0.26 -0.53 1.57 -0.00 -0.93 -1.65 115.95 115.53 1ici h TRP 61 Ca 0.33 -0.10 -0.08 0.00 -0.00 0.00 0.00 58.89 59.04 1ici h TRP 61 Cb 0.22 -0.05 -0.02 0.00 -0.00 0.00 0.00 29.16 29.31 1ici h TRP 61 CO -0.00 0.75 0.01 0.87 -0.00 0.00 0.00 178.44 180.07 1ici h LYS 62 N 0.15 0.89 0.02 0.49 1.57 0.36 -0.09 116.57 119.96 1ici h LYS 62 Ca -0.01 -0.25 -0.00 0.00 -1.87 0.00 0.00 60.65 58.52 1ici h LYS 62 Cb 1.10 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.31 1ici h LYS 62 CO 0.09 0.88 -0.01 2.35 -0.57 0.00 0.00 179.45 182.20 1ici h TRP 63 N 0.83 -0.02 -0.20 -1.35 7.01 -0.92 -2.48 115.95 118.82 1ici h TRP 63 Ca 0.16 -0.00 -0.06 0.00 2.11 0.00 0.00 58.89 61.10 1ici h TRP 63 Cb 0.48 0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.54 1ici h TRP 63 CO 0.03 0.31 -0.12 1.88 -2.79 0.00 0.00 178.44 177.74 1ici h TYR 64 N -0.36 0.34 -0.25 2.65 -1.99 -1.21 -0.08 116.97 116.07 1ici h TYR 64 Ca -0.00 -0.04 -0.13 0.00 2.00 0.00 0.00 58.73 60.56 1ici h TYR 64 Cb 0.34 -0.09 -0.01 0.00 2.00 0.00 0.00 36.73 38.97 1ici h TYR 64 CO 0.04 0.44 -0.37 0.00 -0.00 0.00 0.00 178.16 178.27 1ici h ALA 65 N 1.57 0.89 -0.11 3.88 0.00 -0.98 0.26 119.26 124.77 1ici h ALA 65 Ca 0.06 -0.42 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1ici h ALA 65 Cb 0.41 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ici h ALA 65 CO 0.02 0.63 0.01 2.35 0.00 0.00 0.00 179.25 182.27 1ici h TRP 66 N 0.47 0.20 -0.34 0.00 7.01 -0.93 -1.02 115.95 121.34 1ici h TRP 66 Ca 0.05 -0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.02 1ici h TRP 66 Cb 0.85 -0.05 -0.02 0.00 -2.10 0.00 0.00 29.16 27.84 1ici h TRP 66 CO 0.03 0.40 0.21 0.00 -2.79 0.00 0.00 178.44 176.29 1ici h ARG 67 N -0.05 0.46 0.06 2.65 3.08 -0.75 -2.58 114.38 117.24 1ici h ARG 67 Ca 0.03 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.07 1ici h ARG 67 Cb 0.31 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.22 1ici h ARG 67 CO 0.00 0.34 -0.27 0.52 -1.07 0.00 0.00 179.97 179.49 1ici h MET 68 N 0.45 -0.43 -0.73 0.04 2.86 -0.39 0.20 114.93 116.93 1ici h MET 68 Ca 0.12 0.03 0.08 0.00 -2.06 0.00 0.00 59.70 57.87 1ici h MET 68 Cb -0.00 0.10 -0.07 0.00 0.06 0.00 0.00 31.60 31.69 1ici h MET 68 CO -0.02 -0.29 0.40 1.49 1.06 0.00 0.00 176.91 179.55 1ici h GLU 69 N -0.45 0.68 -0.60 1.72 4.81 -1.09 0.10 114.58 119.76 1ici h GLU 69 Ca 0.05 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.13 1ici h GLU 69 Cb 0.51 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 1ici h GLU 69 CO -0.20 0.45 -0.03 0.87 -0.73 0.00 0.00 179.01 179.37 1ici h LYS 70 N 0.70 1.07 0.05 1.92 1.57 -1.03 -1.99 116.57 118.86 1ici h LYS 70 Ca 0.35 -0.36 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1ici h LYS 70 Cb 0.29 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1ici h LYS 70 CO -0.23 1.06 -0.02 0.28 -0.57 0.00 0.00 179.45 179.97 1ici h VAL 71 N 0.97 1.14 -0.38 0.50 2.07 -0.23 -1.37 116.25 118.95 1ici h VAL 71 Ca 0.17 -0.63 0.11 0.00 0.82 0.00 0.00 66.70 67.16 1ici h VAL 71 Cb 0.59 1.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 1ici h VAL 71 CO 0.04 0.16 0.27 -0.26 0.02 0.00 0.00 177.57 177.80 1ici h PHE 72 N -0.35 0.01 -0.01 1.57 0.05 -0.78 -0.15 116.94 117.29 1ici h PHE 72 Ca -0.01 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.78 1ici h PHE 72 Cb 0.31 -0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.26 1ici h PHE 72 CO 0.02 0.01 -0.46 0.09 -0.18 0.00 0.00 178.31 177.78 1ici n ASN 73 N -4.43 1.12 -4.88 2.17 3.02 -0.75 -4.93 115.26 106.58 1ici n ASN 73 Ca 0.06 -0.90 -0.30 0.00 -0.03 0.00 0.00 54.58 53.41 1ici n ASN 73 Cb 0.45 0.35 0.06 0.00 -0.61 0.00 0.00 39.78 40.03 1ici n ASN 73 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ici s ALA 74 N -2.68 2.80 0.07 5.41 0.00 -0.07 -5.07 121.76 122.22 1ici s ALA 74 Ca 0.18 -0.37 0.09 0.00 0.00 0.00 0.00 51.96 51.85 1ici s ALA 74 Cb 0.18 -3.02 -0.03 0.00 0.00 0.00 0.00 23.12 20.25 1ici s ALA 74 CO 0.62 -1.27 -0.24 -0.65 0.00 0.00 0.00 175.76 174.23 1ici s GLN 75 N -5.37 1.48 0.38 0.00 -1.52 -1.26 -5.01 119.66 108.36 1ici s GLN 75 Ca 0.59 -1.10 -0.28 0.00 -1.95 0.00 0.00 55.36 52.62 1ici s GLN 75 Cb -0.11 -1.70 -0.11 0.00 -0.22 0.00 0.00 33.01 30.86 1ici s GLN 75 CO 0.52 0.43 1.46 -2.30 -0.25 0.00 0.00 175.29 175.14 1ici n PRO 76 N 1.55 2.59 -1.59 2.91 -0.02 -1.26 -4.61 135.00 134.56 1ici n PRO 76 Ca -0.18 0.91 -0.09 0.00 -2.02 0.00 0.00 63.50 62.13 1ici n PRO 76 Cb 0.53 -2.62 0.04 0.00 -0.02 0.00 0.00 33.50 31.42 1ici n PRO 76 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 1ici n ASN 77 N 0.47 0.69 -0.03 2.55 0.23 -1.26 -4.87 115.26 113.04 1ici n ASN 77 Ca 0.02 -1.54 0.12 0.00 -0.53 0.00 0.00 54.58 52.64 1ici n ASN 77 Cb 0.39 -0.23 0.53 0.00 -2.08 0.00 0.00 39.78 38.39 1ici n ASN 77 CO 0.00 0.00 0.00 0.11 -0.93 0.00 0.00 177.26 176.44 1ici h LYS 78 N 0.00 0.33 0.08 -3.83 1.57 -1.91 -1.80 116.57 111.01 1ici h LYS 78 Ca -0.13 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1ici h LYS 78 Cb 0.51 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.75 1ici h LYS 78 CO 0.15 0.22 -0.04 0.00 -0.57 0.00 0.00 179.45 179.21 1ici h ALA 79 N 1.74 -0.10 -0.54 3.86 0.00 -1.77 0.79 119.26 123.22 1ici h ALA 79 Ca 0.23 -0.15 0.08 0.00 0.00 0.00 0.00 54.91 55.07 1ici h ALA 79 Cb 0.48 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.24 1ici h ALA 79 CO -0.06 -0.41 0.17 0.45 0.00 0.00 0.00 179.25 179.41 1ici h HIS 80 N -0.40 0.30 -0.52 0.00 3.86 -1.70 0.97 115.15 117.67 1ici h HIS 80 Ca -0.01 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 1ici h HIS 80 Cb 0.34 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.73 1ici h HIS 80 CO 0.02 0.07 0.15 1.96 0.86 0.00 0.00 177.93 180.99 1ici h GLN 81 N 0.34 0.82 -0.85 2.45 4.20 -1.28 -1.68 115.11 119.11 1ici h GLN 81 Ca 0.27 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.79 1ici h GLN 81 Cb 0.32 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.95 1ici h GLN 81 CO -0.29 0.76 0.52 0.00 -0.67 0.00 0.00 178.83 179.16 1ici h ALA 82 N 1.02 1.08 -0.51 3.87 0.00 0.01 0.13 119.26 124.87 1ici h ALA 82 Ca 0.17 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1ici h ALA 82 Cb 0.30 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1ici h ALA 82 CO -0.00 0.53 0.09 0.74 0.00 0.00 0.00 179.25 180.60 1ici h PHE 83 N 1.16 0.88 -0.39 0.00 -1.00 -0.56 -0.90 116.94 116.13 1ici h PHE 83 Ca 0.31 -0.12 0.01 0.00 2.81 0.00 0.00 57.97 60.98 1ici h PHE 83 Cb -0.07 -0.24 -0.02 0.00 3.61 0.00 0.00 35.95 39.23 1ici h PHE 83 CO -0.00 0.80 0.25 0.00 -1.61 0.00 0.00 178.31 177.74 1ici h ALA 84 N 0.98 0.50 -0.09 2.45 0.00 -0.78 -2.21 119.26 120.10 1ici h ALA 84 Ca 0.15 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.08 1ici h ALA 84 Cb 0.39 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1ici h ALA 84 CO 0.01 -0.07 -0.16 1.49 0.00 0.00 0.00 179.25 180.52 1ici h GLU 85 N 0.50 -0.20 -0.01 0.00 4.22 -0.42 0.67 114.58 119.34 1ici h GLU 85 Ca 0.15 0.01 0.00 0.00 0.08 0.00 0.00 59.36 59.61 1ici h GLU 85 Cb -0.03 0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 1ici h GLU 85 CO -0.05 -0.14 0.01 1.25 -2.18 0.00 0.00 179.01 177.90 1ici h LEU 86 N -0.21 0.00 0.12 1.64 5.85 -0.99 0.15 115.31 121.85 1ici h LEU 86 Ca 0.08 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.50 1ici h LEU 86 Cb 0.33 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.38 1ici h LEU 86 CO -0.22 0.00 -1.26 -0.08 -0.34 0.00 0.00 178.44 176.54 1ici h GLU 87 N 0.00 0.56 -0.80 1.25 4.81 -0.63 -1.57 114.58 118.20 1ici h GLU 87 Ca 0.00 -0.78 0.01 0.00 -0.13 0.00 0.00 59.36 58.46 1ici h GLU 87 Cb 0.02 0.26 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 1ici h GLU 87 CO -0.00 1.35 0.53 -0.09 -0.73 0.00 0.00 179.01 180.07 1ici h ARG 88 N 0.24 1.06 0.00 1.92 2.43 0.69 -0.92 114.38 119.79 1ici h ARG 88 Ca -0.19 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1ici h ARG 88 Cb 1.94 -0.24 0.00 0.00 -0.42 0.00 0.00 29.97 31.25 1ici h ARG 88 CO 0.24 0.70 0.00 1.28 -1.51 0.00 0.00 179.97 180.67 1ici n LEU 89 N -4.53 0.00 0.00 3.80 4.77 0.35 -4.85 117.00 116.55 1ici n LEU 89 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 1ici n LEU 89 Cb 0.01 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 1ici n LEU 89 CO 0.36 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1ici n GLY 90 N -0.09 0.86 0.07 -0.72 0.00 -0.35 -4.88 105.19 100.08 1ici n GLY 90 Ca 0.10 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.01 1ici n GLY 90 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ici h VAL 91 N 0.00 1.47 -3.08 1.61 2.07 -1.65 -3.44 116.25 113.24 1ici h VAL 91 Ca 0.00 -2.08 -0.58 0.00 0.82 0.00 0.00 66.70 64.86 1ici h VAL 91 Cb 0.00 2.77 -0.06 0.00 -1.52 0.00 0.00 31.29 32.48 1ici h VAL 91 CO 0.00 0.49 0.84 -0.22 0.02 0.00 0.00 177.57 178.70 1ici s LEU 92 N -8.30 4.08 -0.01 2.57 2.96 -0.64 -3.84 118.68 115.50 1ici s LEU 92 Ca -0.16 1.39 0.07 0.00 -0.22 0.00 0.00 54.13 55.22 1ici s LEU 92 Cb -0.02 -3.54 -0.24 0.00 0.50 0.00 0.00 46.19 42.89 1ici s LEU 92 CO 0.57 -0.74 0.79 0.11 -1.32 0.00 0.00 176.35 175.76 1ici h LYS 93 N 7.80 0.07 -1.80 1.98 1.79 -0.90 -3.40 116.57 122.11 1ici h LYS 93 Ca -0.21 -0.12 0.01 0.00 -2.18 0.00 0.00 60.65 58.14 1ici h LYS 93 Cb 1.07 0.05 -0.23 0.00 -1.58 0.00 0.00 32.23 31.54 1ici h LYS 93 CO 0.99 0.77 0.31 0.00 -1.08 0.00 0.00 179.45 180.45 1ici s LEU 95 N -0.25 2.33 -0.20 0.00 1.98 -0.23 -1.88 118.68 120.43 1ici s LEU 95 Ca -0.02 -0.63 -0.08 0.00 -2.89 0.00 0.00 54.13 50.51 1ici s LEU 95 Cb -0.03 -1.53 -0.04 0.00 0.66 0.00 0.00 46.19 45.24 1ici s LEU 95 CO 0.01 -0.01 0.08 -0.63 -1.89 0.00 0.00 176.35 173.91 1ici s ILE 96 N 1.32 4.89 0.06 6.68 1.01 0.51 -0.43 121.20 135.24 1ici s ILE 96 Ca 0.05 0.01 0.06 0.00 0.00 0.00 0.00 60.65 60.76 1ici s ILE 96 Cb -0.14 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.08 1ici s ILE 96 CO -0.11 0.43 -0.15 0.28 0.00 0.00 0.00 174.94 175.39 1ici s THR 97 N 0.59 1.21 -0.74 2.92 -1.32 -0.24 -1.30 115.64 116.76 1ici s THR 97 Ca 0.04 -1.23 0.22 0.00 -1.21 0.00 0.00 61.69 59.52 1ici s THR 97 Cb -0.13 -1.13 -0.16 0.00 -1.51 0.00 0.00 72.50 69.58 1ici s THR 97 CO 0.01 -0.11 0.99 0.00 -2.21 0.00 0.00 174.62 173.29 1ici n GLN 98 N 1.48 0.19 -2.19 7.08 6.02 -0.51 -1.51 117.38 127.94 1ici n GLN 98 Ca -0.20 -0.02 -0.37 0.00 -0.01 0.00 0.00 57.00 56.40 1ici n GLN 98 Cb 0.54 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.26 1ici n GLN 98 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 1ici s ASN 99 N -3.55 5.93 0.00 1.08 0.01 -1.26 -4.46 114.94 112.70 1ici s ASN 99 Ca 0.05 2.34 0.19 0.00 -0.71 0.00 0.00 52.86 54.73 1ici s ASN 99 Cb 0.15 -2.60 0.28 0.00 0.41 0.00 0.00 41.25 39.49 1ici s ASN 99 CO 0.82 -1.08 1.23 1.33 -1.51 0.00 0.00 177.10 177.88 1ici n VAL 100 N -0.75 0.34 -2.11 1.60 0.24 -1.26 -4.78 118.33 111.61 1ici n VAL 100 Ca 0.09 -0.67 -0.27 0.00 -2.04 0.00 0.00 64.34 61.45 1ici n VAL 100 Cb 0.48 1.10 0.07 0.00 -1.47 0.00 0.00 33.84 34.02 1ici n VAL 100 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1ici s ASP 101 N -1.41 4.81 -0.27 -1.34 1.47 -1.26 -0.36 116.67 118.31 1ici s ASP 101 Ca 0.29 0.60 0.10 0.00 1.18 0.00 0.00 52.55 54.72 1ici s ASP 101 Cb 0.18 -1.24 0.51 0.00 -0.34 0.00 0.00 42.92 42.03 1ici s ASP 101 CO 0.25 -1.64 1.45 -0.90 0.68 0.00 0.00 175.17 175.02 1ici n ASP 102 N -3.02 2.70 0.20 2.11 5.75 -1.26 -4.73 116.55 118.30 1ici n ASP 102 Ca 0.08 -3.63 0.06 0.00 -0.01 0.00 0.00 54.79 51.29 1ici n ASP 102 Cb 0.60 -0.62 0.39 0.00 -1.03 0.00 0.00 41.12 40.47 1ici n ASP 102 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1ici h LEU 103 N 1.10 0.00 -0.25 -2.12 3.38 -1.94 -1.71 115.31 113.78 1ici h LEU 103 Ca 0.18 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.03 1ici h LEU 103 Cb 1.62 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.36 1ici h LEU 103 CO 0.36 0.33 -0.31 0.45 0.09 0.00 0.00 178.44 179.36 1ici h HIS 104 N 0.00 0.79 0.30 1.13 3.86 -1.92 -1.90 115.15 117.40 1ici h HIS 104 Ca -0.00 -0.25 -0.01 0.00 -1.16 0.00 0.00 60.37 58.94 1ici h HIS 104 Cb 0.80 -0.16 0.00 0.00 1.06 0.00 0.00 27.41 29.11 1ici h HIS 104 CO 0.00 0.99 -0.14 0.93 0.86 0.00 0.00 177.93 180.57 1ici h GLU 105 N 0.37 -0.38 0.00 2.45 3.07 -1.73 -0.56 114.58 117.79 1ici h GLU 105 Ca 0.03 0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.92 1ici h GLU 105 Cb 0.88 0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.88 1ici h GLU 105 CO 0.07 -0.18 0.00 0.00 -1.40 0.00 0.00 179.01 177.51 1ici h ARG 106 N -0.52 0.00 0.00 2.33 3.08 -1.31 0.31 114.38 118.28 1ici h ARG 106 Ca -0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1ici h ARG 106 Cb 0.39 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1ici h ARG 106 CO 0.07 0.00 -0.08 0.00 -1.07 0.00 0.00 179.97 178.88 1ici h ALA 107 N 2.01 0.95 0.00 0.04 0.00 -1.03 -3.47 119.26 117.76 1ici h ALA 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ici h ALA 107 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1ici h ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.66 1ici n GLY 108 N 1.22 0.92 3.69 0.00 0.00 0.11 -4.82 105.19 106.32 1ici n GLY 108 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1ici n GLY 108 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ici s SER 109 N -0.93 6.68 -0.16 1.61 0.01 -0.25 -4.91 113.70 115.75 1ici s SER 109 Ca 0.00 2.39 -0.20 0.00 1.31 0.00 0.00 55.95 59.45 1ici s SER 109 Cb 0.00 -2.57 -0.23 0.00 0.21 0.00 0.00 66.02 63.43 1ici s SER 109 CO 0.00 -0.82 0.40 0.03 0.41 0.00 0.00 173.24 173.26 1ici h ARG 110 N 7.90 0.09 -4.11 12.44 3.08 -1.90 -3.39 114.38 128.48 1ici h ARG 110 Ca -0.41 -0.15 -0.77 0.00 0.07 0.00 0.00 59.98 58.72 1ici h ARG 110 Cb 1.20 0.06 -0.24 0.00 0.08 0.00 0.00 29.97 31.07 1ici h ARG 110 CO 0.92 1.07 0.56 1.21 -1.07 0.00 0.00 179.97 182.66 1ici s ASN 111 N -6.83 6.98 -0.08 7.04 2.47 -1.26 -5.01 114.94 118.25 1ici s ASN 111 Ca -0.24 -2.93 0.04 0.00 0.42 0.00 0.00 52.86 50.15 1ici s ASN 111 Cb 0.04 -2.28 -0.00 0.00 -1.45 0.00 0.00 41.25 37.56 1ici s ASN 111 CO 0.67 -0.59 -0.23 -0.69 -3.72 0.00 0.00 177.10 172.53 1ici s VAL 112 N 0.38 1.95 -0.23 -5.21 1.01 -1.26 -1.07 120.40 115.98 1ici s VAL 112 Ca 0.29 -0.97 -0.06 0.00 0.00 0.00 0.00 61.98 61.24 1ici s VAL 112 Cb -0.08 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.60 1ici s VAL 112 CO -0.07 0.54 0.01 -0.63 0.00 0.00 0.00 175.10 174.95 1ici s ILE 113 N 0.23 3.88 -0.83 2.22 1.01 0.43 -4.99 121.20 123.16 1ici s ILE 113 Ca -0.14 -0.32 -0.18 0.00 0.00 0.00 0.00 60.65 60.00 1ici s ILE 113 Cb -0.16 -2.79 0.14 0.00 0.01 0.00 0.00 42.46 39.66 1ici s ILE 113 CO 0.07 0.39 0.97 -1.00 0.00 0.00 0.00 174.94 175.37 1ici s HIS 114 N 1.44 3.17 0.39 3.97 3.76 -1.26 -1.08 115.29 125.68 1ici s HIS 114 Ca 0.05 -1.34 0.07 0.00 -0.15 0.00 0.00 55.06 53.69 1ici s HIS 114 Cb -0.15 -4.15 0.82 0.00 1.11 0.00 0.00 32.58 30.21 1ici s HIS 114 CO 0.01 -1.38 2.00 1.25 -0.85 0.00 0.00 174.74 175.77 1ici h LEU 115 N 9.95 0.55 -3.24 0.89 5.85 -1.60 -2.75 115.31 124.96 1ici h LEU 115 Ca 0.02 -0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.62 1ici h LEU 115 Cb 1.04 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 41.88 1ici h LEU 115 CO 1.05 0.37 -0.21 1.41 -0.34 0.00 0.00 178.44 180.72 1ici n HIS 116 N -4.47 0.74 -4.10 1.25 8.25 -1.26 -4.80 115.22 110.84 1ici n HIS 116 Ca 0.08 -1.56 0.00 0.00 -0.26 0.00 0.00 57.72 55.98 1ici n HIS 116 Cb 0.18 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 30.88 1ici n HIS 116 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ici n GLY 117 N -1.12 -1.51 3.34 -1.41 0.00 -1.04 -1.46 105.19 102.00 1ici n GLY 117 Ca 0.29 -1.30 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 1ici n GLY 117 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1ici s SER 118 N -4.00 -0.40 0.41 1.61 0.15 -0.28 -4.39 113.70 106.80 1ici s SER 118 Ca 0.00 0.56 0.29 0.00 0.70 0.00 0.00 55.95 57.50 1ici s SER 118 Cb 0.00 0.62 1.22 0.00 -1.71 0.00 0.00 66.02 66.15 1ici s SER 118 CO 0.00 -0.36 1.86 -0.07 1.20 0.00 0.00 173.24 175.87 1ici h LEU 119 N 4.36 0.00 -0.78 3.45 3.38 -0.99 -2.45 115.31 122.29 1ici h LEU 119 Ca -0.28 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.64 1ici h LEU 119 Cb 1.17 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 1ici h LEU 119 CO 0.32 0.00 -0.21 0.03 0.09 0.00 0.00 178.44 178.67 1ici h ARG 120 N 0.00 0.00 -5.79 1.13 2.47 -1.91 -3.45 114.38 106.84 1ici h ARG 120 Ca 0.00 0.00 -0.62 0.00 -1.26 0.00 0.00 59.98 58.10 1ici h ARG 120 Cb 0.40 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.65 1ici h ARG 120 CO 0.00 0.21 -0.31 0.08 0.56 0.00 0.00 179.97 180.51 1ici s VAL 121 N -3.46 5.23 -0.09 2.04 1.01 -0.92 -0.82 120.40 123.40 1ici s VAL 121 Ca 0.02 0.60 0.03 0.00 0.00 0.00 0.00 61.98 62.63 1ici s VAL 121 Cb 0.09 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.87 1ici s VAL 121 CO 0.65 0.55 -0.17 -0.69 0.00 0.00 0.00 175.10 175.43 1ici s VAL 122 N -0.71 1.56 0.10 2.92 1.01 0.20 0.05 120.40 125.53 1ici s VAL 122 Ca 0.20 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.48 1ici s VAL 122 Cb -0.14 -1.39 -0.04 0.00 0.00 0.00 0.00 36.38 34.81 1ici s VAL 122 CO 0.09 0.45 -0.07 0.00 0.00 0.00 0.00 175.10 175.57 1ici s ARG 123 N 0.60 0.84 0.36 2.72 1.70 -0.25 -1.50 118.95 123.42 1ici s ARG 123 Ca -0.15 -1.33 -0.25 0.00 -0.47 0.00 0.00 55.73 53.53 1ici s ARG 123 Cb -0.16 -0.23 -0.10 0.00 -0.57 0.00 0.00 34.95 33.89 1ici s ARG 123 CO 0.05 -0.01 0.98 0.00 -1.08 0.00 0.00 175.30 175.23 1ici n THR 125 N 0.24 0.56 -0.03 0.00 -2.24 -0.23 -4.46 114.28 108.12 1ici n THR 125 Ca 0.03 -0.25 -0.08 0.00 -2.27 0.00 0.00 64.05 61.48 1ici n THR 125 Cb 0.50 -0.59 -0.03 0.00 -2.10 0.00 0.00 70.33 68.11 1ici n THR 125 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1ici n SER 126 N -2.21 0.64 -3.56 3.42 2.88 -1.26 -5.04 113.62 108.49 1ici n SER 126 Ca 0.06 0.11 -0.12 0.00 -1.33 0.00 0.00 58.87 57.58 1ici n SER 126 Cb 0.42 -0.26 0.02 0.00 -0.75 0.00 0.00 64.21 63.64 1ici n SER 126 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ici n ASN 128 N -2.34 1.20 -4.63 0.00 3.02 -1.26 -4.42 115.26 106.82 1ici n ASN 128 Ca 0.05 -1.59 -0.49 0.00 -0.03 0.00 0.00 54.58 52.52 1ici n ASN 128 Cb 0.33 -0.07 -0.05 0.00 -0.61 0.00 0.00 39.78 39.38 1ici n ASN 128 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1ici n ASN 129 N 0.00 2.45 -3.76 6.41 5.15 -1.26 -4.85 115.26 119.40 1ici n ASN 129 Ca 0.16 1.10 -0.13 0.00 -0.60 0.00 0.00 54.58 55.11 1ici n ASN 129 Cb 0.26 -1.32 -0.10 0.00 -0.53 0.00 0.00 39.78 38.08 1ici n ASN 129 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1ici s SER 130 N 0.70 -0.30 0.18 1.20 0.15 -1.26 -1.41 113.70 112.96 1ici s SER 130 Ca 0.81 0.54 -0.23 0.00 0.70 0.00 0.00 55.95 57.76 1ici s SER 130 Cb -0.80 0.59 0.06 0.00 -1.71 0.00 0.00 66.02 64.16 1ici s SER 130 CO 0.42 -0.17 0.69 0.72 1.20 0.00 0.00 173.24 176.10 1ici s PHE 131 N -0.11 -0.38 0.03 3.44 -0.12 -0.56 -5.02 117.98 115.26 1ici s PHE 131 Ca -0.03 0.09 -0.00 0.00 -0.05 0.00 0.00 56.93 56.94 1ici s PHE 131 Cb -0.03 0.61 -0.04 0.00 -0.63 0.00 0.00 43.02 42.93 1ici s PHE 131 CO 0.01 -0.95 0.13 -1.21 -0.05 0.00 0.00 175.22 173.15 1ici s GLU 132 N -3.72 3.18 0.09 1.99 2.02 -1.26 -0.63 118.70 120.38 1ici s GLU 132 Ca 0.05 -0.49 0.07 0.00 0.02 0.00 0.00 54.97 54.63 1ici s GLU 132 Cb -0.03 -2.92 -0.04 0.00 0.10 0.00 0.00 34.13 31.25 1ici s GLU 132 CO -0.05 0.63 -0.13 0.14 0.02 0.00 0.00 175.26 175.87 1ici s VAL 133 N -1.34 3.19 -0.17 2.63 -7.23 0.00 -4.95 120.40 112.54 1ici s VAL 133 Ca 0.28 -1.29 0.18 0.00 -1.81 0.00 0.00 61.98 59.34 1ici s VAL 133 Cb -0.12 -2.46 -0.05 0.00 0.56 0.00 0.00 36.38 34.30 1ici s VAL 133 CO 0.20 0.15 1.00 -0.33 -0.31 0.00 0.00 175.10 175.81 1ici h GLU 134 N 3.79 0.00 -3.98 4.82 5.08 -1.99 -3.47 114.58 118.83 1ici h GLU 134 Ca -0.49 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.75 1ici h GLU 134 Cb 1.17 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.29 1ici h GLU 134 CO 0.50 0.24 -0.38 -1.54 -1.00 0.00 0.00 179.01 176.84 1ici s SER 135 N -5.80 0.09 0.36 1.42 1.04 -1.26 -5.04 113.70 104.51 1ici s SER 135 Ca -0.01 -0.92 -0.27 0.00 0.48 0.00 0.00 55.95 55.23 1ici s SER 135 Cb 0.09 0.41 -0.09 0.00 0.10 0.00 0.00 66.02 66.53 1ici s SER 135 CO 0.79 -0.86 1.22 0.00 0.98 0.00 0.00 173.24 175.36 1ici s ALA 136 N -3.98 3.30 0.36 5.32 0.00 -1.26 -5.00 121.76 120.50 1ici s ALA 136 Ca 0.18 1.08 -0.23 0.00 0.00 0.00 0.00 51.96 53.00 1ici s ALA 136 Cb 0.04 -3.42 -0.10 0.00 0.00 0.00 0.00 23.12 19.64 1ici s ALA 136 CO 0.00 -0.55 0.92 -1.25 0.00 0.00 0.00 175.76 174.88 1ici s PRO 137 N -2.02 4.36 -0.20 0.00 0.04 -1.26 -5.01 135.00 130.91 1ici s PRO 137 Ca 0.53 1.15 -0.28 0.00 0.04 0.00 0.00 61.00 62.44 1ici s PRO 137 Cb -0.35 -2.51 -0.00 0.00 0.04 0.00 0.00 34.50 31.69 1ici s PRO 137 CO 0.45 0.14 0.97 0.21 0.04 0.00 0.00 177.00 178.81 1ici s LYS 138 N -2.61 4.28 -0.12 4.56 2.20 -1.26 -4.88 119.74 121.91 1ici s LYS 138 Ca 0.55 1.25 0.01 0.00 -0.36 0.00 0.00 55.97 57.41 1ici s LYS 138 Cb -0.14 -3.61 0.14 0.00 -1.51 0.00 0.00 37.83 32.71 1ici s LYS 138 CO 0.18 -0.51 1.42 -0.89 -0.36 0.00 0.00 175.35 175.20 1ici n ILE 139 N 5.08 1.74 -0.05 5.43 2.08 -1.26 -4.04 119.36 128.32 1ici n ILE 139 Ca 0.09 -0.60 -0.14 0.00 0.56 0.00 0.00 62.75 62.66 1ici n ILE 139 Cb 0.47 -1.02 -0.07 0.00 -0.75 0.00 0.00 39.64 38.27 1ici n ILE 139 CO 0.00 0.00 0.00 -0.65 0.56 0.00 0.00 176.55 176.46 1ici h PRO 140 N 0.50 0.43 -5.97 0.38 0.11 -2.01 -3.43 132.00 122.01 1ici h PRO 140 Ca 0.14 -0.26 -0.67 0.00 0.11 0.00 0.00 66.00 65.32 1ici h PRO 140 Cb 1.30 0.02 -0.13 0.00 0.11 0.00 0.00 31.00 32.31 1ici h PRO 140 CO 0.28 0.85 -0.60 -1.25 -0.21 0.00 0.00 178.00 177.07 1ici s PRO 141 N -4.12 3.02 0.25 1.05 0.04 -1.26 -5.08 135.00 128.90 1ici s PRO 141 Ca -0.14 -0.42 -0.30 0.00 0.04 0.00 0.00 61.00 60.19 1ici s PRO 141 Cb 0.05 -2.83 -0.09 0.00 0.04 0.00 0.00 34.50 31.67 1ici s PRO 141 CO 0.78 0.69 1.29 -0.51 0.04 0.00 0.00 177.00 179.29 1ici s LEU 142 N -1.15 4.43 0.21 -3.56 1.43 -1.26 -4.92 118.68 113.86 1ici s LEU 142 Ca 0.16 2.48 -0.30 0.00 -1.03 0.00 0.00 54.13 55.43 1ici s LEU 142 Cb -0.12 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.39 1ici s LEU 142 CO 0.06 -0.49 1.43 -2.84 0.23 0.00 0.00 176.35 174.73 1ici s PRO 143 N -0.75 4.29 -0.02 1.29 0.02 -1.26 -4.98 135.00 133.60 1ici s PRO 143 Ca 0.53 2.23 0.07 0.00 0.02 0.00 0.00 61.00 63.85 1ici s PRO 143 Cb -0.37 -3.15 -0.02 0.00 0.02 0.00 0.00 34.50 30.98 1ici s PRO 143 CO 0.43 -0.42 -0.22 0.15 -0.33 0.00 0.00 177.00 176.61 1ici s LYS 144 N 0.12 1.77 0.17 5.54 -0.14 -1.26 -1.57 119.74 124.37 1ici s LYS 144 Ca 0.61 -0.79 -0.32 0.00 -1.36 0.00 0.00 55.97 54.12 1ici s LYS 144 Cb -0.40 -1.71 -0.11 0.00 -1.68 0.00 0.00 37.83 33.93 1ici s LYS 144 CO 0.39 0.47 1.65 0.00 -0.76 0.00 0.00 175.35 177.09 1ici n ASP 146 N 4.17 0.54 -0.09 0.00 3.85 -1.26 -0.96 116.55 122.80 1ici n ASP 146 Ca 0.15 -1.77 -0.16 0.00 -0.71 0.00 0.00 54.79 52.31 1ici n ASP 146 Cb 0.37 -0.05 -0.08 0.00 -1.35 0.00 0.00 41.12 40.01 1ici n ASP 146 CO 0.00 0.00 0.00 0.29 -1.01 0.00 0.00 177.20 176.48 1ici n LYS 147 N -0.31 0.43 0.00 0.11 4.76 -1.26 -4.80 118.16 117.09 1ici n LYS 147 Ca 0.09 0.13 0.00 0.00 -2.87 0.00 0.00 58.31 55.66 1ici n LYS 147 Cb 0.12 -1.28 0.00 0.00 -1.84 0.00 0.00 35.03 32.02 1ici n LYS 147 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ici n GLY 149 N -0.11 1.15 3.85 0.00 0.00 -0.13 -4.99 105.19 104.96 1ici n GLY 149 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1ici n GLY 149 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ici s SER 150 N -2.91 3.03 0.16 1.61 0.01 -1.26 -4.41 113.70 109.93 1ici s SER 150 Ca 0.00 0.49 -0.30 0.00 1.31 0.00 0.00 55.95 57.45 1ici s SER 150 Cb 0.00 -0.71 -0.08 0.00 0.21 0.00 0.00 66.02 65.44 1ici s SER 150 CO 0.00 -2.80 1.27 -0.22 0.41 0.00 0.00 173.24 171.90 1ici s LEU 151 N -6.03 4.41 0.48 2.44 2.96 -1.26 0.63 118.68 122.31 1ici s LEU 151 Ca 0.70 2.28 -0.03 0.00 -0.22 0.00 0.00 54.13 56.87 1ici s LEU 151 Cb -0.07 -3.60 -0.02 0.00 0.50 0.00 0.00 46.19 43.00 1ici s LEU 151 CO 0.53 -0.49 0.75 -0.76 -1.32 0.00 0.00 176.35 175.05 1ici s LEU 152 N 0.22 3.60 0.14 -0.68 1.43 -0.61 -1.07 118.68 121.72 1ici s LEU 152 Ca 0.57 0.64 -0.07 0.00 -1.03 0.00 0.00 54.13 54.24 1ici s LEU 152 Cb -0.34 -3.53 -0.01 0.00 0.03 0.00 0.00 46.19 42.33 1ici s LEU 152 CO 0.35 -0.68 0.22 0.00 0.23 0.00 0.00 176.35 176.47 1ici s ARG 153 N -4.69 1.04 0.40 1.70 1.70 0.11 -4.81 118.95 114.41 1ici s ARG 153 Ca 0.48 -1.17 -0.27 0.00 -0.47 0.00 0.00 55.73 54.30 1ici s ARG 153 Cb -0.10 0.34 -0.09 0.00 -0.57 0.00 0.00 34.95 34.53 1ici s ARG 153 CO 0.42 -0.36 1.39 -2.14 -1.08 0.00 0.00 175.30 173.53 1ici s PRO 154 N -3.96 4.01 -0.13 3.89 0.02 -1.26 -1.09 135.00 136.48 1ici s PRO 154 Ca 0.15 2.35 -0.05 0.00 0.02 0.00 0.00 61.00 63.48 1ici s PRO 154 Cb 0.04 -2.85 -0.15 0.00 0.02 0.00 0.00 34.50 31.57 1ici s PRO 154 CO -0.02 -0.53 3.22 0.41 -0.33 0.00 0.00 177.00 179.75 1ici n GLY 155 N 0.61 3.34 3.63 0.52 0.00 0.11 -4.69 105.19 108.70 1ici n GLY 155 Ca 0.03 -1.28 -0.24 0.00 0.00 0.00 0.00 46.02 44.53 1ici n GLY 155 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ici s VAL 156 N -0.02 2.69 -0.27 1.61 -7.23 -1.26 -1.12 120.40 114.80 1ici s VAL 156 Ca 0.58 -1.98 -0.14 0.00 -1.81 0.00 0.00 61.98 58.63 1ici s VAL 156 Cb 0.31 -2.78 -0.04 0.00 0.56 0.00 0.00 36.38 34.43 1ici s VAL 156 CO -0.06 -0.22 0.32 -0.69 -0.31 0.00 0.00 175.10 174.15 1ici s VAL 157 N -2.50 5.21 0.48 1.32 1.01 -0.53 -4.90 120.40 120.48 1ici s VAL 157 Ca 0.34 0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.83 1ici s VAL 157 Cb -0.01 -3.65 0.02 0.00 0.00 0.00 0.00 36.38 32.74 1ici s VAL 157 CO 0.19 0.18 0.67 0.26 0.00 0.00 0.00 175.10 176.41 1ici s TRP 158 N 1.97 2.91 0.27 5.22 0.51 -1.26 -4.92 118.94 123.64 1ici s TRP 158 Ca 0.13 -0.12 -0.29 0.00 -2.12 0.00 0.00 56.10 53.70 1ici s TRP 158 Cb -0.16 -2.52 -0.09 0.00 -0.81 0.00 0.00 33.47 29.89 1ici s TRP 158 CO 0.10 -0.59 1.25 0.12 -0.51 0.00 0.00 176.95 177.32 1ici s PHE 159 N -2.56 3.27 0.00 -1.98 5.36 -1.22 -1.78 117.98 119.08 1ici s PHE 159 Ca 0.54 1.42 0.00 0.00 -0.96 0.00 0.00 56.93 57.94 1ici s PHE 159 Cb -0.10 -3.54 0.00 0.00 -0.34 0.00 0.00 43.02 39.04 1ici s PHE 159 CO 0.36 -1.49 0.00 0.41 -1.46 0.00 0.00 175.22 173.04 1ici n GLY 160 N 1.50 0.20 3.55 13.12 0.00 -1.26 -4.44 105.19 117.86 1ici n GLY 160 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1ici n GLY 160 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ici s GLU 161 N -0.99 2.60 0.47 1.61 2.02 -0.73 -5.06 118.70 118.61 1ici s GLU 161 Ca 0.00 -0.66 -0.23 0.00 0.02 0.00 0.00 54.97 54.11 1ici s GLU 161 Cb 0.00 -2.49 -0.07 0.00 0.10 0.00 0.00 34.13 31.67 1ici s GLU 161 CO 0.00 0.63 1.18 -1.64 0.02 0.00 0.00 175.26 175.45 1ici s MET 162 N -1.00 3.71 0.75 1.61 -1.94 -1.26 -4.79 119.30 116.38 1ici s MET 162 Ca 0.14 1.81 -0.11 0.00 -1.71 0.00 0.00 55.69 55.81 1ici s MET 162 Cb -0.11 -2.39 0.04 0.00 2.01 0.00 0.00 34.83 34.38 1ici s MET 162 CO 0.03 -0.60 1.10 -0.51 -0.01 0.00 0.00 175.02 175.02 1ici s LEU 163 N -3.07 2.76 0.08 -0.03 1.43 -1.26 -4.95 118.68 113.64 1ici s LEU 163 Ca 0.64 1.23 -0.31 0.00 -1.03 0.00 0.00 54.13 54.66 1ici s LEU 163 Cb -0.29 -3.94 -0.07 0.00 0.03 0.00 0.00 46.19 41.91 1ici s LEU 163 CO 0.36 -1.64 1.45 -2.84 0.23 0.00 0.00 176.35 173.91 1ici s PRO 164 N -5.26 4.28 0.25 1.29 0.02 -1.26 -4.90 135.00 129.42 1ici s PRO 164 Ca 0.59 2.11 -0.04 0.00 0.02 0.00 0.00 61.00 63.68 1ici s PRO 164 Cb -0.13 -3.39 0.47 0.00 0.02 0.00 0.00 34.50 31.48 1ici s PRO 164 CO 0.53 -0.54 1.70 -1.35 -0.33 0.00 0.00 177.00 177.01 1ici h PRO 165 N 7.33 0.32 -0.65 5.54 0.11 -2.00 -1.01 132.00 141.65 1ici h PRO 165 Ca -0.41 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.60 1ici h PRO 165 Cb 1.20 -0.07 -0.03 0.00 0.11 0.00 0.00 31.00 32.21 1ici h PRO 165 CO 0.89 0.21 0.09 0.22 -0.21 0.00 0.00 178.00 179.20 1ici h ASP 166 N 0.33 1.03 -0.15 -2.05 3.58 -1.99 -0.36 116.42 116.81 1ici h ASP 166 Ca 0.42 -0.25 -0.00 0.00 0.42 0.00 0.00 57.03 57.62 1ici h ASP 166 Cb 0.70 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.47 1ici h ASP 166 CO -0.48 1.02 0.08 0.58 -2.88 0.00 0.00 179.24 177.56 1ici h VAL 167 N 1.00 1.11 0.17 2.25 2.07 -1.70 -0.84 116.25 120.31 1ici h VAL 167 Ca 0.20 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1ici h VAL 167 Cb 0.44 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1ici h VAL 167 CO 0.01 0.10 -0.08 0.25 0.02 0.00 0.00 177.57 177.87 1ici h LEU 168 N 0.13 -0.19 -0.33 2.57 5.85 -1.00 -1.76 115.31 120.58 1ici h LEU 168 Ca 0.05 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.85 1ici h LEU 168 Cb 0.09 0.05 -0.08 0.00 0.37 0.00 0.00 40.66 41.09 1ici h LEU 168 CO -0.01 -0.14 -0.24 -0.78 -0.34 0.00 0.00 178.44 176.93 1ici h ASP 169 N -0.23 -0.81 -0.56 1.25 1.82 -0.92 -0.72 116.42 116.25 1ici h ASP 169 Ca -0.02 0.16 0.09 0.00 -0.39 0.00 0.00 57.03 56.86 1ici h ASP 169 Cb 0.18 0.40 -0.07 0.00 0.68 0.00 0.00 39.33 40.51 1ici h ASP 169 CO 0.04 -0.27 0.16 0.03 -1.61 0.00 0.00 179.24 177.59 1ici h ARG 170 N -0.21 0.31 -0.53 0.28 3.08 -0.95 -1.25 114.38 115.11 1ici h ARG 170 Ca 0.17 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1ici h ARG 170 Cb 0.47 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.42 1ici h ARG 170 CO -0.45 0.20 0.31 0.00 -1.07 0.00 0.00 179.97 178.96 1ici h ALA 171 N 1.41 0.68 0.06 0.04 0.00 -0.38 -1.35 119.26 119.72 1ici h ALA 171 Ca 0.28 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.12 1ici h ALA 171 Cb 0.37 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ici h ALA 171 CO -0.33 0.17 -0.03 0.52 0.00 0.00 0.00 179.25 179.59 1ici h MET 172 N 0.71 -0.08 -0.59 0.00 2.86 -0.62 -2.01 114.93 115.20 1ici h MET 172 Ca 0.19 0.01 0.01 0.00 -2.06 0.00 0.00 59.70 57.84 1ici h MET 172 Cb 0.01 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.65 1ici h MET 172 CO -0.03 -0.03 0.39 0.00 1.06 0.00 0.00 176.91 178.30 1ici h ARG 173 N -0.11 0.78 -0.03 1.72 3.08 -1.08 0.03 114.38 118.77 1ici h ARG 173 Ca -0.01 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 59.99 1ici h ARG 173 Cb 0.08 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 29.96 1ici h ARG 173 CO 0.01 0.52 0.01 0.93 -1.07 0.00 0.00 179.97 180.37 1ici h GLU 174 N 0.80 0.05 0.00 0.04 4.39 -0.92 -2.72 114.58 116.23 1ici h GLU 174 Ca 0.22 -0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.84 1ici h GLU 174 Cb -0.09 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 1ici h GLU 174 CO -0.05 0.27 -0.29 -0.39 -1.16 0.00 0.00 179.01 177.39 1ici h VAL 175 N -0.17 0.68 0.00 3.13 -1.51 -0.98 -1.98 116.25 115.42 1ici h VAL 175 Ca 0.01 -1.34 0.00 0.00 -1.23 0.00 0.00 66.70 64.14 1ici h VAL 175 Cb 0.24 1.87 0.00 0.00 -2.13 0.00 0.00 31.29 31.27 1ici h VAL 175 CO 0.00 0.29 0.00 -0.62 -1.23 0.00 0.00 177.57 176.01 1ici n GLU 176 N -3.42 0.04 -0.01 5.19 1.02 -0.04 -2.44 120.64 120.98 1ici n GLU 176 Ca 0.00 0.20 0.09 0.00 -0.02 0.00 0.00 57.16 57.43 1ici n GLU 176 Cb 0.48 -1.57 -0.14 0.00 -0.02 0.00 0.00 31.44 30.19 1ici n GLU 176 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1ici n ARG 177 N -1.64 0.58 -2.75 3.49 0.63 -0.87 -5.01 116.66 111.08 1ici n ARG 177 Ca 0.04 -0.16 -0.41 0.00 -0.92 0.00 0.00 57.85 56.41 1ici n ARG 177 Cb 0.25 -1.43 -0.05 0.00 0.45 0.00 0.00 32.46 31.67 1ici n ARG 177 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ici s ALA 178 N -3.25 3.28 -0.31 5.13 0.00 -0.80 -4.81 121.76 121.00 1ici s ALA 178 Ca -0.06 0.58 0.21 0.00 0.00 0.00 0.00 51.96 52.69 1ici s ALA 178 Cb 0.12 -3.24 -0.30 0.00 0.00 0.00 0.00 23.12 19.70 1ici s ALA 178 CO 0.76 0.06 0.59 -0.40 0.00 0.00 0.00 175.76 176.77 1ici n ASP 179 N 2.34 0.38 -3.87 0.00 5.75 -0.89 -4.63 116.55 115.63 1ici n ASP 179 Ca 0.01 -0.30 -0.11 0.00 -0.01 0.00 0.00 54.79 54.37 1ici n ASP 179 Cb 0.48 1.68 -0.11 0.00 -1.03 0.00 0.00 41.12 42.15 1ici n ASP 179 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1ici s VAL 180 N -3.32 0.06 -0.08 2.12 1.01 -1.24 -0.60 120.40 118.34 1ici s VAL 180 Ca -0.03 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 61.46 1ici s VAL 180 Cb 0.14 -0.32 0.04 0.00 0.00 0.00 0.00 36.38 36.24 1ici s VAL 180 CO 0.88 -0.25 0.17 -0.51 0.00 0.00 0.00 175.10 175.39 1ici s ILE 181 N -0.85 -0.11 -0.20 2.22 2.07 -0.67 -1.83 121.20 121.82 1ici s ILE 181 Ca -0.09 0.22 -0.16 0.00 -1.41 0.00 0.00 60.65 59.21 1ici s ILE 181 Cb -0.05 -0.29 -0.04 0.00 0.13 0.00 0.00 42.46 42.21 1ici s ILE 181 CO 0.01 0.09 0.39 -0.63 -1.91 0.00 0.00 174.94 172.89 1ici s ILE 182 N 1.49 5.20 -0.35 2.00 1.01 -0.33 -0.85 121.20 129.37 1ici s ILE 182 Ca -0.06 0.70 -0.00 0.00 0.00 0.00 0.00 60.65 61.29 1ici s ILE 182 Cb -0.12 -3.72 0.09 0.00 0.01 0.00 0.00 42.46 38.72 1ici s ILE 182 CO -0.07 0.26 0.09 -0.69 0.00 0.00 0.00 174.94 174.53 1ici s VAL 183 N 1.29 2.86 -0.04 2.92 1.01 0.05 -0.17 120.40 128.32 1ici s VAL 183 Ca 0.19 -1.96 0.06 0.00 0.00 0.00 0.00 61.98 60.27 1ici s VAL 183 Cb -0.15 -2.91 -0.01 0.00 0.00 0.00 0.00 36.38 33.31 1ici s VAL 183 CO 0.08 -0.49 -0.21 0.00 0.00 0.00 0.00 175.10 174.48 1ici s ALA 184 N 1.09 1.81 -1.20 5.51 0.00 -0.52 -1.05 121.76 127.40 1ici s ALA 184 Ca 0.05 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.12 1ici s ALA 184 Cb -0.21 -0.53 0.00 0.00 0.00 0.00 0.00 23.12 22.38 1ici s ALA 184 CO -0.05 0.38 0.00 0.41 0.00 0.00 0.00 175.76 176.51 1ici n GLY 185 N 2.85 -0.14 3.13 0.00 0.00 -0.83 -1.40 105.19 108.79 1ici n GLY 185 Ca -0.17 -0.30 -0.24 0.00 0.00 0.00 0.00 46.02 45.31 1ici n GLY 185 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1ici s THR 186 N -2.69 1.24 -1.18 2.61 -1.32 -1.26 -0.70 115.64 112.34 1ici s THR 186 Ca 0.00 -0.67 0.15 0.00 -1.21 0.00 0.00 61.69 59.96 1ici s THR 186 Cb 0.00 -1.04 0.18 0.00 -1.51 0.00 0.00 72.50 70.13 1ici s THR 186 CO 0.00 0.35 1.45 -1.54 -2.21 0.00 0.00 174.62 172.67 1ici n SER 187 N 2.74 0.00 -3.86 8.08 3.41 -1.26 -4.90 113.62 117.83 1ici n SER 187 Ca -0.15 0.32 -0.28 0.00 -0.26 0.00 0.00 58.87 58.51 1ici n SER 187 Cb 0.54 -0.41 0.03 0.00 -0.26 0.00 0.00 64.21 64.11 1ici n SER 187 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ici n ALA 188 N -1.41 -1.49 0.00 7.33 0.00 -1.26 -4.38 120.51 119.30 1ici n ALA 188 Ca 0.05 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1ici n ALA 188 Cb 0.15 -3.79 0.00 0.00 0.00 0.00 0.00 19.45 15.81 1ici n ALA 188 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ici n VAL 189 N -4.58 0.00 -2.10 0.00 0.31 -1.26 -4.46 118.33 106.24 1ici n VAL 189 Ca -0.05 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.86 1ici n VAL 189 Cb 0.57 -0.60 -0.03 0.00 -0.91 0.00 0.00 33.84 32.87 1ici n VAL 189 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1ici s VAL 190 N -1.82 3.22 0.21 2.52 1.01 -1.26 -4.81 120.40 119.47 1ici s VAL 190 Ca 0.00 0.81 0.02 0.00 0.00 0.00 0.00 61.98 62.81 1ici s VAL 190 Cb 0.00 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.83 1ici s VAL 190 CO 0.00 0.04 0.37 -1.10 0.00 0.00 0.00 175.10 174.41 1ici s GLN 191 N 1.61 3.47 0.00 2.72 -1.52 -1.26 -1.36 119.66 123.31 1ici s GLN 191 Ca 0.67 -0.55 0.27 0.00 -1.95 0.00 0.00 55.36 53.80 1ici s GLN 191 Cb -0.37 -2.87 1.26 0.00 -0.22 0.00 0.00 33.01 30.80 1ici s GLN 191 CO 0.30 0.42 1.86 -0.35 -0.25 0.00 0.00 175.29 177.26 1ici n PRO 192 N -0.99 1.42 -0.32 2.91 -0.04 -1.26 -4.87 135.00 131.85 1ici n PRO 192 Ca -0.07 -0.61 0.07 0.00 -0.04 0.00 0.00 63.50 62.85 1ici n PRO 192 Cb 0.55 -1.46 0.24 0.00 -0.04 0.00 0.00 33.50 32.79 1ici n PRO 192 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ici h ALA 193 N 4.14 1.39 0.00 0.55 0.00 -1.96 0.30 119.26 123.68 1ici h ALA 193 Ca 0.00 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ici h ALA 193 Cb 0.31 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ici h ALA 193 CO 0.00 0.03 -0.02 0.00 0.00 0.00 0.00 179.25 179.26 1ici h ALA 194 N 1.55 1.64 0.00 0.00 0.00 -1.53 -2.38 119.26 118.54 1ici h ALA 194 Ca 0.48 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.33 1ici h ALA 194 Cb 0.61 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1ici h ALA 194 CO -0.32 0.02 -0.62 0.77 0.00 0.00 0.00 179.25 179.10 1ici h SER 195 N 0.00 0.00 -0.80 0.00 0.02 -1.22 -3.37 113.55 108.18 1ici h SER 195 Ca -0.00 0.00 0.17 0.00 -0.84 0.00 0.00 61.79 61.12 1ici h SER 195 Cb 0.04 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 62.47 1ici h SER 195 CO 0.00 0.21 0.31 -0.07 -1.14 0.00 0.00 176.83 176.14 1ici h LEU 196 N 0.00 0.25 -2.17 5.07 3.38 -1.28 0.27 115.31 120.83 1ici h LEU 196 Ca -0.03 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1ici h LEU 196 Cb 1.18 0.12 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 1ici h LEU 196 CO 0.02 0.05 -0.06 -0.65 0.09 0.00 0.00 178.44 177.89 1ici h PRO 197 N 0.41 0.00 -0.58 1.13 0.11 -1.76 -2.29 132.00 129.02 1ici h PRO 197 Ca 0.46 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.48 1ici h PRO 197 Cb 0.77 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.86 1ici h PRO 197 CO -0.46 0.06 0.01 -0.07 -0.21 0.00 0.00 178.00 177.33 1ici h LEU 198 N 0.00 0.98 -0.27 2.35 3.38 -0.70 -1.85 115.31 119.19 1ici h LEU 198 Ca -0.00 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1ici h LEU 198 Cb 0.23 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1ici h LEU 198 CO 0.01 1.03 0.18 0.40 0.09 0.00 0.00 178.44 180.15 1ici h ILE 199 N 0.93 1.07 -0.25 1.22 5.03 -1.31 0.73 117.51 124.94 1ici h ILE 199 Ca 0.17 -0.13 0.02 0.00 -0.12 0.00 0.00 64.86 64.80 1ici h ILE 199 Cb 0.53 0.67 -0.02 0.00 -3.03 0.00 0.00 36.82 34.96 1ici h ILE 199 CO 0.03 0.07 0.10 0.58 -0.68 0.00 0.00 178.15 178.25 1ici h VAL 200 N 0.37 0.96 -0.00 1.67 2.07 -1.51 -2.38 116.25 117.42 1ici h VAL 200 Ca 0.10 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.57 1ici h VAL 200 Cb -0.04 0.72 -0.05 0.00 -1.52 0.00 0.00 31.29 30.40 1ici h VAL 200 CO -0.02 0.04 -0.26 0.50 0.02 0.00 0.00 177.57 177.85 1ici h LYS 201 N 0.23 -0.38 0.00 1.57 3.11 -0.89 -0.02 116.57 120.18 1ici h LYS 201 Ca 0.11 0.03 -0.00 0.00 -2.81 0.00 0.00 60.65 57.97 1ici h LYS 201 Cb 0.05 0.09 -0.00 0.00 -1.00 0.00 0.00 32.23 31.37 1ici h LYS 201 CO -0.09 -0.25 -0.02 1.96 -2.81 0.00 0.00 179.45 178.24 1ici h GLN 202 N -0.39 0.00 -0.61 1.90 1.08 -0.67 -1.24 115.11 115.18 1ici h GLN 202 Ca 0.06 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.26 1ici h GLN 202 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 1ici h GLN 202 CO -0.23 0.02 0.00 0.54 -0.95 0.00 0.00 178.83 178.21 1ici n ARG 203 N -3.79 2.89 -0.51 1.46 1.74 -0.91 -4.90 116.66 112.64 1ici n ARG 203 Ca -0.03 -1.99 0.00 0.00 -0.77 0.00 0.00 57.85 55.06 1ici n ARG 203 Cb 0.10 -1.70 0.00 0.00 -1.02 0.00 0.00 32.46 29.85 1ici n ARG 203 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ici n GLY 204 N 0.89 0.75 3.92 -0.13 0.00 -0.47 -5.06 105.19 105.09 1ici n GLY 204 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1ici n GLY 204 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ici s GLY 205 N -1.69 1.66 0.09 -0.02 0.00 -0.07 -4.99 107.32 102.29 1ici s GLY 205 Ca 0.00 -0.85 0.02 0.00 0.00 0.00 0.00 44.72 43.89 1ici s GLY 205 CO 0.00 -0.32 0.13 0.00 0.00 0.00 0.00 173.10 172.91 1ici s ALA 206 N -3.56 3.69 -0.14 3.20 0.00 0.23 -4.31 121.76 120.88 1ici s ALA 206 Ca 0.64 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 51.61 1ici s ALA 206 Cb -0.09 -1.54 -0.01 0.00 0.00 0.00 0.00 23.12 21.48 1ici s ALA 206 CO 0.49 0.73 -0.14 0.42 0.00 0.00 0.00 175.76 177.26 1ici s ILE 207 N -1.47 2.89 -0.33 0.00 1.01 -1.26 -1.67 121.20 120.37 1ici s ILE 207 Ca 0.31 -0.71 0.04 0.00 0.00 0.00 0.00 60.65 60.29 1ici s ILE 207 Cb -0.12 -2.21 0.09 0.00 0.01 0.00 0.00 42.46 40.23 1ici s ILE 207 CO 0.24 0.52 0.03 -0.63 0.00 0.00 0.00 174.94 175.09 1ici s ILE 208 N 0.51 2.21 -0.03 2.92 1.01 -0.03 -1.46 121.20 126.33 1ici s ILE 208 Ca -0.10 -2.20 -0.15 0.00 0.00 0.00 0.00 60.65 58.21 1ici s ILE 208 Cb -0.16 -2.58 -0.05 0.00 0.01 0.00 0.00 42.46 39.68 1ici s ILE 208 CO 0.04 -0.51 0.40 -0.70 0.00 0.00 0.00 174.94 174.17 1ici s GLU 209 N 0.96 3.97 -0.24 2.79 2.12 0.11 -0.77 118.70 127.64 1ici s GLU 209 Ca 0.08 0.37 0.01 0.00 0.36 0.00 0.00 54.97 55.78 1ici s GLU 209 Cb -0.19 -3.26 0.07 0.00 0.26 0.00 0.00 34.13 31.00 1ici s GLU 209 CO -0.08 0.60 -0.03 0.42 -0.54 0.00 0.00 175.26 175.63 1ici s ILE 210 N -0.76 1.46 -0.27 -3.70 1.01 -0.21 -0.29 121.20 118.43 1ici s ILE 210 Ca 0.23 -1.26 -0.23 0.00 0.00 0.00 0.00 60.65 59.39 1ici s ILE 210 Cb -0.16 -1.79 0.08 0.00 0.01 0.00 0.00 42.46 40.60 1ici s ILE 210 CO 0.12 -0.18 0.76 0.21 0.00 0.00 0.00 174.94 175.85 1ici s ASN 211 N 1.41 -0.74 0.01 3.58 3.84 -0.57 -1.97 114.94 120.50 1ici s ASN 211 Ca -0.03 1.37 0.17 0.00 0.21 0.00 0.00 52.86 54.57 1ici s ASN 211 Cb -0.19 1.38 0.70 0.00 -0.55 0.00 0.00 41.25 42.59 1ici s ASN 211 CO -0.08 -0.23 1.53 -0.81 -2.79 0.00 0.00 177.10 174.72 1ici n PRO 212 N 2.94 0.01 -4.45 0.43 -0.04 -1.21 -3.49 135.00 129.18 1ici n PRO 212 Ca -0.15 0.22 -0.25 0.00 -0.04 0.00 0.00 63.50 63.29 1ici n PRO 212 Cb 0.56 -1.51 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 1ici n PRO 212 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ici s ASP 213 N -3.04 3.60 0.35 3.54 1.01 -1.26 -4.77 116.67 116.10 1ici s ASP 213 Ca 0.08 -0.97 -0.09 0.00 0.71 0.00 0.00 52.55 52.27 1ici s ASP 213 Cb 0.11 -0.32 -0.06 0.00 1.01 0.00 0.00 42.92 43.66 1ici s ASP 213 CO 0.30 0.06 0.69 -1.61 0.21 0.00 0.00 175.17 174.82 1ici s GLU 214 N -3.31 3.77 0.31 8.23 2.02 -1.26 -5.00 118.70 123.46 1ici s GLU 214 Ca 0.28 0.35 0.07 0.00 0.02 0.00 0.00 54.97 55.70 1ici s GLU 214 Cb -0.06 -2.48 -0.03 0.00 0.10 0.00 0.00 34.13 31.66 1ici s GLU 214 CO 0.14 0.08 0.27 0.25 0.02 0.00 0.00 175.26 176.02 1ici n THR 215 N -1.01 0.00 0.18 3.63 -2.24 -1.26 -5.00 114.28 108.59 1ici n THR 215 Ca 0.01 -2.31 0.08 0.00 -2.27 0.00 0.00 64.05 59.57 1ici n THR 215 Cb 0.54 1.15 0.41 0.00 -2.10 0.00 0.00 70.33 70.33 1ici n THR 215 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1ici n PRO 216 N -0.60 0.10 0.01 -0.78 -0.02 -1.26 -1.87 135.00 130.58 1ici n PRO 216 Ca 0.07 0.55 -0.07 0.00 -2.02 0.00 0.00 63.50 62.03 1ici n PRO 216 Cb 0.57 -1.81 -0.12 0.00 -0.02 0.00 0.00 33.50 32.12 1ici n PRO 216 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1ici h LEU 217 N 0.00 0.00 -0.76 2.45 5.85 -1.89 -3.39 115.31 117.56 1ici h LEU 217 Ca 0.00 0.00 0.14 0.00 0.84 0.00 0.00 57.88 58.86 1ici h LEU 217 Cb 0.07 0.00 -0.14 0.00 0.37 0.00 0.00 40.66 40.96 1ici h LEU 217 CO 0.00 0.94 -0.26 0.74 -0.34 0.00 0.00 178.44 179.52 1ici h THR 218 N 0.00 0.17 -0.03 1.05 2.02 -1.76 0.31 112.91 114.67 1ici h THR 218 Ca -0.18 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.01 1ici h THR 218 Cb 1.88 0.17 -0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1ici h THR 218 CO 0.09 0.00 0.48 -0.65 0.37 0.00 0.00 175.52 175.81 1ici h PRO 219 N -0.05 0.00 -0.10 6.66 0.11 -1.76 0.14 132.00 137.00 1ici h PRO 219 Ca 0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.45 1ici h PRO 219 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 1ici h PRO 219 CO -0.80 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 177.43 1ici n ILE 220 N -2.84 0.64 -2.86 4.15 -5.35 0.07 -4.69 119.36 108.47 1ici n ILE 220 Ca -0.01 -0.82 -0.41 0.00 -0.27 0.00 0.00 62.75 61.25 1ici n ILE 220 Cb 0.52 0.72 -0.04 0.00 -1.74 0.00 0.00 39.64 39.10 1ici n ILE 220 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ici s ALA 221 N -0.79 3.29 0.30 -1.28 0.00 0.48 -4.77 121.76 119.00 1ici s ALA 221 Ca 0.09 0.40 0.08 0.00 0.00 0.00 0.00 51.96 52.53 1ici s ALA 221 Cb 0.05 -3.14 0.48 0.00 0.00 0.00 0.00 23.12 20.51 1ici s ALA 221 CO 0.07 -0.04 1.71 -0.44 0.00 0.00 0.00 175.76 177.06 1ici h ASP 222 N 5.98 0.17 -3.57 0.00 5.19 -1.56 -3.41 116.42 119.22 1ici h ASP 222 Ca -0.43 -0.07 -0.26 0.00 -0.62 0.00 0.00 57.03 55.65 1ici h ASP 222 Cb 1.21 -0.05 -0.31 0.00 0.18 0.00 0.00 39.33 40.36 1ici h ASP 222 CO 0.72 0.59 -0.68 -0.31 -3.12 0.00 0.00 179.24 176.45 1ici s TYR 223 N -4.07 -0.03 -0.16 4.55 1.51 -0.92 -1.46 117.35 116.77 1ici s TYR 223 Ca -0.04 0.20 -0.02 0.00 -1.01 0.00 0.00 57.07 56.20 1ici s TYR 223 Cb 0.13 -0.13 0.05 0.00 -0.11 0.00 0.00 41.96 41.90 1ici s TYR 223 CO 0.76 -0.08 0.00 0.45 -1.11 0.00 0.00 175.55 175.57 1ici s SER 224 N 0.77 2.56 -0.30 2.29 0.15 -0.64 0.07 113.70 118.60 1ici s SER 224 Ca -0.06 -0.60 -0.10 0.00 0.70 0.00 0.00 55.95 55.90 1ici s SER 224 Cb -0.09 -0.65 -0.02 0.00 -1.71 0.00 0.00 66.02 63.56 1ici s SER 224 CO -0.03 -0.24 0.15 -0.76 1.20 0.00 0.00 173.24 173.56 1ici s LEU 225 N 1.82 4.00 -1.00 3.45 1.43 0.60 -4.37 118.68 124.62 1ici s LEU 225 Ca 0.01 -0.39 -0.22 0.00 -1.03 0.00 0.00 54.13 52.50 1ici s LEU 225 Cb -0.15 -2.01 0.07 0.00 0.03 0.00 0.00 46.19 44.12 1ici s LEU 225 CO -0.07 -0.15 1.38 -0.13 0.23 0.00 0.00 176.35 177.61 1ici s ARG 226 N 1.64 3.59 0.11 1.70 1.81 -1.25 -1.51 118.95 125.04 1ici s ARG 226 Ca 0.05 -1.24 -0.26 0.00 -1.72 0.00 0.00 55.73 52.56 1ici s ARG 226 Cb -0.17 -5.25 0.08 0.00 -0.45 0.00 0.00 34.95 29.17 1ici s ARG 226 CO 0.07 -2.12 1.08 0.20 -0.68 0.00 0.00 175.30 173.85 1ici s GLY 227 N 4.68 -0.21 0.35 -3.53 0.00 -1.23 -4.85 107.32 102.53 1ici s GLY 227 Ca 0.43 0.19 -0.26 0.00 0.00 0.00 0.00 44.72 45.07 1ici s GLY 227 CO -0.10 0.72 1.09 0.54 0.00 0.00 0.00 173.10 175.36 1ici s LYS 228 N -2.79 4.34 0.43 2.90 1.02 -1.26 -3.32 119.74 121.06 1ici s LYS 228 Ca 0.15 1.69 0.09 0.00 0.02 0.00 0.00 55.97 57.92 1ici s LYS 228 Cb 0.00 -2.83 0.94 0.00 -0.52 0.00 0.00 37.83 35.43 1ici s LYS 228 CO 0.01 -0.03 2.06 0.00 -0.92 0.00 0.00 175.35 176.48 1ici h ALA 229 N 3.06 1.79 0.90 5.17 0.00 -1.89 -1.27 119.26 127.01 1ici h ALA 229 Ca -0.48 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 1ici h ALA 229 Cb 1.22 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.88 1ici h ALA 229 CO 0.64 0.18 -0.43 0.78 0.00 0.00 0.00 179.25 180.41 1ici h GLY 230 N 0.45 -1.27 1.00 0.00 0.00 -1.91 0.96 103.07 102.30 1ici h GLY 230 Ca 0.14 0.47 -0.00 0.00 0.00 0.00 0.00 47.33 47.94 1ici h GLY 230 CO -0.03 -0.46 -0.05 0.83 0.00 0.00 0.00 176.54 176.83 1ici h GLU 231 N -1.21 -0.13 -0.19 4.80 4.39 -1.92 -1.25 114.58 119.07 1ici h GLU 231 Ca -0.12 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.58 1ici h GLU 231 Cb 0.93 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.60 1ici h GLU 231 CO 0.20 -0.09 0.08 0.28 -1.16 0.00 0.00 179.01 178.32 1ici h VAL 232 N -0.14 1.15 -0.44 3.13 2.07 -1.28 -1.57 116.25 119.18 1ici h VAL 232 Ca -0.01 -0.43 -0.10 0.00 0.82 0.00 0.00 66.70 66.98 1ici h VAL 232 Cb 0.11 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1ici h VAL 232 CO 0.02 0.14 -0.14 0.24 0.02 0.00 0.00 177.57 177.85 1ici h MET 233 N 0.17 0.82 0.48 1.57 2.86 -0.83 0.12 114.93 120.12 1ici h MET 233 Ca 0.06 -0.29 -0.01 0.00 -2.06 0.00 0.00 59.70 57.40 1ici h MET 233 Cb 0.14 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 1ici h MET 233 CO -0.01 0.91 -0.38 0.22 1.06 0.00 0.00 176.91 178.71 1ici h ASP 234 N 0.73 -1.00 -0.78 1.22 3.58 -1.10 0.12 116.42 119.20 1ici h ASP 234 Ca 0.12 0.07 0.07 0.00 0.42 0.00 0.00 57.03 57.71 1ici h ASP 234 Cb 0.64 0.32 -0.05 0.00 1.72 0.00 0.00 39.33 41.96 1ici h ASP 234 CO 0.04 -0.56 0.51 -0.08 -2.88 0.00 0.00 179.24 176.28 1ici h GLU 235 N -0.85 0.78 -0.00 0.28 4.81 -1.16 -2.08 114.58 116.36 1ici h GLU 235 Ca -0.05 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1ici h GLU 235 Cb 0.73 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 1ici h GLU 235 CO -0.00 0.52 0.00 1.25 -0.73 0.00 0.00 179.01 180.04 1ici h LEU 236 N 0.80 0.00 -1.02 1.64 5.85 -0.31 -2.83 115.31 119.45 1ici h LEU 236 Ca 0.34 -0.18 -0.09 0.00 0.84 0.00 0.00 57.88 58.79 1ici h LEU 236 Cb 0.29 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.30 1ici h LEU 236 CO -0.12 0.18 -0.23 0.58 -0.34 0.00 0.00 178.44 178.51 1ici h VAL 237 N -0.18 1.25 0.59 1.05 2.07 -0.47 -1.78 116.25 118.79 1ici h VAL 237 Ca 0.00 -1.19 -0.02 0.00 0.82 0.00 0.00 66.70 66.31 1ici h VAL 237 Cb 0.18 1.32 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1ici h VAL 237 CO -0.00 0.38 -0.35 -0.09 0.02 0.00 0.00 177.57 177.53 1ici h ARG 238 N 0.39 -0.85 -0.42 1.57 2.43 -1.30 0.20 114.38 116.40 1ici h ARG 238 Ca 0.06 0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.33 1ici h ARG 238 Cb 0.61 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.32 1ici h ARG 238 CO 0.04 -0.56 0.20 0.45 -1.51 0.00 0.00 179.97 178.59 1ici h HIS 239 N -0.88 0.37 -0.96 2.20 3.86 -1.46 -1.10 115.15 117.18 1ici h HIS 239 Ca -0.07 0.02 0.03 0.00 -1.16 0.00 0.00 60.37 59.18 1ici h HIS 239 Cb 0.71 -0.10 -0.05 0.00 1.06 0.00 0.00 27.41 29.02 1ici h HIS 239 CO -0.09 0.18 0.63 0.28 0.86 0.00 0.00 177.93 179.80 1ici h VAL 240 N 0.41 1.20 -0.39 2.45 2.07 -1.21 -0.45 116.25 120.33 1ici h VAL 240 Ca 0.18 -0.43 0.01 0.00 0.82 0.00 0.00 66.70 67.29 1ici h VAL 240 Cb 0.11 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 29.69 1ici h VAL 240 CO -0.14 0.23 0.24 -0.09 0.02 0.00 0.00 177.57 177.83 1ici h ARG 241 N 1.25 0.48 0.14 1.57 2.43 0.34 0.11 114.38 120.70 1ici h ARG 241 Ca 0.37 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.51 1ici h ARG 241 Cb -0.06 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.39 1ici h ARG 241 CO -0.11 0.31 -0.07 -0.22 -1.51 0.00 0.00 179.97 178.38 1ici h LYS 242 N 0.49 -0.18 0.00 0.20 3.64 -0.81 -3.08 116.57 116.83 1ici h LYS 242 Ca 0.15 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1ici h LYS 242 Cb -0.03 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1ici h LYS 242 CO -0.05 0.14 -0.05 0.00 -2.27 0.00 0.00 179.45 177.22 1ici h ALA 243 N 0.27 1.25 -0.22 5.00 0.00 -1.01 -1.77 119.26 122.78 1ici h ALA 243 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ici h ALA 243 Cb 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1ici h ALA 243 CO 0.03 0.06 0.00 -0.11 0.00 0.00 0.00 179.25 179.23 1ici n LEU 244 N -3.51 1.66 0.00 0.00 7.94 0.39 -5.07 117.00 118.41 1ici n LEU 244 Ca -0.02 -0.84 0.00 0.00 -1.11 0.00 0.00 56.01 54.04 1ici n LEU 244 Cb 0.16 -0.29 0.00 0.00 0.53 0.00 0.00 43.42 43.82 1ici n LEU 244 CO 0.27 0.33 0.11 -1.20 -1.11 0.00 0.00 177.39 175.79