#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ff9 s THR 3 N 0.00 3.16 0.63 0.00 2.01 -1.26 -4.94 115.64 115.25 1ff9 s THR 3 Ca 0.00 -0.01 -0.16 0.00 0.31 0.00 0.00 61.69 61.83 1ff9 s THR 3 Cb 0.00 -3.41 -0.02 0.00 0.01 0.00 0.00 72.50 69.08 1ff9 s THR 3 CO 0.00 -0.39 1.10 -0.54 -0.69 0.00 0.00 174.62 174.10 1ff9 s LYS 4 N 7.90 3.00 0.05 4.92 -0.14 -1.26 -4.92 119.74 129.30 1ff9 s LYS 4 Ca 0.84 1.37 0.03 0.00 -1.36 0.00 0.00 55.97 56.85 1ff9 s LYS 4 Cb -0.13 -1.98 -0.03 0.00 -1.68 0.00 0.00 37.83 34.01 1ff9 s LYS 4 CO 0.16 -1.08 -0.09 -1.54 -0.76 0.00 0.00 175.35 172.04 1ff9 s SER 5 N -2.53 1.04 0.03 2.83 1.04 -1.26 -2.23 113.70 112.62 1ff9 s SER 5 Ca 0.67 -0.58 0.04 0.00 0.48 0.00 0.00 55.95 56.56 1ff9 s SER 5 Cb -0.20 0.02 -0.02 0.00 0.10 0.00 0.00 66.02 65.92 1ff9 s SER 5 CO 0.38 -0.18 -0.11 -0.69 0.98 0.00 0.00 173.24 173.62 1ff9 s VAL 6 N -1.41 0.84 -0.31 5.02 1.01 0.61 -1.40 120.40 124.76 1ff9 s VAL 6 Ca -0.08 -0.91 -0.11 0.00 0.00 0.00 0.00 61.98 60.88 1ff9 s VAL 6 Cb -0.10 -0.79 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 1ff9 s VAL 6 CO 0.01 -0.09 0.19 -0.22 0.00 0.00 0.00 175.10 174.98 1ff9 s LEU 7 N -1.12 4.17 -0.23 3.92 2.96 -0.24 -1.49 118.68 126.64 1ff9 s LEU 7 Ca -0.02 -0.32 -0.08 0.00 -0.22 0.00 0.00 54.13 53.49 1ff9 s LEU 7 Cb -0.08 -2.07 -0.04 0.00 0.50 0.00 0.00 46.19 44.50 1ff9 s LEU 7 CO 0.01 -0.15 0.09 -0.32 -1.32 0.00 0.00 176.35 174.65 1ff9 s MET 8 N 1.69 3.81 -0.25 1.98 -2.45 -0.49 0.14 119.30 123.73 1ff9 s MET 8 Ca 0.06 -0.41 -0.08 0.00 -1.25 0.00 0.00 55.69 54.02 1ff9 s MET 8 Cb -0.17 -3.35 -0.03 0.00 1.25 0.00 0.00 34.83 32.53 1ff9 s MET 8 CO 0.09 -0.04 0.08 -0.51 1.05 0.00 0.00 175.02 175.69 1ff9 s LEU 9 N 1.25 3.51 0.00 4.11 1.43 0.80 -1.08 118.68 128.70 1ff9 s LEU 9 Ca 0.05 -0.18 0.00 0.00 -1.03 0.00 0.00 54.13 52.97 1ff9 s LEU 9 Cb -0.14 -1.95 0.00 0.00 0.03 0.00 0.00 46.19 44.13 1ff9 s LEU 9 CO 0.04 -0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.20 1ff9 n GLY 10 N 4.92 4.65 2.69 -3.19 0.00 -1.13 -1.16 105.19 111.96 1ff9 n GLY 10 Ca -0.16 -0.76 -0.26 0.00 0.00 0.00 0.00 46.02 44.85 1ff9 n GLY 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ff9 n SER 11 N 0.00 4.22 -1.52 1.61 3.41 -1.26 -4.79 113.62 115.29 1ff9 n SER 11 Ca 0.00 -3.61 0.00 0.00 -0.26 0.00 0.00 58.87 55.00 1ff9 n SER 11 Cb 0.00 -0.52 0.00 0.00 -0.26 0.00 0.00 64.21 63.43 1ff9 n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ff9 n GLY 12 N -0.31 4.21 0.37 5.00 0.00 -1.26 -5.07 105.19 108.14 1ff9 n GLY 12 Ca 0.33 -1.97 -0.10 0.00 0.00 0.00 0.00 46.02 44.29 1ff9 n GLY 12 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1ff9 h PHE 13 N 0.97 -1.10 0.00 1.61 3.57 -1.97 -3.00 116.94 117.01 1ff9 h PHE 13 Ca 0.00 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.55 1ff9 h PHE 13 Cb 0.00 0.53 -0.00 0.00 2.79 0.00 0.00 35.95 39.27 1ff9 h PHE 13 CO 0.00 -0.43 -0.06 -0.39 -2.23 0.00 0.00 178.31 175.20 1ff9 h VAL 14 N -0.34 0.15 -0.72 1.41 -1.51 -1.93 -3.36 116.25 109.96 1ff9 h VAL 14 Ca 0.13 -0.76 0.15 0.00 -1.23 0.00 0.00 66.70 65.00 1ff9 h VAL 14 Cb 0.57 1.66 -0.11 0.00 -2.13 0.00 0.00 31.29 31.28 1ff9 h VAL 14 CO -0.51 0.06 0.16 0.74 -1.23 0.00 0.00 177.57 176.78 1ff9 h THR 15 N 0.00 0.52 0.16 7.19 2.02 -1.89 -3.21 112.91 117.70 1ff9 h THR 15 Ca -0.00 -0.09 0.02 0.00 0.77 0.00 0.00 66.41 67.11 1ff9 h THR 15 Cb 0.65 0.24 -0.04 0.00 -1.74 0.00 0.00 68.15 67.26 1ff9 h THR 15 CO 0.01 0.05 -0.41 -0.09 0.37 0.00 0.00 175.52 175.44 1ff9 h ARG 16 N 0.25 -0.65 -0.98 6.66 2.43 -1.78 0.84 114.38 121.16 1ff9 h ARG 16 Ca 0.40 0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.69 1ff9 h ARG 16 Cb 0.67 0.15 -0.07 0.00 -0.42 0.00 0.00 29.97 30.31 1ff9 h ARG 16 CO -0.51 -0.43 0.63 -1.35 -1.51 0.00 0.00 179.97 176.80 1ff9 h PRO 17 N -0.68 1.07 -0.24 0.20 0.11 -1.85 0.28 132.00 130.90 1ff9 h PRO 17 Ca 0.01 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1ff9 h PRO 17 Cb 0.68 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 1ff9 h PRO 17 CO -0.21 0.71 0.10 1.15 -0.21 0.00 0.00 178.00 179.53 1ff9 h THR 18 N 1.11 1.17 -0.15 -1.15 2.02 -1.50 -1.31 112.91 113.08 1ff9 h THR 18 Ca 0.43 -0.51 -0.00 0.00 0.77 0.00 0.00 66.41 67.10 1ff9 h THR 18 Cb 0.23 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 1ff9 h THR 18 CO -0.18 0.17 0.09 0.25 0.37 0.00 0.00 175.52 176.23 1ff9 h LEU 19 N 0.24 0.18 0.06 2.58 5.85 0.04 -1.96 115.31 122.31 1ff9 h LEU 19 Ca 0.08 -0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.77 1ff9 h LEU 19 Cb 0.18 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.13 1ff9 h LEU 19 CO -0.01 0.17 -0.16 0.44 -0.34 0.00 0.00 178.44 178.55 1ff9 h ASP 20 N 0.18 -0.44 -0.72 1.25 3.45 -0.38 -1.09 116.42 118.66 1ff9 h ASP 20 Ca 0.06 0.06 0.01 0.00 0.43 0.00 0.00 57.03 57.58 1ff9 h ASP 20 Cb 0.02 0.17 -0.04 0.00 -0.56 0.00 0.00 39.33 38.93 1ff9 h ASP 20 CO -0.01 -0.22 0.47 0.58 -1.57 0.00 0.00 179.24 178.49 1ff9 h VAL 21 N -0.29 1.17 0.01 -1.35 2.07 -1.17 -0.47 116.25 116.22 1ff9 h VAL 21 Ca 0.03 -0.33 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1ff9 h VAL 21 Cb 0.32 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1ff9 h VAL 21 CO -0.11 0.18 -0.00 -0.07 0.02 0.00 0.00 177.57 177.58 1ff9 h LEU 22 N 0.96 -0.01 -1.37 2.57 3.38 -1.20 -2.88 115.31 116.76 1ff9 h LEU 22 Ca 0.27 -0.42 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1ff9 h LEU 22 Cb -0.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1ff9 h LEU 22 CO -0.07 0.41 -0.08 0.71 0.09 0.00 0.00 178.44 179.50 1ff9 h THR 23 N -0.43 1.18 0.00 0.22 1.35 -1.16 -0.42 112.91 113.65 1ff9 h THR 23 Ca -0.00 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 1ff9 h THR 23 Cb 0.42 1.12 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 1ff9 h THR 23 CO 0.00 0.24 0.00 0.44 -0.25 0.00 0.00 175.52 175.95 1ff9 h ASP 24 N 0.31 0.00 -0.28 5.36 3.32 -1.04 -1.64 116.42 122.45 1ff9 h ASP 24 Ca 0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1ff9 h ASP 24 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1ff9 h ASP 24 CO 0.02 0.00 0.00 -1.20 -1.72 0.00 0.00 179.24 176.34 1ff9 n SER 25 N -2.62 2.81 0.00 6.45 7.64 -0.22 -4.92 113.62 122.76 1ff9 n SER 25 Ca 0.01 -1.90 0.00 0.00 1.01 0.00 0.00 58.87 57.99 1ff9 n SER 25 Cb 0.21 -0.18 0.00 0.00 -1.01 0.00 0.00 64.21 63.24 1ff9 n SER 25 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ff9 n GLY 26 N 1.37 0.75 3.69 0.23 0.00 -0.62 -5.03 105.19 105.58 1ff9 n GLY 26 Ca 0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1ff9 n GLY 26 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ff9 s ILE 27 N -2.62 4.99 0.19 -0.61 1.01 -0.85 -4.73 121.20 118.58 1ff9 s ILE 27 Ca 0.00 1.46 -0.28 0.00 0.00 0.00 0.00 60.65 61.82 1ff9 s ILE 27 Cb 0.00 -4.05 -0.08 0.00 0.01 0.00 0.00 42.46 38.34 1ff9 s ILE 27 CO 0.00 0.16 0.89 -0.54 0.00 0.00 0.00 174.94 175.44 1ff9 s LYS 28 N 1.41 4.73 -0.07 2.79 1.02 -0.95 -3.55 119.74 125.12 1ff9 s LYS 28 Ca 0.36 1.36 0.01 0.00 0.02 0.00 0.00 55.97 57.72 1ff9 s LYS 28 Cb -0.17 -3.29 0.02 0.00 -0.52 0.00 0.00 37.83 33.86 1ff9 s LYS 28 CO 0.15 0.47 -0.08 0.08 -0.92 0.00 0.00 175.35 175.05 1ff9 s VAL 29 N -0.92 0.89 -0.29 3.17 1.01 -0.32 -0.28 120.40 123.65 1ff9 s VAL 29 Ca 0.40 -0.29 -0.10 0.00 0.00 0.00 0.00 61.98 61.99 1ff9 s VAL 29 Cb -0.24 -0.87 -0.03 0.00 0.00 0.00 0.00 36.38 35.24 1ff9 s VAL 29 CO 0.29 0.32 0.17 0.42 0.00 0.00 0.00 175.10 176.30 1ff9 s THR 30 N 1.09 4.91 -0.31 3.92 -4.23 -0.55 -0.81 115.64 119.66 1ff9 s THR 30 Ca -0.07 -0.14 -0.21 0.00 -1.18 0.00 0.00 61.69 60.08 1ff9 s THR 30 Cb -0.14 -3.41 -0.01 0.00 1.34 0.00 0.00 72.50 70.28 1ff9 s THR 30 CO -0.01 0.17 0.69 -0.69 -0.54 0.00 0.00 174.62 174.24 1ff9 s VAL 31 N 1.68 4.88 -0.16 2.29 1.01 0.21 -1.39 120.40 128.92 1ff9 s VAL 31 Ca 0.06 0.98 -0.02 0.00 0.00 0.00 0.00 61.98 63.00 1ff9 s VAL 31 Cb -0.16 -4.06 -0.02 0.00 0.00 0.00 0.00 36.38 32.14 1ff9 s VAL 31 CO 0.08 -0.18 -0.08 0.00 0.00 0.00 0.00 175.10 174.92 1ff9 s ALA 32 N 2.74 2.78 0.25 5.51 0.00 -0.24 -1.25 121.76 131.55 1ff9 s ALA 32 Ca 0.28 -0.94 0.02 0.00 0.00 0.00 0.00 51.96 51.32 1ff9 s ALA 32 Cb -0.15 -1.44 -0.05 0.00 0.00 0.00 0.00 23.12 21.48 1ff9 s ALA 32 CO 0.12 0.07 0.06 0.00 0.00 0.00 0.00 175.76 176.00 1ff9 h ARG 34 N 2.42 1.14 -5.85 0.00 3.08 -1.87 -1.01 114.38 112.29 1ff9 h ARG 34 Ca -0.38 -0.07 -0.66 0.00 0.07 0.00 0.00 59.98 58.94 1ff9 h ARG 34 Cb 1.24 -0.26 -0.08 0.00 0.08 0.00 0.00 29.97 30.95 1ff9 h ARG 34 CO 0.63 0.75 -0.53 0.99 -1.07 0.00 0.00 179.97 180.74 1ff9 s THR 35 N -6.13 5.10 0.21 2.04 2.01 -1.26 -4.02 115.64 113.59 1ff9 s THR 35 Ca -0.13 -0.17 -0.04 0.00 0.31 0.00 0.00 61.69 61.66 1ff9 s THR 35 Cb 0.17 -3.31 0.02 0.00 0.01 0.00 0.00 72.50 69.39 1ff9 s THR 35 CO 0.80 0.43 1.61 0.25 -0.69 0.00 0.00 174.62 177.02 1ff9 h LEU 36 N 4.31 0.77 0.20 4.42 5.85 -1.82 -2.82 115.31 126.22 1ff9 h LEU 36 Ca -0.51 -0.29 0.01 0.00 0.84 0.00 0.00 57.88 57.93 1ff9 h LEU 36 Cb 1.20 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.99 1ff9 h LEU 36 CO 0.63 1.00 -0.28 -0.33 -0.34 0.00 0.00 178.44 179.11 1ff9 h GLU 37 N 0.64 -0.52 -0.70 1.25 5.08 -1.95 0.73 114.58 119.11 1ff9 h GLU 37 Ca 0.08 0.04 0.15 0.00 -1.00 0.00 0.00 59.36 58.63 1ff9 h GLU 37 Cb 0.79 0.12 -0.11 0.00 0.50 0.00 0.00 28.75 30.05 1ff9 h GLU 37 CO 0.06 -0.35 0.10 0.77 -1.00 0.00 0.00 179.01 178.59 1ff9 h SER 38 N -0.54 -0.12 -0.27 1.42 0.02 -1.95 0.37 113.55 112.47 1ff9 h SER 38 Ca 0.01 0.15 -0.07 0.00 -0.84 0.00 0.00 61.79 61.04 1ff9 h SER 38 Cb 0.53 0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.30 1ff9 h SER 38 CO -0.11 -0.08 -0.11 0.00 -1.14 0.00 0.00 176.83 175.39 1ff9 h ALA 39 N 1.60 0.38 -1.00 3.77 0.00 -1.15 -2.57 119.26 120.29 1ff9 h ALA 39 Ca 0.38 -0.30 0.11 0.00 0.00 0.00 0.00 54.91 55.10 1ff9 h ALA 39 Cb 0.65 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 18.26 1ff9 h ALA 39 CO -0.53 0.23 0.63 0.87 0.00 0.00 0.00 179.25 180.45 1ff9 h LYS 40 N 0.29 0.99 0.00 0.00 1.57 0.23 -2.69 116.57 116.96 1ff9 h LYS 40 Ca 0.06 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1ff9 h LYS 40 Cb 0.61 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1ff9 h LYS 40 CO 0.04 0.66 0.00 1.17 -0.57 0.00 0.00 179.45 180.74 1ff9 n LYS 41 N -4.60 0.00 0.00 3.15 4.81 0.11 -1.20 118.16 120.43 1ff9 n LYS 41 Ca 0.18 0.41 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 1ff9 n LYS 41 Cb 0.32 -1.40 0.00 0.00 0.02 0.00 0.00 35.03 33.97 1ff9 n LYS 41 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1ff9 n LEU 42 N -1.71 0.00 0.00 3.14 4.77 -0.99 -2.04 117.00 120.17 1ff9 n LEU 42 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1ff9 n LEU 42 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1ff9 n LEU 42 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.39 175.82 1ff9 n SER 43 N -0.31 0.00 -4.68 -1.43 2.88 -1.02 -4.88 113.62 104.18 1ff9 n SER 43 Ca 0.00 -0.04 -0.46 0.00 -1.33 0.00 0.00 58.87 57.05 1ff9 n SER 43 Cb 0.00 0.07 -0.04 0.00 -0.75 0.00 0.00 64.21 63.49 1ff9 n SER 43 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ff9 n ALA 44 N -0.07 1.46 -0.79 -1.46 0.00 -0.34 -1.70 120.51 117.61 1ff9 n ALA 44 Ca 0.00 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1ff9 n ALA 44 Cb 0.00 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.05 1ff9 n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ff9 n GLY 45 N 3.65 1.07 3.58 0.00 0.00 -1.26 -4.99 105.19 107.24 1ff9 n GLY 45 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 1ff9 n GLY 45 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ff9 s VAL 46 N -3.41 5.03 0.68 1.61 1.01 -0.69 -5.04 120.40 119.60 1ff9 s VAL 46 Ca 0.00 0.49 -0.17 0.00 0.00 0.00 0.00 61.98 62.31 1ff9 s VAL 46 Cb 0.00 -3.92 -0.02 0.00 0.00 0.00 0.00 36.38 32.44 1ff9 s VAL 46 CO 0.00 -0.12 0.91 0.00 0.00 0.00 0.00 175.10 175.89 1ff9 n GLN 47 N 5.68 0.60 -1.52 2.72 1.13 -1.26 -2.88 117.38 121.85 1ff9 n GLN 47 Ca -0.05 0.25 -0.17 0.00 -1.94 0.00 0.00 57.00 55.09 1ff9 n GLN 47 Cb 0.49 -2.15 -0.07 0.00 0.11 0.00 0.00 30.24 28.61 1ff9 n GLN 47 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1ff9 n HIS 48 N -2.26 -0.19 -4.33 1.08 8.25 -1.26 -4.83 115.22 111.69 1ff9 n HIS 48 Ca 0.13 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.32 1ff9 n HIS 48 Cb 0.49 -3.08 -0.10 0.00 1.12 0.00 0.00 29.99 28.42 1ff9 n HIS 48 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1ff9 s SER 49 N -2.47 4.02 -0.05 0.41 1.04 -1.14 -1.18 113.70 114.34 1ff9 s SER 49 Ca 0.00 -0.66 -0.02 0.00 0.48 0.00 0.00 55.95 55.75 1ff9 s SER 49 Cb 0.00 -0.59 0.04 0.00 0.10 0.00 0.00 66.02 65.57 1ff9 s SER 49 CO 0.00 0.11 0.09 -0.89 0.98 0.00 0.00 173.24 173.52 1ff9 s THR 50 N -1.71 -0.10 0.09 2.02 2.01 0.01 -4.95 115.64 113.00 1ff9 s THR 50 Ca 0.24 0.28 -0.07 0.00 0.31 0.00 0.00 61.69 62.45 1ff9 s THR 50 Cb -0.08 -0.17 -0.05 0.00 0.01 0.00 0.00 72.50 72.20 1ff9 s THR 50 CO 0.14 0.12 0.35 -2.16 -0.69 0.00 0.00 174.62 172.38 1ff9 s PRO 51 N 1.57 3.65 0.14 4.92 0.04 -1.26 0.64 135.00 144.70 1ff9 s PRO 51 Ca -0.04 -0.01 -0.12 0.00 0.04 0.00 0.00 61.00 60.88 1ff9 s PRO 51 Cb -0.12 -2.96 0.01 0.00 0.04 0.00 0.00 34.50 31.47 1ff9 s PRO 51 CO -0.04 0.55 0.32 0.96 0.04 0.00 0.00 177.00 178.82 1ff9 s ILE 52 N -1.48 0.08 -0.16 0.56 -4.36 -0.38 -4.91 121.20 110.56 1ff9 s ILE 52 Ca 0.35 -1.06 -0.08 0.00 -0.26 0.00 0.00 60.65 59.60 1ff9 s ILE 52 Cb -0.13 -1.51 -0.04 0.00 1.25 0.00 0.00 42.46 42.03 1ff9 s ILE 52 CO 0.20 -0.38 0.13 -0.55 0.24 0.00 0.00 174.94 174.59 1ff9 s SER 53 N -2.89 6.30 -0.20 4.36 0.15 -1.26 -2.41 113.70 117.75 1ff9 s SER 53 Ca 0.09 0.35 -0.15 0.00 0.70 0.00 0.00 55.95 56.94 1ff9 s SER 53 Cb 0.03 -2.08 0.06 0.00 -1.71 0.00 0.00 66.02 62.32 1ff9 s SER 53 CO -0.06 0.30 0.52 -0.22 1.20 0.00 0.00 173.24 174.97 1ff9 s LEU 54 N -0.37 -0.15 -0.56 3.45 2.96 -0.38 -4.92 118.68 118.71 1ff9 s LEU 54 Ca 0.12 1.07 -0.17 0.00 -0.22 0.00 0.00 54.13 54.93 1ff9 s LEU 54 Cb -0.12 1.76 0.13 0.00 0.50 0.00 0.00 46.19 48.46 1ff9 s LEU 54 CO 0.01 -0.19 0.55 -0.62 -1.32 0.00 0.00 176.35 174.78 1ff9 s ASP 55 N 0.76 6.20 0.59 3.68 3.68 -1.26 -4.01 116.67 126.31 1ff9 s ASP 55 Ca -0.04 -1.74 0.29 0.00 2.13 0.00 0.00 52.55 53.19 1ff9 s ASP 55 Cb -0.05 -2.23 1.72 0.00 -1.45 0.00 0.00 42.92 40.91 1ff9 s ASP 55 CO -0.06 -0.91 2.17 0.58 0.13 0.00 0.00 175.17 177.08 1ff9 h VAL 56 N 5.87 0.50 0.00 1.11 2.07 -1.98 -1.45 116.25 122.38 1ff9 h VAL 56 Ca -0.29 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1ff9 h VAL 56 Cb 1.10 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1ff9 h VAL 56 CO 1.05 0.00 0.00 -3.20 0.02 0.00 0.00 177.57 175.44 1ff9 n ASN 57 N -3.84 0.71 -4.51 0.57 4.05 -1.26 -4.54 115.26 106.45 1ff9 n ASN 57 Ca -0.00 0.57 -0.42 0.00 0.45 0.00 0.00 54.58 55.18 1ff9 n ASN 57 Cb 0.22 -0.76 -0.03 0.00 1.23 0.00 0.00 39.78 40.44 1ff9 n ASN 57 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1ff9 s ASP 58 N -4.34 6.30 0.24 1.20 -1.08 -0.55 -4.90 116.67 113.54 1ff9 s ASP 58 Ca 0.11 -1.04 -0.07 0.00 -0.52 0.00 0.00 52.55 51.02 1ff9 s ASP 58 Cb 0.13 -2.50 0.41 0.00 -1.46 0.00 0.00 42.92 39.50 1ff9 s ASP 58 CO 0.58 -1.55 1.66 0.44 0.52 0.00 0.00 175.17 176.82 1ff9 h ASP 59 N 9.69 -0.22 -0.57 -0.34 5.19 -1.85 0.16 116.42 128.48 1ff9 h ASP 59 Ca -0.12 0.17 -0.05 0.00 -0.62 0.00 0.00 57.03 56.41 1ff9 h ASP 59 Cb 1.04 0.28 -0.02 0.00 0.18 0.00 0.00 39.33 40.81 1ff9 h ASP 59 CO 1.26 -0.12 0.14 0.00 -3.12 0.00 0.00 179.24 177.40 1ff9 h ALA 60 N 1.64 0.75 -0.50 3.45 0.00 -1.95 -1.78 119.26 120.87 1ff9 h ALA 60 Ca 0.39 -0.22 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 1ff9 h ALA 60 Cb 0.67 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1ff9 h ALA 60 CO -0.58 0.45 -0.19 0.00 0.00 0.00 0.00 179.25 178.93 1ff9 h ALA 61 N 1.03 0.70 -0.13 0.00 0.00 -1.60 -2.80 119.26 116.46 1ff9 h ALA 61 Ca 0.18 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1ff9 h ALA 61 Cb 0.34 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1ff9 h ALA 61 CO 0.00 0.68 0.04 1.25 0.00 0.00 0.00 179.25 181.22 1ff9 h LEU 62 N 0.88 0.18 -0.70 0.00 5.85 -0.57 -2.84 115.31 118.11 1ff9 h LEU 62 Ca 0.12 -0.18 0.07 0.00 0.84 0.00 0.00 57.88 58.72 1ff9 h LEU 62 Cb 0.78 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 1ff9 h LEU 62 CO 0.06 0.32 0.38 0.44 -0.34 0.00 0.00 178.44 179.30 1ff9 h ASP 63 N 0.03 0.55 -0.52 1.25 3.45 -1.32 -0.02 116.42 119.84 1ff9 h ASP 63 Ca 0.04 0.04 0.03 0.00 0.43 0.00 0.00 57.03 57.57 1ff9 h ASP 63 Cb 0.20 -0.07 -0.04 0.00 -0.56 0.00 0.00 39.33 38.86 1ff9 h ASP 63 CO -0.00 0.34 0.30 0.00 -1.57 0.00 0.00 179.24 178.31 1ff9 h ALA 64 N 1.38 0.67 -0.08 3.45 0.00 -1.40 -1.78 119.26 121.50 1ff9 h ALA 64 Ca 0.32 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.99 1ff9 h ALA 64 Cb 0.24 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1ff9 h ALA 64 CO -0.21 -0.01 -0.89 1.49 0.00 0.00 0.00 179.25 179.64 1ff9 h GLU 65 N 0.59 0.72 -0.93 0.00 4.57 -1.22 -3.25 114.58 115.06 1ff9 h GLU 65 Ca 0.22 -0.66 0.02 0.00 -1.18 0.00 0.00 59.36 57.75 1ff9 h GLU 65 Cb 0.06 0.16 -0.05 0.00 -0.16 0.00 0.00 28.75 28.76 1ff9 h GLU 65 CO -0.11 1.26 0.61 0.28 -1.18 0.00 0.00 179.01 179.87 1ff9 h VAL 66 N 0.46 1.21 0.00 0.32 2.07 -0.85 -2.12 116.25 117.34 1ff9 h VAL 66 Ca -0.08 -0.42 -0.00 0.00 0.82 0.00 0.00 66.70 67.01 1ff9 h VAL 66 Cb 1.52 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 31.17 1ff9 h VAL 66 CO 0.18 0.22 -0.02 0.00 0.02 0.00 0.00 177.57 177.97 1ff9 h ALA 67 N 1.35 1.29 0.00 1.67 0.00 -1.36 -2.04 119.26 120.17 1ff9 h ALA 67 Ca 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1ff9 h ALA 67 Cb -0.09 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1ff9 h ALA 67 CO -0.09 0.02 0.00 1.63 0.00 0.00 0.00 179.25 180.81 1ff9 n LYS 68 N -3.52 0.60 -4.39 0.00 5.02 -0.80 -4.86 118.16 110.20 1ff9 n LYS 68 Ca -0.03 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.07 1ff9 n LYS 68 Cb 0.11 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.52 1ff9 n LYS 68 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1ff9 s HIS 69 N -2.40 1.79 -0.37 2.13 3.76 -0.77 -4.96 115.29 114.47 1ff9 s HIS 69 Ca 0.34 -0.92 0.23 0.00 -0.15 0.00 0.00 55.06 54.57 1ff9 s HIS 69 Cb 0.21 -1.09 0.15 0.00 1.11 0.00 0.00 32.58 32.96 1ff9 s HIS 69 CO 0.43 0.01 1.22 -0.44 -0.85 0.00 0.00 174.74 175.12 1ff9 h ASP 70 N 2.29 0.00 -4.52 1.40 5.19 -1.50 -3.48 116.42 115.80 1ff9 h ASP 70 Ca -0.40 -0.05 -0.05 0.00 -0.62 0.00 0.00 57.03 55.91 1ff9 h ASP 70 Cb 1.23 0.00 -0.20 0.00 0.18 0.00 0.00 39.33 40.54 1ff9 h ASP 70 CO 0.67 0.02 0.15 -0.22 -3.12 0.00 0.00 179.24 176.74 1ff9 s LEU 71 N -5.24 -0.65 -0.12 1.55 2.96 -1.24 -2.80 118.68 113.14 1ff9 s LEU 71 Ca 0.03 1.04 -0.00 0.00 -0.22 0.00 0.00 54.13 54.98 1ff9 s LEU 71 Cb 0.10 2.46 -0.02 0.00 0.50 0.00 0.00 46.19 49.23 1ff9 s LEU 71 CO 0.75 -0.43 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.54 1ff9 s VAL 72 N -0.45 3.22 -0.21 1.68 1.01 -0.54 -1.08 120.40 124.03 1ff9 s VAL 72 Ca -0.06 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 1ff9 s VAL 72 Cb -0.02 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.98 1ff9 s VAL 72 CO 0.06 0.53 0.03 -0.63 0.00 0.00 0.00 175.10 175.08 1ff9 s ILE 73 N 0.19 4.18 -0.39 2.22 1.01 0.12 -2.13 121.20 126.40 1ff9 s ILE 73 Ca -0.07 -0.23 -0.05 0.00 0.00 0.00 0.00 60.65 60.30 1ff9 s ILE 73 Cb -0.15 -2.91 0.09 0.00 0.01 0.00 0.00 42.46 39.50 1ff9 s ILE 73 CO 0.05 0.41 0.18 -0.55 0.00 0.00 0.00 174.94 175.03 1ff9 s SER 74 N 1.06 5.31 0.00 3.58 0.15 -0.47 -0.14 113.70 123.19 1ff9 s SER 74 Ca 0.03 -1.72 0.16 0.00 0.70 0.00 0.00 55.95 55.12 1ff9 s SER 74 Cb -0.14 -1.86 -0.00 0.00 -1.71 0.00 0.00 66.02 62.31 1ff9 s SER 74 CO 0.02 -0.49 0.85 0.18 1.20 0.00 0.00 173.24 175.01 1ff9 n LEU 75 N 4.70 1.62 0.00 3.45 4.77 -0.31 -3.90 117.00 127.34 1ff9 n LEU 75 Ca -0.07 -0.77 -0.06 0.00 -0.03 0.00 0.00 56.01 55.09 1ff9 n LEU 75 Cb 0.42 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.56 1ff9 n LEU 75 CO 0.34 0.31 0.13 2.30 -1.33 0.00 0.00 177.39 179.14 1ff9 n ILE 76 N -0.11 0.00 0.00 -0.08 -5.35 -1.10 -4.91 119.36 107.81 1ff9 n ILE 76 Ca 0.07 -0.11 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1ff9 n ILE 76 Cb 0.34 -1.23 0.00 0.00 -1.74 0.00 0.00 39.64 37.01 1ff9 n ILE 76 CO 0.00 0.00 0.00 -2.65 -1.76 0.00 0.00 176.55 172.14 1ff9 n PRO 77 N -2.01 0.00 -0.73 6.28 -0.02 -1.26 -4.98 135.00 132.27 1ff9 n PRO 77 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 1ff9 n PRO 77 Cb 0.11 -0.42 0.00 0.00 -0.02 0.00 0.00 33.50 33.17 1ff9 n PRO 77 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1ff9 n PHE 80 N -0.11 0.00 0.04 6.00 0.99 -1.26 -5.03 117.46 118.10 1ff9 n PHE 80 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.45 57.34 1ff9 n PHE 80 Cb 0.00 -0.25 -0.04 0.00 -1.00 0.00 0.00 39.48 38.18 1ff9 n PHE 80 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 1ff9 h HIS 81 N 0.00 -0.39 -0.84 1.38 3.86 -2.00 -1.40 115.15 115.77 1ff9 h HIS 81 Ca 0.00 0.02 -0.03 0.00 -1.16 0.00 0.00 60.37 59.20 1ff9 h HIS 81 Cb 0.00 0.18 -0.04 0.00 1.06 0.00 0.00 27.41 28.61 1ff9 h HIS 81 CO 0.00 -0.22 0.41 0.00 0.86 0.00 0.00 177.93 178.97 1ff9 h ALA 82 N 0.72 1.14 -0.55 2.45 0.00 -1.95 -1.14 119.26 119.93 1ff9 h ALA 82 Ca 0.06 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1ff9 h ALA 82 Cb 0.32 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1ff9 h ALA 82 CO -0.17 0.66 0.36 1.15 0.00 0.00 0.00 179.25 181.24 1ff9 h THR 83 N 1.19 1.12 -0.54 0.00 2.02 -1.94 0.88 112.91 115.64 1ff9 h THR 83 Ca 0.29 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 1ff9 h THR 83 Cb 0.11 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 66.83 1ff9 h THR 83 CO -0.04 0.13 0.16 0.58 0.37 0.00 0.00 175.52 176.73 1ff9 h VAL 84 N 0.72 1.24 -0.69 3.16 2.07 -0.83 -2.33 116.25 119.58 1ff9 h VAL 84 Ca 0.21 -0.81 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 1ff9 h VAL 84 Cb -0.06 0.74 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1ff9 h VAL 84 CO -0.06 0.30 0.17 0.40 0.02 0.00 0.00 177.57 178.40 1ff9 h ILE 85 N 0.75 1.26 -0.83 4.57 2.04 -0.70 -1.54 117.51 123.05 1ff9 h ILE 85 Ca 0.17 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 65.05 1ff9 h ILE 85 Cb 0.29 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 36.88 1ff9 h ILE 85 CO -0.00 0.37 0.41 0.11 0.00 0.00 0.00 178.15 179.03 1ff9 h LYS 86 N 1.04 1.19 -0.36 2.37 1.57 -0.60 0.57 116.57 122.35 1ff9 h LYS 86 Ca 0.22 -0.17 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1ff9 h LYS 86 Cb 0.36 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1ff9 h LYS 86 CO 0.00 0.91 0.02 1.03 -0.57 0.00 0.00 179.45 180.85 1ff9 h SER 87 N 1.19 0.60 -0.25 0.86 0.87 -1.12 -1.70 113.55 113.99 1ff9 h SER 87 Ca 0.29 -0.29 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1ff9 h SER 87 Cb 0.10 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 61.89 1ff9 h SER 87 CO -0.04 0.74 0.14 0.00 -0.53 0.00 0.00 176.83 177.14 1ff9 h ALA 88 N 0.88 1.72 -0.25 6.23 0.00 -0.81 -0.61 119.26 126.41 1ff9 h ALA 88 Ca 0.10 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 1ff9 h ALA 88 Cb 0.42 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1ff9 h ALA 88 CO 0.01 0.23 -0.29 0.82 0.00 0.00 0.00 179.25 180.02 1ff9 h ILE 89 N 0.39 1.31 -0.46 0.00 2.04 -0.48 0.25 117.51 120.56 1ff9 h ILE 89 Ca 0.10 -1.47 -0.04 0.00 1.00 0.00 0.00 64.86 64.45 1ff9 h ILE 89 Cb 0.03 1.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.77 1ff9 h ILE 89 CO -0.02 0.46 0.14 0.03 0.00 0.00 0.00 178.15 178.77 1ff9 h ARG 90 N 0.37 0.72 -0.00 2.37 3.08 -0.68 -2.92 114.38 117.32 1ff9 h ARG 90 Ca 0.04 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1ff9 h ARG 90 Cb 0.87 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.81 1ff9 h ARG 90 CO 0.07 0.70 -0.15 1.04 -1.07 0.00 0.00 179.97 180.56 1ff9 n GLN 91 N -4.53 0.18 -3.48 0.04 1.13 -0.30 -4.95 117.38 105.47 1ff9 n GLN 91 Ca 0.01 -0.05 -0.21 0.00 -1.94 0.00 0.00 57.00 54.81 1ff9 n GLN 91 Cb 0.19 -1.50 0.07 0.00 0.11 0.00 0.00 30.24 29.12 1ff9 n GLN 91 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1ff9 n LYS 92 N -1.37 -7.14 -4.24 -1.09 5.02 0.72 -4.91 118.16 105.15 1ff9 n LYS 92 Ca 0.09 0.75 -0.24 0.00 -2.02 0.00 0.00 58.31 56.90 1ff9 n LYS 92 Cb 0.32 -5.57 -0.07 0.00 -0.02 0.00 0.00 35.03 29.69 1ff9 n LYS 92 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1ff9 s LYS 93 N -6.10 2.45 0.79 1.97 -0.14 -0.20 -4.89 119.74 113.61 1ff9 s LYS 93 Ca 0.48 -1.27 -0.12 0.00 -1.36 0.00 0.00 55.97 53.70 1ff9 s LYS 93 Cb -0.21 -2.29 0.07 0.00 -1.68 0.00 0.00 37.83 33.72 1ff9 s LYS 93 CO 0.66 0.39 1.15 -1.01 -0.76 0.00 0.00 175.35 175.78 1ff9 s HIS 94 N -2.15 3.00 -0.00 3.18 3.76 -1.12 -4.60 115.29 117.36 1ff9 s HIS 94 Ca 0.31 0.88 -0.03 0.00 -0.15 0.00 0.00 55.06 56.07 1ff9 s HIS 94 Cb -0.07 -3.34 -0.00 0.00 1.11 0.00 0.00 32.58 30.28 1ff9 s HIS 94 CO 0.21 -1.67 0.05 0.08 -0.85 0.00 0.00 174.74 172.56 1ff9 s VAL 95 N -3.45 0.05 -0.03 -0.90 1.01 0.74 -1.47 120.40 116.36 1ff9 s VAL 95 Ca 0.61 -0.44 0.01 0.00 0.00 0.00 0.00 61.98 62.15 1ff9 s VAL 95 Cb -0.12 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.06 1ff9 s VAL 95 CO 0.51 -0.24 -0.02 -0.69 0.00 0.00 0.00 175.10 174.66 1ff9 s VAL 96 N -0.75 0.28 0.09 2.92 1.01 -0.90 -0.14 120.40 122.91 1ff9 s VAL 96 Ca -0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 61.98 61.88 1ff9 s VAL 96 Cb -0.05 -0.33 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 1ff9 s VAL 96 CO 0.00 0.15 0.00 0.42 0.00 0.00 0.00 175.10 175.67 1ff9 s THR 97 N 0.79 0.24 -0.22 3.92 -4.23 0.72 -1.37 115.64 115.49 1ff9 s THR 97 Ca -0.09 -1.87 0.15 0.00 -1.18 0.00 0.00 61.69 58.70 1ff9 s THR 97 Cb -0.12 -1.77 0.59 0.00 1.34 0.00 0.00 72.50 72.54 1ff9 s THR 97 CO -0.01 -0.75 1.51 0.35 -0.54 0.00 0.00 174.62 175.18 1ff9 n THR 98 N -0.00 2.46 -3.71 3.99 -2.24 -1.25 -2.99 114.28 110.53 1ff9 n THR 98 Ca -0.10 -1.91 -0.21 0.00 -2.27 0.00 0.00 64.05 59.55 1ff9 n THR 98 Cb 0.62 -0.28 -0.04 0.00 -2.10 0.00 0.00 70.33 68.53 1ff9 n THR 98 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ff9 s SER 99 N -1.78 4.98 0.57 3.42 1.04 -1.26 -4.52 113.70 116.14 1ff9 s SER 99 Ca 0.46 -0.75 -0.18 0.00 0.48 0.00 0.00 55.95 55.96 1ff9 s SER 99 Cb 0.37 -0.63 -0.05 0.00 0.10 0.00 0.00 66.02 65.81 1ff9 s SER 99 CO 0.09 -0.57 1.08 -0.31 0.98 0.00 0.00 173.24 174.52 1ff9 s TYR 100 N -2.46 2.84 -0.34 5.02 2.02 -1.26 -0.86 117.35 122.31 1ff9 s TYR 100 Ca 0.45 1.54 -0.29 0.00 -0.37 0.00 0.00 57.07 58.41 1ff9 s TYR 100 Cb -0.03 -3.13 0.02 0.00 -0.40 0.00 0.00 41.96 38.43 1ff9 s TYR 100 CO 0.27 -1.28 1.10 0.08 -1.57 0.00 0.00 175.55 174.15 1ff9 s VAL 101 N -2.14 4.44 0.56 0.71 1.01 -1.26 -4.90 120.40 118.81 1ff9 s VAL 101 Ca 0.67 1.64 0.01 0.00 0.00 0.00 0.00 61.98 64.31 1ff9 s VAL 101 Cb -0.19 -4.42 0.03 0.00 0.00 0.00 0.00 36.38 31.80 1ff9 s VAL 101 CO 0.31 -0.55 0.78 -0.94 0.00 0.00 0.00 175.10 174.70 1ff9 s SER 102 N 1.84 5.26 0.30 3.32 1.04 -1.26 -4.90 113.70 119.31 1ff9 s SER 102 Ca 0.47 -0.00 -0.02 0.00 0.48 0.00 0.00 55.95 56.88 1ff9 s SER 102 Cb -0.12 -0.88 0.46 0.00 0.10 0.00 0.00 66.02 65.59 1ff9 s SER 102 CO 0.18 -1.16 1.97 -0.65 0.98 0.00 0.00 173.24 174.56 1ff9 h PRO 103 N 0.05 1.06 -0.11 4.02 0.11 -1.99 -0.27 132.00 134.88 1ff9 h PRO 103 Ca -0.42 -0.06 -0.11 0.00 0.11 0.00 0.00 66.00 65.51 1ff9 h PRO 103 Cb 1.30 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1ff9 h PRO 103 CO 0.52 0.70 -0.44 0.00 -0.21 0.00 0.00 178.00 178.57 1ff9 h ALA 104 N 1.50 1.05 -0.12 -0.75 0.00 -1.99 -1.26 119.26 117.68 1ff9 h ALA 104 Ca 0.30 -0.44 -0.08 0.00 0.00 0.00 0.00 54.91 54.69 1ff9 h ALA 104 Cb -0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1ff9 h ALA 104 CO -0.07 0.62 -0.23 0.52 0.00 0.00 0.00 179.25 180.09 1ff9 h MET 105 N 0.21 0.37 -0.18 0.00 2.86 -1.76 -3.14 114.93 113.29 1ff9 h MET 105 Ca 0.02 -0.24 -0.03 0.00 -2.06 0.00 0.00 59.70 57.39 1ff9 h MET 105 Cb 0.87 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.55 1ff9 h MET 105 CO 0.07 0.83 -0.02 0.52 1.06 0.00 0.00 176.91 179.38 1ff9 h MET 106 N -0.04 0.27 -0.02 1.72 2.86 -0.96 -1.71 114.93 117.05 1ff9 h MET 106 Ca 0.01 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1ff9 h MET 106 Cb 0.82 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.43 1ff9 h MET 106 CO 0.05 0.31 0.02 1.49 1.06 0.00 0.00 176.91 179.85 1ff9 h GLU 107 N 0.26 0.00 -0.14 1.72 4.22 -1.18 -0.68 114.58 118.78 1ff9 h GLU 107 Ca 0.06 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.50 1ff9 h GLU 107 Cb 0.21 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1ff9 h GLU 107 CO 0.01 0.00 0.00 1.28 -2.18 0.00 0.00 179.01 178.12 1ff9 n LEU 108 N -3.87 1.87 -0.03 1.64 4.77 -0.64 -4.45 117.00 116.28 1ff9 n LEU 108 Ca -0.02 -0.74 -0.09 0.00 -0.03 0.00 0.00 56.01 55.13 1ff9 n LEU 108 Cb 0.11 -0.08 -0.02 0.00 -2.33 0.00 0.00 43.42 41.09 1ff9 n LEU 108 CO 0.28 0.37 0.68 -0.78 -1.33 0.00 0.00 177.39 176.61 1ff9 h ASP 109 N 2.62 -0.83 -0.78 -1.43 -0.00 -1.17 0.93 116.42 115.75 1ff9 h ASP 109 Ca 0.00 0.14 -0.04 0.00 -0.00 0.00 0.00 57.03 57.13 1ff9 h ASP 109 Cb 0.57 0.38 -0.03 0.00 -0.00 0.00 0.00 39.33 40.24 1ff9 h ASP 109 CO 0.00 -0.30 0.32 -0.61 -0.00 0.00 0.00 179.24 178.66 1ff9 h GLN 110 N -0.29 1.16 -0.41 0.28 5.75 -1.81 -1.63 115.11 118.16 1ff9 h GLN 110 Ca 0.12 -0.20 -0.08 0.00 -0.15 0.00 0.00 58.65 58.34 1ff9 h GLN 110 Cb 0.48 -0.19 -0.02 0.00 1.07 0.00 0.00 27.48 28.82 1ff9 h GLN 110 CO -0.37 0.94 -0.07 0.00 -2.65 0.00 0.00 178.83 176.67 1ff9 h ALA 111 N 1.17 1.12 -0.27 3.38 0.00 -1.75 -1.51 119.26 121.40 1ff9 h ALA 111 Ca 0.26 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1ff9 h ALA 111 Cb 0.20 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ff9 h ALA 111 CO -0.02 0.55 0.09 0.00 0.00 0.00 0.00 179.25 179.87 1ff9 h ALA 112 N 1.29 0.35 -0.58 0.00 0.00 -0.37 -2.13 119.26 117.81 1ff9 h ALA 112 Ca 0.12 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1ff9 h ALA 112 Cb 0.50 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 1ff9 h ALA 112 CO 0.03 -0.02 0.30 0.87 0.00 0.00 0.00 179.25 180.42 1ff9 h LYS 113 N 0.27 0.81 0.00 0.00 1.57 -1.05 -1.84 116.57 116.34 1ff9 h LYS 113 Ca 0.09 -0.09 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 1ff9 h LYS 113 Cb 0.23 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1ff9 h LYS 113 CO -0.00 0.61 -0.41 -0.44 -0.57 0.00 0.00 179.45 178.64 1ff9 h ASP 114 N 0.81 0.00 0.21 0.86 3.32 -1.04 -2.19 116.42 118.39 1ff9 h ASP 114 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1ff9 h ASP 114 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1ff9 h ASP 114 CO -0.03 0.41 -0.13 0.00 -1.72 0.00 0.00 179.24 177.77 1ff9 n ALA 115 N -2.36 2.83 -2.70 3.45 0.00 -0.82 -4.94 120.51 115.97 1ff9 n ALA 115 Ca -0.01 -0.35 -0.15 0.00 0.00 0.00 0.00 53.44 52.93 1ff9 n ALA 115 Cb 0.49 -1.24 0.02 0.00 0.00 0.00 0.00 19.45 18.73 1ff9 n ALA 115 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ff9 n GLY 116 N 1.26 -0.13 3.60 0.00 0.00 -0.76 -4.82 105.19 104.33 1ff9 n GLY 116 Ca 0.15 -0.19 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 1ff9 n GLY 116 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ff9 s ILE 117 N -2.93 3.07 -0.13 -0.61 -4.36 -0.79 -5.01 121.20 110.43 1ff9 s ILE 117 Ca 0.18 -2.05 -0.03 0.00 -0.26 0.00 0.00 60.65 58.48 1ff9 s ILE 117 Cb -0.08 -2.69 -0.03 0.00 1.25 0.00 0.00 42.46 40.91 1ff9 s ILE 117 CO 0.22 -0.35 -0.02 -0.89 0.24 0.00 0.00 174.94 174.13 1ff9 s THR 118 N -2.40 4.05 -0.42 8.37 2.01 -1.26 -0.76 115.64 125.22 1ff9 s THR 118 Ca 0.32 -0.32 0.03 0.00 0.31 0.00 0.00 61.69 62.03 1ff9 s THR 118 Cb -0.05 -2.75 0.12 0.00 0.01 0.00 0.00 72.50 69.82 1ff9 s THR 118 CO 0.19 0.52 0.17 -0.69 -0.69 0.00 0.00 174.62 174.12 1ff9 s VAL 119 N -0.01 2.11 -0.34 3.82 1.01 0.24 -0.18 120.40 127.05 1ff9 s VAL 119 Ca 0.02 -2.67 -0.20 0.00 0.00 0.00 0.00 61.98 59.13 1ff9 s VAL 119 Cb -0.13 -2.51 -0.00 0.00 0.00 0.00 0.00 36.38 33.73 1ff9 s VAL 119 CO 0.02 -0.74 0.60 -0.04 0.00 0.00 0.00 175.10 174.95 1ff9 s MET 120 N 0.41 3.72 0.54 2.72 -1.94 0.81 -0.22 119.30 125.34 1ff9 s MET 120 Ca 0.14 0.05 0.02 0.00 -1.71 0.00 0.00 55.69 54.20 1ff9 s MET 120 Cb -0.23 -3.79 0.02 0.00 2.01 0.00 0.00 34.83 32.85 1ff9 s MET 120 CO -0.05 -0.67 0.17 0.09 -0.01 0.00 0.00 175.02 174.55 1ff9 n ASN 121 N 5.92 3.21 -3.94 3.03 3.02 -0.40 -0.20 115.26 125.89 1ff9 n ASN 121 Ca -0.02 -3.17 -0.27 0.00 -0.03 0.00 0.00 54.58 51.09 1ff9 n ASN 121 Cb 0.49 0.21 -0.00 0.00 -0.61 0.00 0.00 39.78 39.86 1ff9 n ASN 121 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ff9 n GLU 122 N -1.52 -3.98 -2.70 3.52 1.02 -0.04 -4.20 120.64 112.75 1ff9 n GLU 122 Ca -0.14 0.48 -0.21 0.00 -0.02 0.00 0.00 57.16 57.27 1ff9 n GLU 122 Cb 0.66 -4.92 -0.00 0.00 -0.02 0.00 0.00 31.44 27.16 1ff9 n GLU 122 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 1ff9 n ILE 123 N -4.42 1.81 0.00 -3.67 0.13 -1.23 -2.83 119.36 109.15 1ff9 n ILE 123 Ca -0.18 -4.49 0.00 0.00 -1.10 0.00 0.00 62.75 56.98 1ff9 n ILE 123 Cb 0.62 -0.63 0.00 0.00 -0.84 0.00 0.00 39.64 38.79 1ff9 n ILE 123 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1ff9 n GLY 124 N -0.23 2.35 0.09 4.50 0.00 0.43 -2.41 105.19 109.92 1ff9 n GLY 124 Ca 0.28 -0.58 -0.15 0.00 0.00 0.00 0.00 46.02 45.56 1ff9 n GLY 124 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1ff9 n LEU 125 N 0.00 1.86 -3.30 0.99 7.94 -1.16 -1.97 117.00 121.36 1ff9 n LEU 125 Ca 0.00 0.48 -0.08 0.00 -1.11 0.00 0.00 56.01 55.30 1ff9 n LEU 125 Cb 0.00 -0.89 -0.06 0.00 0.53 0.00 0.00 43.42 43.00 1ff9 n LEU 125 CO 0.00 -0.03 -0.06 -0.62 -1.11 0.00 0.00 177.39 175.58 1ff9 s ASP 126 N -6.42 0.25 0.37 1.96 2.15 -1.26 -1.74 116.67 111.99 1ff9 s ASP 126 Ca -0.25 -0.25 -0.26 0.00 0.43 0.00 0.00 52.55 52.21 1ff9 s ASP 126 Cb 0.05 1.16 -0.09 0.00 -0.30 0.00 0.00 42.92 43.75 1ff9 s ASP 126 CO 0.42 -0.34 1.19 -2.16 -0.17 0.00 0.00 175.17 174.11 1ff9 s PRO 127 N 2.56 4.19 0.00 4.34 0.04 -1.26 -5.08 135.00 139.78 1ff9 s PRO 127 Ca 0.10 1.91 0.00 0.00 0.04 0.00 0.00 61.00 63.05 1ff9 s PRO 127 Cb -0.13 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.59 1ff9 s PRO 127 CO -0.28 -0.22 0.00 0.41 0.04 0.00 0.00 177.00 176.95 1ff9 n GLY 128 N 0.74 -0.05 0.31 0.56 0.00 -1.13 -0.43 105.19 105.20 1ff9 n GLY 128 Ca 0.03 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.14 1ff9 n GLY 128 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ff9 h ILE 129 N 0.00 0.60 -0.84 -0.61 2.04 -0.68 0.12 117.51 118.15 1ff9 h ILE 129 Ca 0.00 -0.18 0.07 0.00 1.00 0.00 0.00 64.86 65.75 1ff9 h ILE 129 Cb 0.00 0.03 -0.06 0.00 -0.74 0.00 0.00 36.82 36.05 1ff9 h ILE 129 CO 0.00 0.10 0.51 -2.24 0.00 0.00 0.00 178.15 176.51 1ff9 h ASP 130 N 0.52 0.78 -0.42 1.72 2.03 -1.73 -2.09 116.42 117.23 1ff9 h ASP 130 Ca 0.52 0.02 -0.01 0.00 -0.73 0.00 0.00 57.03 56.84 1ff9 h ASP 130 Cb 0.89 -0.14 -0.02 0.00 -0.83 0.00 0.00 39.33 39.23 1ff9 h ASP 130 CO -0.45 0.49 0.24 0.45 -1.03 0.00 0.00 179.24 178.94 1ff9 h HIS 131 N 0.91 0.57 -0.45 4.15 3.86 -1.28 -1.38 115.15 121.53 1ff9 h HIS 131 Ca 0.37 -0.01 0.06 0.00 -1.16 0.00 0.00 60.37 59.63 1ff9 h HIS 131 Cb 0.21 -0.18 -0.05 0.00 1.06 0.00 0.00 27.41 28.45 1ff9 h HIS 131 CO -0.04 0.43 0.16 -0.07 0.86 0.00 0.00 177.93 179.27 1ff9 h LEU 132 N 0.55 0.17 0.00 2.43 3.38 -0.98 -1.82 115.31 119.04 1ff9 h LEU 132 Ca 0.15 0.05 -0.06 0.00 0.09 0.00 0.00 57.88 58.11 1ff9 h LEU 132 Cb 0.04 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1ff9 h LEU 132 CO -0.03 0.13 -0.56 1.88 0.09 0.00 0.00 178.44 179.96 1ff9 h TYR 133 N 0.34 0.00 -0.21 1.13 -1.99 -1.40 -1.66 116.97 113.18 1ff9 h TYR 133 Ca 0.21 0.00 -0.10 0.00 2.00 0.00 0.00 58.73 60.85 1ff9 h TYR 133 Cb 0.21 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.94 1ff9 h TYR 133 CO -0.15 0.27 -0.24 0.00 -0.00 0.00 0.00 178.16 178.04 1ff9 h ALA 134 N 1.73 0.31 -0.28 3.88 0.00 -1.08 -2.55 119.26 121.27 1ff9 h ALA 134 Ca -0.03 -0.38 -0.16 0.00 0.00 0.00 0.00 54.91 54.34 1ff9 h ALA 134 Cb 1.23 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1ff9 h ALA 134 CO 0.03 0.28 -0.48 0.82 0.00 0.00 0.00 179.25 179.90 1ff9 h ILE 135 N 0.20 1.29 -0.31 0.00 2.04 -1.39 -1.55 117.51 117.80 1ff9 h ILE 135 Ca 0.03 -1.68 0.03 0.00 1.00 0.00 0.00 64.86 64.24 1ff9 h ILE 135 Cb 0.80 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.45 1ff9 h ILE 135 CO 0.06 0.54 0.14 0.50 0.00 0.00 0.00 178.15 179.39 1ff9 h LYS 136 N 0.59 0.29 -0.29 2.37 3.64 -1.29 -1.54 116.57 120.33 1ff9 h LYS 136 Ca 0.03 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.33 1ff9 h LYS 136 Cb 1.05 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.79 1ff9 h LYS 136 CO 0.10 0.19 -0.07 1.15 -2.27 0.00 0.00 179.45 178.55 1ff9 h THR 137 N 0.29 1.28 -0.67 1.00 2.02 -1.41 -2.00 112.91 113.43 1ff9 h THR 137 Ca 0.13 -1.10 0.04 0.00 0.77 0.00 0.00 66.41 66.25 1ff9 h THR 137 Cb 0.07 1.40 -0.05 0.00 -1.74 0.00 0.00 68.15 67.83 1ff9 h THR 137 CO -0.11 0.35 0.41 0.40 0.37 0.00 0.00 175.52 176.94 1ff9 h ILE 138 N 0.33 1.06 -0.33 3.11 2.04 -1.14 -0.35 117.51 122.24 1ff9 h ILE 138 Ca 0.07 -0.27 -0.11 0.00 1.00 0.00 0.00 64.86 65.56 1ff9 h ILE 138 Cb 0.55 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1ff9 h ILE 138 CO 0.03 0.15 -0.23 -0.33 0.00 0.00 0.00 178.15 177.76 1ff9 h GLU 139 N 0.79 0.64 0.07 2.37 5.08 -1.22 -0.06 114.58 122.25 1ff9 h GLU 139 Ca 0.28 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1ff9 h GLU 139 Cb 0.06 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1ff9 h GLU 139 CO -0.12 0.82 -0.03 0.93 -1.00 0.00 0.00 179.01 179.61 1ff9 h GLU 140 N 0.56 -0.09 0.25 2.33 5.08 -0.63 0.19 114.58 122.27 1ff9 h GLU 140 Ca 0.08 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 1ff9 h GLU 140 Cb 0.70 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 1ff9 h GLU 140 CO 0.05 0.01 -0.37 0.28 -1.00 0.00 0.00 179.01 177.98 1ff9 h VAL 141 N -0.16 0.25 -0.99 3.13 2.07 -0.84 -1.74 116.25 117.96 1ff9 h VAL 141 Ca -0.01 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.62 1ff9 h VAL 141 Cb 0.14 0.25 -0.08 0.00 -1.52 0.00 0.00 31.29 30.07 1ff9 h VAL 141 CO 0.02 0.00 0.62 0.45 0.02 0.00 0.00 177.57 178.68 1ff9 h HIS 142 N -0.68 1.14 -0.72 1.57 3.86 -0.91 0.84 115.15 120.25 1ff9 h HIS 142 Ca -0.00 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.28 1ff9 h HIS 142 Cb 0.65 -0.36 -0.04 0.00 1.06 0.00 0.00 27.41 28.72 1ff9 h HIS 142 CO -0.26 0.48 0.47 0.00 0.86 0.00 0.00 177.93 179.48 1ff9 h ALA 143 N 1.51 1.61 -0.03 2.45 0.00 -0.04 0.27 119.26 125.03 1ff9 h ALA 143 Ca 0.48 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.35 1ff9 h ALA 143 Cb 0.41 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ff9 h ALA 143 CO -0.24 0.31 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1ff9 n ALA 144 N -2.44 2.58 -1.11 0.00 0.00 0.16 -4.87 120.51 114.84 1ff9 n ALA 144 Ca 0.09 -0.17 -0.04 0.00 0.00 0.00 0.00 53.44 53.32 1ff9 n ALA 144 Cb 0.14 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.35 1ff9 n ALA 144 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ff9 n GLY 145 N 0.81 0.66 3.94 0.00 0.00 0.96 -4.52 105.19 107.04 1ff9 n GLY 145 Ca 0.13 -0.84 -0.25 0.00 0.00 0.00 0.00 46.02 45.06 1ff9 n GLY 145 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ff9 s GLY 146 N -2.90 1.69 -0.08 -0.02 0.00 -0.44 -4.09 107.32 101.48 1ff9 s GLY 146 Ca 0.00 -0.97 0.05 0.00 0.00 0.00 0.00 44.72 43.80 1ff9 s GLY 146 CO 0.00 -0.63 -0.24 0.54 0.00 0.00 0.00 173.10 172.78 1ff9 s LYS 147 N -5.05 2.78 -0.69 2.90 -0.14 -0.49 -4.24 119.74 114.82 1ff9 s LYS 147 Ca 0.57 -0.86 -0.22 0.00 -1.36 0.00 0.00 55.97 54.11 1ff9 s LYS 147 Cb -0.11 -2.19 0.08 0.00 -1.68 0.00 0.00 37.83 33.93 1ff9 s LYS 147 CO 0.43 0.24 0.96 0.42 -0.76 0.00 0.00 175.35 176.65 1ff9 s ILE 148 N 0.18 4.41 0.06 2.17 -1.09 -1.26 -1.88 121.20 123.79 1ff9 s ILE 148 Ca -0.13 -0.55 0.08 0.00 -2.23 0.00 0.00 60.65 57.82 1ff9 s ILE 148 Cb -0.16 -4.68 -0.22 0.00 -1.58 0.00 0.00 42.46 35.81 1ff9 s ILE 148 CO 0.07 -1.44 1.05 0.11 -1.23 0.00 0.00 174.94 173.50 1ff9 h LYS 149 N 9.46 0.01 -3.58 2.79 1.79 -1.61 -2.67 116.57 122.77 1ff9 h LYS 149 Ca -0.24 -0.03 -0.24 0.00 -2.18 0.00 0.00 60.65 57.97 1ff9 h LYS 149 Cb 1.07 0.01 -0.29 0.00 -1.58 0.00 0.00 32.23 31.43 1ff9 h LYS 149 CO 1.17 0.84 -0.67 0.95 -1.08 0.00 0.00 179.45 180.65 1ff9 s THR 150 N -2.67 -0.01 -0.11 -0.16 -4.23 -1.15 -0.74 115.64 106.57 1ff9 s THR 150 Ca -0.01 0.05 -0.00 0.00 -1.18 0.00 0.00 61.69 60.55 1ff9 s THR 150 Cb 0.09 -0.09 0.02 0.00 1.34 0.00 0.00 72.50 73.87 1ff9 s THR 150 CO 0.82 0.02 -0.07 0.12 -0.54 0.00 0.00 174.62 174.98 1ff9 s PHE 151 N 0.31 1.39 0.01 3.99 2.19 0.78 -1.97 117.98 124.68 1ff9 s PHE 151 Ca -0.02 -0.67 0.06 0.00 0.33 0.00 0.00 56.93 56.63 1ff9 s PHE 151 Cb -0.04 -1.18 -0.02 0.00 -1.31 0.00 0.00 43.02 40.48 1ff9 s PHE 151 CO -0.01 -0.49 -0.18 -0.51 1.83 0.00 0.00 175.22 175.86 1ff9 s LEU 152 N 1.72 2.09 -0.09 6.12 1.43 0.10 -1.51 118.68 128.53 1ff9 s LEU 152 Ca 0.05 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 52.70 1ff9 s LEU 152 Cb -0.13 -0.90 0.05 0.00 0.03 0.00 0.00 46.19 45.24 1ff9 s LEU 152 CO -0.08 0.18 0.19 -0.55 0.23 0.00 0.00 176.35 176.32 1ff9 s SER 153 N -0.75 0.35 0.02 2.29 0.15 -0.02 0.66 113.70 116.40 1ff9 s SER 153 Ca 0.06 0.41 0.05 0.00 0.70 0.00 0.00 55.95 57.17 1ff9 s SER 153 Cb -0.08 0.37 -0.02 0.00 -1.71 0.00 0.00 66.02 64.58 1ff9 s SER 153 CO 0.00 -0.21 -0.14 -0.31 1.20 0.00 0.00 173.24 173.78 1ff9 s TYR 154 N 1.96 1.25 -0.03 3.44 1.51 -0.78 -0.05 117.35 124.64 1ff9 s TYR 154 Ca -0.01 -0.30 -0.11 0.00 -1.01 0.00 0.00 57.07 55.63 1ff9 s TYR 154 Cb -0.12 -0.77 0.02 0.00 -0.11 0.00 0.00 41.96 40.98 1ff9 s TYR 154 CO -0.07 0.01 0.26 0.00 -1.11 0.00 0.00 175.55 174.64 1ff9 s GLY 156 N -0.96 -0.48 -0.45 0.00 0.00 -0.46 -1.55 107.32 103.42 1ff9 s GLY 156 Ca -0.10 1.83 -0.14 0.00 0.00 0.00 0.00 44.72 46.31 1ff9 s GLY 156 CO 0.03 1.66 0.35 -0.32 0.00 0.00 0.00 173.10 174.82 1ff9 s GLY 157 N 0.63 2.02 0.34 0.20 0.00 -1.26 -2.27 107.32 106.98 1ff9 s GLY 157 Ca -0.02 -2.06 0.03 0.00 0.00 0.00 0.00 44.72 42.67 1ff9 s GLY 157 CO -0.04 1.01 0.11 1.08 0.00 0.00 0.00 173.10 175.26 1ff9 s LEU 158 N 1.60 1.95 0.43 0.66 1.43 0.64 -4.91 118.68 120.48 1ff9 s LEU 158 Ca 0.04 -1.51 -0.23 0.00 -1.03 0.00 0.00 54.13 51.39 1ff9 s LEU 158 Cb -0.23 -0.13 -0.08 0.00 0.03 0.00 0.00 46.19 45.78 1ff9 s LEU 158 CO 0.06 -0.79 1.09 -2.84 0.23 0.00 0.00 176.35 174.10 1ff9 s PRO 159 N -3.84 3.97 0.69 1.29 0.02 -1.26 -0.24 135.00 135.63 1ff9 s PRO 159 Ca 0.32 1.58 -0.16 0.00 0.02 0.00 0.00 61.00 62.75 1ff9 s PRO 159 Cb 0.06 -2.43 0.01 0.00 0.02 0.00 0.00 34.50 32.16 1ff9 s PRO 159 CO 0.15 -0.32 1.24 0.00 -0.33 0.00 0.00 177.00 177.74 1ff9 s ALA 160 N -1.67 2.24 0.25 -1.55 0.00 -0.72 -4.64 121.76 115.67 1ff9 s ALA 160 Ca 0.61 1.03 -0.05 0.00 0.00 0.00 0.00 51.96 53.55 1ff9 s ALA 160 Cb -0.23 -3.51 0.47 0.00 0.00 0.00 0.00 23.12 19.85 1ff9 s ALA 160 CO 0.29 -1.73 1.67 -1.35 0.00 0.00 0.00 175.76 174.64 1ff9 h PRO 161 N 0.12 0.21 -0.95 0.00 0.11 -1.93 -0.93 132.00 128.64 1ff9 h PRO 161 Ca -0.49 -0.01 0.29 0.00 0.11 0.00 0.00 66.00 65.89 1ff9 h PRO 161 Cb 1.31 -0.05 -0.17 0.00 0.11 0.00 0.00 31.00 32.21 1ff9 h PRO 161 CO 0.51 0.14 0.22 1.05 -0.21 0.00 0.00 178.00 179.72 1ff9 h GLU 162 N 0.22 0.09 -0.61 1.05 4.11 -1.96 -0.49 114.58 116.98 1ff9 h GLU 162 Ca 0.42 -0.01 -0.40 0.00 0.07 0.00 0.00 59.36 59.45 1ff9 h GLU 162 Cb 0.74 -0.02 -0.24 0.00 0.50 0.00 0.00 28.75 29.72 1ff9 h GLU 162 CO -0.55 0.06 -0.10 0.43 0.07 0.00 0.00 179.01 178.92 1ff9 n SER 163 N -5.33 4.22 -1.06 3.06 7.64 -0.38 -4.66 113.62 117.10 1ff9 n SER 163 Ca 0.26 -3.78 0.12 0.00 1.01 0.00 0.00 58.87 56.48 1ff9 n SER 163 Cb 0.85 -0.62 0.17 0.00 -1.01 0.00 0.00 64.21 63.59 1ff9 n SER 163 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1ff9 n SER 164 N -0.97 3.26 -3.59 6.43 3.41 -0.19 -4.74 113.62 117.23 1ff9 n SER 164 Ca 0.43 -1.98 -0.41 0.00 -0.26 0.00 0.00 58.87 56.65 1ff9 n SER 164 Cb 0.97 -0.15 -0.04 0.00 -0.26 0.00 0.00 64.21 64.73 1ff9 n SER 164 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1ff9 n ASP 165 N 1.42 3.26 -4.16 4.04 2.03 -1.26 -3.91 116.55 117.97 1ff9 n ASP 165 Ca 0.17 -2.67 -0.10 0.00 0.52 0.00 0.00 54.79 52.71 1ff9 n ASP 165 Cb 0.60 -1.24 -0.10 0.00 -0.72 0.00 0.00 41.12 39.65 1ff9 n ASP 165 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1ff9 s ASN 166 N 4.34 0.54 0.51 1.67 6.03 -1.26 -5.02 114.94 121.75 1ff9 s ASN 166 Ca 0.53 -1.18 0.38 0.00 -1.03 0.00 0.00 52.86 51.57 1ff9 s ASN 166 Cb 0.14 0.24 1.54 0.00 -3.03 0.00 0.00 41.25 40.14 1ff9 s ASN 166 CO 0.05 -0.68 1.68 -0.65 -2.03 0.00 0.00 177.10 175.47 1ff9 h PRO 167 N 2.86 0.06 -0.01 3.55 0.11 -1.87 -1.68 132.00 135.01 1ff9 h PRO 167 Ca -0.35 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1ff9 h PRO 167 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ff9 h PRO 167 CO 0.61 0.04 -0.17 1.28 -0.21 0.00 0.00 178.00 179.55 1ff9 n LEU 168 N -4.28 1.56 -3.56 2.35 4.77 -1.26 -4.68 117.00 111.90 1ff9 n LEU 168 Ca 0.35 -0.84 -0.26 0.00 -0.03 0.00 0.00 56.01 55.23 1ff9 n LEU 168 Cb 1.52 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 42.64 1ff9 n LEU 168 CO 0.35 0.30 0.09 0.61 -1.33 0.00 0.00 177.39 177.41 1ff9 n GLY 169 N 0.88 -0.51 3.14 -0.72 0.00 -0.63 -4.47 105.19 102.87 1ff9 n GLY 169 Ca 0.06 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.13 1ff9 n GLY 169 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ff9 s TYR 170 N -3.21 -0.17 -0.08 1.61 5.04 -1.26 -4.56 117.35 114.71 1ff9 s TYR 170 Ca 0.53 0.37 0.03 0.00 -2.44 0.00 0.00 57.07 55.55 1ff9 s TYR 170 Cb -0.25 0.05 0.01 0.00 0.35 0.00 0.00 41.96 42.12 1ff9 s TYR 170 CO 0.65 -0.21 -0.16 0.15 -1.34 0.00 0.00 175.55 174.63 1ff9 s LYS 171 N -0.53 2.21 0.01 4.97 -0.14 -1.26 -4.88 119.74 120.11 1ff9 s LYS 171 Ca -0.06 -0.59 -0.24 0.00 -1.36 0.00 0.00 55.97 53.72 1ff9 s LYS 171 Cb -0.04 -1.76 -0.05 0.00 -1.68 0.00 0.00 37.83 34.30 1ff9 s LYS 171 CO 0.01 0.07 0.73 -0.06 -0.76 0.00 0.00 175.35 175.34 1ff9 s PHE 172 N 0.60 3.68 -0.19 3.18 0.40 0.29 -4.88 117.98 121.07 1ff9 s PHE 172 Ca -0.15 1.38 0.03 0.00 -0.60 0.00 0.00 56.93 57.59 1ff9 s PHE 172 Cb -0.16 -2.79 -0.13 0.00 0.51 0.00 0.00 43.02 40.44 1ff9 s PHE 172 CO 0.05 0.23 -0.15 0.43 0.70 0.00 0.00 175.22 176.48 1ff9 n SER 173 N 3.09 2.38 -4.76 1.36 7.64 -1.26 -4.49 113.62 117.58 1ff9 n SER 173 Ca -0.02 -0.09 -0.24 0.00 1.01 0.00 0.00 58.87 59.53 1ff9 n SER 173 Cb 0.51 -0.19 -0.06 0.00 -1.01 0.00 0.00 64.21 63.45 1ff9 n SER 173 CO 0.00 0.00 0.00 -1.66 -3.01 0.00 0.00 175.04 170.37 1ff9 s TRP 174 N -2.38 2.65 -0.22 1.43 1.48 -1.26 -5.03 118.94 115.60 1ff9 s TRP 174 Ca -0.24 -0.52 -0.43 0.00 -1.06 0.00 0.00 56.10 53.85 1ff9 s TRP 174 Cb 0.06 -1.91 -0.20 0.00 -1.16 0.00 0.00 33.47 30.27 1ff9 s TRP 174 CO 0.46 0.18 1.32 -1.13 -4.06 0.00 0.00 176.95 173.72 1ff9 n SER 175 N -1.26 0.60 0.20 -2.66 3.41 -1.26 -4.83 113.62 107.81 1ff9 n SER 175 Ca -0.01 1.17 0.06 0.00 -0.26 0.00 0.00 58.87 59.83 1ff9 n SER 175 Cb 0.63 -0.91 0.40 0.00 -0.26 0.00 0.00 64.21 64.08 1ff9 n SER 175 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1ff9 h SER 176 N 3.98 0.00 -0.84 4.04 4.64 -1.97 -2.60 113.55 120.80 1ff9 h SER 176 Ca -0.48 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.83 1ff9 h SER 176 Cb 1.40 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.45 1ff9 h SER 176 CO 0.80 0.34 0.48 -0.09 -0.87 0.00 0.00 176.83 177.49 1ff9 h ARG 177 N 0.00 1.16 -0.13 4.77 2.43 -1.92 -0.14 114.38 120.55 1ff9 h ARG 177 Ca -0.00 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 1ff9 h ARG 177 Cb 0.74 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1ff9 h ARG 177 CO 0.04 0.84 0.03 0.78 -1.51 0.00 0.00 179.97 180.15 1ff9 h GLY 178 N 1.16 0.23 0.61 2.80 0.00 -1.83 -1.05 103.07 104.99 1ff9 h GLY 178 Ca 0.30 -0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.50 1ff9 h GLY 178 CO -0.05 0.14 -0.20 -2.08 0.00 0.00 0.00 176.54 174.34 1ff9 h VAL 179 N -0.00 0.54 -0.29 4.60 2.07 -1.32 -0.36 116.25 121.49 1ff9 h VAL 179 Ca 0.04 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.57 1ff9 h VAL 179 Cb 0.28 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.57 1ff9 h VAL 179 CO 0.00 0.00 0.17 -0.07 0.02 0.00 0.00 177.57 177.70 1ff9 h LEU 180 N -0.36 0.29 -1.34 2.57 3.38 -1.00 -2.60 115.31 116.25 1ff9 h LEU 180 Ca 0.04 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.95 1ff9 h LEU 180 Cb 0.40 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1ff9 h LEU 180 CO -0.14 0.21 -0.18 -0.07 0.09 0.00 0.00 178.44 178.35 1ff9 h LEU 181 N 0.36 0.21 -2.18 1.67 3.38 -1.02 -2.41 115.31 115.31 1ff9 h LEU 181 Ca 0.11 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1ff9 h LEU 181 Cb -0.01 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 40.68 1ff9 h LEU 181 CO -0.04 0.41 -0.02 0.00 0.09 0.00 0.00 178.44 178.87 1ff9 h ALA 182 N 1.61 1.71 0.00 1.53 0.00 -0.65 -0.11 119.26 123.35 1ff9 h ALA 182 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ff9 h ALA 182 Cb 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1ff9 h ALA 182 CO 0.03 0.03 0.00 1.28 0.00 0.00 0.00 179.25 180.59 1ff9 n LEU 183 N -4.15 0.00 0.08 0.00 4.77 -0.91 -1.03 117.00 115.76 1ff9 n LEU 183 Ca -0.03 0.24 0.12 0.00 -0.03 0.00 0.00 56.01 56.30 1ff9 n LEU 183 Cb 0.11 -0.24 0.05 0.00 -2.33 0.00 0.00 43.42 41.01 1ff9 n LEU 183 CO 0.31 -0.15 0.09 0.54 -1.33 0.00 0.00 177.39 176.85 1ff9 n ARG 184 N -1.24 0.47 -2.13 3.23 1.74 -0.05 -4.27 116.66 114.42 1ff9 n ARG 184 Ca 0.06 0.09 -0.38 0.00 -0.77 0.00 0.00 57.85 56.84 1ff9 n ARG 184 Cb 0.08 -1.75 -0.00 0.00 -1.02 0.00 0.00 32.46 29.76 1ff9 n ARG 184 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1ff9 s ASN 185 N -4.82 6.21 0.35 0.55 0.01 -0.20 -4.37 114.94 112.67 1ff9 s ASN 185 Ca 0.02 2.51 -0.24 0.00 -0.71 0.00 0.00 52.86 54.44 1ff9 s ASN 185 Cb 0.11 -2.62 -0.10 0.00 0.41 0.00 0.00 41.25 39.05 1ff9 s ASN 185 CO 0.78 -0.90 0.93 0.00 -1.51 0.00 0.00 177.10 176.39 1ff9 s ALA 186 N -1.36 3.17 -0.05 0.60 0.00 -1.26 -4.63 121.76 118.23 1ff9 s ALA 186 Ca 0.60 0.46 0.06 0.00 0.00 0.00 0.00 51.96 53.07 1ff9 s ALA 186 Cb -0.34 -3.14 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 1ff9 s ALA 186 CO 0.43 0.17 -0.23 0.00 0.00 0.00 0.00 175.76 176.14 1ff9 s ALA 187 N -1.79 2.27 -0.05 0.00 0.00 0.50 -4.33 121.76 118.36 1ff9 s ALA 187 Ca 0.53 -1.05 0.04 0.00 0.00 0.00 0.00 51.96 51.49 1ff9 s ALA 187 Cb -0.15 -0.71 -0.00 0.00 0.00 0.00 0.00 23.12 22.25 1ff9 s ALA 187 CO 0.20 0.47 -0.19 -1.12 0.00 0.00 0.00 175.76 175.12 1ff9 s SER 188 N -0.37 2.37 0.30 0.00 0.01 -0.47 -1.19 113.70 114.35 1ff9 s SER 188 Ca 0.03 -0.39 -0.16 0.00 1.31 0.00 0.00 55.95 56.74 1ff9 s SER 188 Cb -0.12 -0.72 0.02 0.00 0.21 0.00 0.00 66.02 65.41 1ff9 s SER 188 CO 0.02 0.16 0.64 0.72 0.41 0.00 0.00 173.24 175.19 1ff9 s PHE 189 N 0.06 0.15 -0.15 2.43 -0.12 -0.34 0.10 117.98 120.11 1ff9 s PHE 189 Ca -0.05 -0.60 -0.14 0.00 -0.05 0.00 0.00 56.93 56.08 1ff9 s PHE 189 Cb -0.13 0.51 -0.05 0.00 -0.63 0.00 0.00 43.02 42.73 1ff9 s PHE 189 CO 0.03 -1.22 0.31 0.71 -0.05 0.00 0.00 175.22 175.00 1ff9 s TYR 190 N -3.55 3.48 -0.02 3.49 1.51 -0.41 -0.09 117.35 121.75 1ff9 s TYR 190 Ca 0.17 0.64 0.00 0.00 -1.01 0.00 0.00 57.07 56.87 1ff9 s TYR 190 Cb -0.04 -2.35 0.02 0.00 -0.11 0.00 0.00 41.96 39.48 1ff9 s TYR 190 CO 0.10 0.25 0.01 0.21 -1.11 0.00 0.00 175.55 175.01 1ff9 s LYS 191 N 0.41 0.17 -1.62 -0.62 2.20 -0.52 -1.38 119.74 118.39 1ff9 s LYS 191 Ca 0.18 0.09 -0.13 0.00 -0.36 0.00 0.00 55.97 55.75 1ff9 s LYS 191 Cb -0.13 -0.36 0.11 0.00 -1.51 0.00 0.00 37.83 35.94 1ff9 s LYS 191 CO 0.05 -0.12 0.65 -0.25 -0.36 0.00 0.00 175.35 175.31 1ff9 n ASP 192 N 4.00 -2.29 0.00 1.43 8.00 -1.10 -0.27 116.55 126.32 1ff9 n ASP 192 Ca -0.25 -1.03 0.00 0.00 0.71 0.00 0.00 54.79 54.22 1ff9 n ASP 192 Cb 0.51 -2.77 0.00 0.00 -0.02 0.00 0.00 41.12 38.85 1ff9 n ASP 192 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ff9 n GLY 193 N -1.62 0.35 3.18 0.44 0.00 0.18 -5.00 105.19 102.73 1ff9 n GLY 193 Ca -0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 1ff9 n GLY 193 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ff9 s LYS 194 N -0.79 1.19 0.19 1.61 1.02 0.63 -5.05 119.74 118.54 1ff9 s LYS 194 Ca 0.00 -0.78 -0.32 0.00 0.02 0.00 0.00 55.97 54.89 1ff9 s LYS 194 Cb 0.00 -1.23 -0.12 0.00 -0.52 0.00 0.00 37.83 35.96 1ff9 s LYS 194 CO 0.00 0.32 1.73 0.28 -0.92 0.00 0.00 175.35 176.76 1ff9 n VAL 195 N 2.08 0.07 -4.71 3.17 0.31 -1.26 -1.43 118.33 116.55 1ff9 n VAL 195 Ca -0.17 -0.01 -0.23 0.00 -0.01 0.00 0.00 64.34 63.92 1ff9 n VAL 195 Cb 0.54 -1.96 -0.15 0.00 -0.91 0.00 0.00 33.84 31.36 1ff9 n VAL 195 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1ff9 s THR 196 N 1.45 1.21 0.01 2.52 2.01 0.87 -4.92 115.64 118.79 1ff9 s THR 196 Ca 0.77 -0.64 0.08 0.00 0.31 0.00 0.00 61.69 62.20 1ff9 s THR 196 Cb -0.52 -1.01 -0.03 0.00 0.01 0.00 0.00 72.50 70.95 1ff9 s THR 196 CO 0.34 0.34 -0.23 0.20 -0.69 0.00 0.00 174.62 174.58 1ff9 s ASN 197 N -0.29 3.35 -0.11 3.53 -0.87 -1.26 -1.20 114.94 118.09 1ff9 s ASN 197 Ca 0.04 -0.47 -0.08 0.00 -1.57 0.00 0.00 52.86 50.78 1ff9 s ASN 197 Cb -0.07 -0.44 0.03 0.00 -0.02 0.00 0.00 41.25 40.76 1ff9 s ASN 197 CO -0.00 0.29 0.27 0.54 -2.57 0.00 0.00 177.10 175.63 1ff9 s VAL 198 N -0.75 -0.01 0.10 1.60 0.11 -0.33 -4.98 120.40 116.13 1ff9 s VAL 198 Ca 0.12 0.05 -0.26 0.00 -2.93 0.00 0.00 61.98 58.96 1ff9 s VAL 198 Cb -0.10 -0.40 0.08 0.00 -1.53 0.00 0.00 36.38 34.43 1ff9 s VAL 198 CO 0.01 0.02 0.83 0.00 -3.33 0.00 0.00 175.10 172.63 1ff9 s ALA 199 N 0.56 -1.67 0.00 1.54 0.00 -1.26 -0.37 121.76 120.56 1ff9 s ALA 199 Ca -0.03 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.45 1ff9 s ALA 199 Cb -0.05 0.62 0.00 0.00 0.00 0.00 0.00 23.12 23.70 1ff9 s ALA 199 CO -0.03 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.30 1ff9 n GLY 200 N -0.36 -1.27 0.38 0.00 0.00 -1.26 -3.66 105.19 99.01 1ff9 n GLY 200 Ca -0.09 -1.26 0.25 0.00 0.00 0.00 0.00 46.02 44.92 1ff9 n GLY 200 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1ff9 h PRO 201 N 0.00 0.33 -0.92 1.61 0.11 -1.99 0.50 132.00 131.64 1ff9 h PRO 201 Ca 0.00 -0.02 0.18 0.00 0.11 0.00 0.00 66.00 66.27 1ff9 h PRO 201 Cb 0.00 -0.07 -0.11 0.00 0.11 0.00 0.00 31.00 30.93 1ff9 h PRO 201 CO 0.00 0.22 0.50 1.49 -0.21 0.00 0.00 178.00 180.00 1ff9 h GLU 202 N 0.34 0.60 -0.18 1.05 4.81 -1.98 0.42 114.58 119.64 1ff9 h GLU 202 Ca 0.70 -0.04 0.01 0.00 -0.13 0.00 0.00 59.36 59.91 1ff9 h GLU 202 Cb 1.73 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 30.96 1ff9 h GLU 202 CO -0.48 0.40 0.08 1.25 -0.73 0.00 0.00 179.01 179.53 1ff9 h LEU 203 N 0.62 0.11 -0.51 1.64 5.85 -0.09 -1.55 115.31 121.38 1ff9 h LEU 203 Ca 0.54 0.01 -0.09 0.00 0.84 0.00 0.00 57.88 59.18 1ff9 h LEU 203 Cb 0.87 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.88 1ff9 h LEU 203 CO -0.41 0.09 -0.44 0.24 -0.34 0.00 0.00 178.44 177.58 1ff9 h MET 204 N 0.18 0.00 0.00 1.25 2.86 -1.24 -2.83 114.93 115.15 1ff9 h MET 204 Ca 0.07 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.71 1ff9 h MET 204 Cb 0.03 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.69 1ff9 h MET 204 CO -0.06 0.44 -0.05 0.00 1.06 0.00 0.00 176.91 178.30 1ff9 h ALA 205 N 1.56 1.00 0.00 6.32 0.00 0.17 -2.72 119.26 125.59 1ff9 h ALA 205 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ff9 h ALA 205 Cb 1.13 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1ff9 h ALA 205 CO 0.06 0.06 -0.68 2.41 0.00 0.00 0.00 179.25 181.09 1ff9 n THR 206 N -3.15 0.10 -2.13 0.00 -1.04 -0.62 -4.76 114.28 102.68 1ff9 n THR 206 Ca 0.01 -0.10 -0.29 0.00 -2.04 0.00 0.00 64.05 61.63 1ff9 n THR 206 Cb 0.36 0.24 -0.05 0.00 -1.82 0.00 0.00 70.33 69.07 1ff9 n THR 206 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ff9 s ALA 207 N -3.07 1.90 0.39 2.41 0.00 -1.03 -4.87 121.76 117.49 1ff9 s ALA 207 Ca 0.08 -1.90 -0.00 0.00 0.00 0.00 0.00 51.96 50.14 1ff9 s ALA 207 Cb 0.16 -4.61 -0.02 0.00 0.00 0.00 0.00 23.12 18.65 1ff9 s ALA 207 CO 0.74 -4.80 0.61 0.21 0.00 0.00 0.00 175.76 172.53 1ff9 s LYS 208 N 6.48 3.37 0.31 0.00 2.20 -1.23 -4.67 119.74 126.19 1ff9 s LYS 208 Ca 0.67 -0.31 -0.29 0.00 -0.36 0.00 0.00 55.97 55.67 1ff9 s LYS 208 Cb -0.03 -2.60 -0.12 0.00 -1.51 0.00 0.00 37.83 33.57 1ff9 s LYS 208 CO 0.05 -0.02 1.38 -2.30 -0.36 0.00 0.00 175.35 174.10 1ff9 n PRO 209 N -1.93 2.22 -3.79 4.03 -0.02 -1.26 -1.96 135.00 132.29 1ff9 n PRO 209 Ca -0.02 0.78 -0.29 0.00 -2.02 0.00 0.00 63.50 61.96 1ff9 n PRO 209 Cb 0.56 -2.42 -0.16 0.00 -0.02 0.00 0.00 33.50 31.46 1ff9 n PRO 209 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1ff9 s TYR 210 N -0.66 1.44 0.18 6.00 5.04 0.01 -4.83 117.35 124.53 1ff9 s TYR 210 Ca 0.60 -1.16 -0.30 0.00 -2.44 0.00 0.00 57.07 53.76 1ff9 s TYR 210 Cb -0.57 -1.23 -0.08 0.00 0.35 0.00 0.00 41.96 40.43 1ff9 s TYR 210 CO 0.57 -0.68 1.25 0.12 -1.34 0.00 0.00 175.55 175.47 1ff9 s PHE 211 N 1.72 3.35 0.03 4.97 5.36 -1.26 -4.28 117.98 127.87 1ff9 s PHE 211 Ca -0.01 1.32 0.00 0.00 -0.96 0.00 0.00 56.93 57.28 1ff9 s PHE 211 Cb -0.18 -3.51 0.00 0.00 -0.34 0.00 0.00 43.02 39.00 1ff9 s PHE 211 CO -0.09 -1.51 0.00 -0.89 -1.46 0.00 0.00 175.22 171.27 1ff9 n ILE 212 N 2.71 0.05 -4.33 3.12 5.41 -1.26 -5.11 119.36 119.96 1ff9 n ILE 212 Ca 0.06 0.02 -0.23 0.00 1.00 0.00 0.00 62.75 63.59 1ff9 n ILE 212 Cb 0.44 -0.40 -0.13 0.00 -0.71 0.00 0.00 39.64 38.84 1ff9 n ILE 212 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 1ff9 s TYR 213 N -1.12 1.72 0.22 1.39 4.12 -1.26 -5.07 117.35 117.34 1ff9 s TYR 213 Ca 0.00 -0.41 -0.08 0.00 0.02 0.00 0.00 57.07 56.59 1ff9 s TYR 213 Cb 0.00 -0.96 0.34 0.00 -1.52 0.00 0.00 41.96 39.83 1ff9 s TYR 213 CO 0.00 0.17 1.70 -1.35 0.02 0.00 0.00 175.55 176.09 1ff9 h PRO 214 N 4.24 0.27 0.00 -1.71 0.11 -2.02 -2.79 132.00 130.10 1ff9 h PRO 214 Ca -0.45 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1ff9 h PRO 214 Cb 1.18 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 1ff9 h PRO 214 CO 0.40 0.18 -0.04 0.78 -0.21 0.00 0.00 178.00 179.11 1ff9 h GLY 215 N 0.28 0.00 -4.97 -0.55 0.00 -2.06 -3.44 103.07 92.34 1ff9 h GLY 215 Ca 0.34 0.00 -0.62 0.00 0.00 0.00 0.00 47.33 47.05 1ff9 h GLY 215 CO -0.42 0.00 -0.48 -1.36 0.00 0.00 0.00 176.54 174.28 1ff9 s PHE 216 N -4.16 3.53 -0.72 5.60 0.40 -1.06 -5.06 117.98 116.51 1ff9 s PHE 216 Ca -0.03 0.32 0.02 0.00 -0.60 0.00 0.00 56.93 56.64 1ff9 s PHE 216 Cb 0.13 -1.81 0.18 0.00 0.51 0.00 0.00 43.02 42.02 1ff9 s PHE 216 CO 0.51 0.60 0.53 0.00 0.70 0.00 0.00 175.22 177.56 1ff9 s ALA 217 N -1.45 3.84 0.29 5.36 0.00 -1.26 -4.77 121.76 123.78 1ff9 s ALA 217 Ca 0.32 -3.71 -0.01 0.00 0.00 0.00 0.00 51.96 48.56 1ff9 s ALA 217 Cb -0.13 -2.38 -0.04 0.00 0.00 0.00 0.00 23.12 20.57 1ff9 s ALA 217 CO 0.24 -2.10 0.50 -0.06 0.00 0.00 0.00 175.76 174.34 1ff9 s PHE 218 N -1.15 3.49 0.09 0.00 0.40 -1.26 -1.40 117.98 118.15 1ff9 s PHE 218 Ca 0.24 0.40 0.07 0.00 -0.60 0.00 0.00 56.93 57.03 1ff9 s PHE 218 Cb -0.10 -1.92 -0.03 0.00 0.51 0.00 0.00 43.02 41.49 1ff9 s PHE 218 CO -0.12 0.21 -0.18 0.14 0.70 0.00 0.00 175.22 175.97 1ff9 s VAL 219 N -2.13 1.47 0.04 -0.44 -7.23 0.14 -0.81 120.40 111.44 1ff9 s VAL 219 Ca 0.40 -1.43 0.04 0.00 -1.81 0.00 0.00 61.98 59.19 1ff9 s VAL 219 Cb -0.10 -1.36 -0.02 0.00 0.56 0.00 0.00 36.38 35.46 1ff9 s VAL 219 CO 0.33 -0.11 -0.12 0.00 -0.31 0.00 0.00 175.10 174.88 1ff9 s ALA 220 N -1.18 1.00 0.02 1.32 0.00 -0.83 -1.85 121.76 120.24 1ff9 s ALA 220 Ca 0.03 -0.78 -0.13 0.00 0.00 0.00 0.00 51.96 51.08 1ff9 s ALA 220 Cb -0.10 -0.13 0.02 0.00 0.00 0.00 0.00 23.12 22.91 1ff9 s ALA 220 CO 0.03 0.16 0.29 1.52 0.00 0.00 0.00 175.76 177.76 1ff9 s TYR 221 N -0.93 -0.11 0.50 0.00 1.13 -1.01 -3.54 117.35 113.39 1ff9 s TYR 221 Ca -0.01 0.05 -0.23 0.00 -1.41 0.00 0.00 57.07 55.47 1ff9 s TYR 221 Cb -0.08 0.08 -0.06 0.00 -1.10 0.00 0.00 41.96 40.80 1ff9 s TYR 221 CO 0.01 -0.45 1.32 -2.14 -2.51 0.00 0.00 175.55 171.78 1ff9 s PRO 222 N -2.08 3.42 -0.02 -3.49 0.02 -1.26 -1.14 135.00 130.45 1ff9 s PRO 222 Ca -0.08 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.09 1ff9 s PRO 222 Cb -0.03 -2.39 0.02 0.00 0.02 0.00 0.00 34.50 32.13 1ff9 s PRO 222 CO -0.00 -0.94 0.02 1.21 -0.33 0.00 0.00 177.00 176.95 1ff9 s ASN 223 N -0.97 0.11 1.00 2.53 2.47 -0.45 -4.73 114.94 114.90 1ff9 s ASN 223 Ca 0.67 0.02 0.00 0.00 0.42 0.00 0.00 52.86 53.97 1ff9 s ASN 223 Cb -0.38 -0.07 0.00 0.00 -1.45 0.00 0.00 41.25 39.35 1ff9 s ASN 223 CO 0.46 -0.09 0.00 0.54 -3.72 0.00 0.00 177.10 174.29 1ff9 n ARG 224 N 3.90 0.00 -3.51 0.43 1.74 -1.26 -4.56 116.66 113.39 1ff9 n ARG 224 Ca -0.24 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.43 1ff9 n ARG 224 Cb 0.53 0.00 -0.10 0.00 -1.02 0.00 0.00 32.46 31.86 1ff9 n ARG 224 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1ff9 s ASP 225 N -4.00 6.03 0.04 0.55 2.15 -1.26 -1.36 116.67 118.81 1ff9 s ASP 225 Ca 0.00 -0.72 0.22 0.00 0.43 0.00 0.00 52.55 52.48 1ff9 s ASP 225 Cb 0.00 -2.13 -0.15 0.00 -0.30 0.00 0.00 42.92 40.34 1ff9 s ASP 225 CO 0.00 -0.35 0.79 -1.20 -0.17 0.00 0.00 175.17 174.23 1ff9 n SER 226 N 5.12 0.44 -0.29 -0.34 7.64 0.12 -4.47 113.62 121.83 1ff9 n SER 226 Ca -0.12 -0.12 0.07 0.00 1.01 0.00 0.00 58.87 59.71 1ff9 n SER 226 Cb 0.48 1.25 0.29 0.00 -1.01 0.00 0.00 64.21 65.22 1ff9 n SER 226 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1ff9 h THR 227 N 0.00 0.97 -0.00 0.44 1.35 -1.87 -1.38 112.91 112.42 1ff9 h THR 227 Ca 0.00 -0.31 0.00 0.00 -0.55 0.00 0.00 66.41 65.55 1ff9 h THR 227 Cb 0.86 -0.01 -0.00 0.00 -1.73 0.00 0.00 68.15 67.27 1ff9 h THR 227 CO 0.00 0.16 0.02 -0.65 -0.25 0.00 0.00 175.52 174.81 1ff9 h PRO 228 N 0.90 0.00 0.00 4.72 0.11 -1.93 -2.73 132.00 133.06 1ff9 h PRO 228 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 1ff9 h PRO 228 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1ff9 h PRO 228 CO -0.18 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.27 1ff9 n TYR 229 N -3.14 0.83 0.05 0.65 4.02 -0.52 -1.74 117.16 117.31 1ff9 n TYR 229 Ca -0.03 0.30 0.04 0.00 -0.01 0.00 0.00 57.90 58.20 1ff9 n TYR 229 Cb 0.09 -0.99 0.44 0.00 -0.02 0.00 0.00 39.34 38.86 1ff9 n TYR 229 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 176.86 175.63 1ff9 h LYS 230 N 0.00 0.42 0.01 -0.72 3.64 -1.66 -1.26 116.57 117.00 1ff9 h LYS 230 Ca 0.00 -0.04 -0.25 0.00 -1.27 0.00 0.00 60.65 59.09 1ff9 h LYS 230 Cb 0.46 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1ff9 h LYS 230 CO 0.00 0.33 -1.37 0.39 -2.27 0.00 0.00 179.45 176.53 1ff9 n GLU 231 N -4.44 0.58 -0.16 1.90 4.71 -1.05 -1.63 120.64 120.55 1ff9 n GLU 231 Ca 0.02 0.54 -0.02 0.00 -0.01 0.00 0.00 57.16 57.68 1ff9 n GLU 231 Cb 0.11 -1.74 0.07 0.00 -1.01 0.00 0.00 31.44 28.87 1ff9 n GLU 231 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1ff9 h ARG 232 N -0.90 0.20 -0.20 3.49 3.08 -1.24 -1.25 114.38 117.56 1ff9 h ARG 232 Ca -0.37 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.67 1ff9 h ARG 232 Cb 1.38 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1ff9 h ARG 232 CO -0.19 0.14 0.00 0.66 -1.07 0.00 0.00 179.97 179.50 1ff9 n TYR 233 N -5.14 0.25 -3.65 3.04 4.01 -0.48 -4.97 117.16 110.23 1ff9 n TYR 233 Ca 0.06 -0.13 -0.30 0.00 -0.16 0.00 0.00 57.90 57.37 1ff9 n TYR 233 Cb 0.25 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.32 1ff9 n TYR 233 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 1ff9 n GLN 234 N 0.60 -1.46 -3.14 -0.72 6.02 -0.47 -4.94 117.38 113.26 1ff9 n GLN 234 Ca 0.17 0.50 -0.24 0.00 -0.01 0.00 0.00 57.00 57.41 1ff9 n GLN 234 Cb 0.40 -4.32 -0.05 0.00 1.02 0.00 0.00 30.24 27.29 1ff9 n GLN 234 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 177.06 176.49 1ff9 n ILE 235 N -4.11 1.62 0.07 5.09 -5.35 -0.65 -4.90 119.36 111.14 1ff9 n ILE 235 Ca -0.10 -5.06 0.14 0.00 -0.27 0.00 0.00 62.75 57.46 1ff9 n ILE 235 Cb 0.60 -1.33 0.62 0.00 -1.74 0.00 0.00 39.64 37.79 1ff9 n ILE 235 CO 0.00 0.00 0.00 -0.65 -1.76 0.00 0.00 176.55 174.14 1ff9 h PRO 236 N 3.36 0.10 0.00 6.28 0.11 -1.93 -1.39 132.00 138.54 1ff9 h PRO 236 Ca 0.13 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1ff9 h PRO 236 Cb 0.70 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.79 1ff9 h PRO 236 CO 0.70 0.07 0.00 -0.85 -0.21 0.00 0.00 178.00 177.71 1ff9 n GLU 237 N -4.46 0.31 -2.55 1.05 0.00 -1.26 -4.84 120.64 108.89 1ff9 n GLU 237 Ca 0.05 0.04 -0.42 0.00 0.00 0.00 0.00 57.16 56.83 1ff9 n GLU 237 Cb 0.36 -1.50 -0.03 0.00 0.00 0.00 0.00 31.44 30.27 1ff9 n GLU 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ff9 s ALA 238 N -2.65 3.32 -0.10 -1.84 0.00 -0.53 -4.51 121.76 115.46 1ff9 s ALA 238 Ca 0.23 0.68 0.15 0.00 0.00 0.00 0.00 51.96 53.02 1ff9 s ALA 238 Cb 0.18 -3.41 -0.22 0.00 0.00 0.00 0.00 23.12 19.66 1ff9 s ALA 238 CO 0.42 -0.41 0.53 -0.25 0.00 0.00 0.00 175.76 176.05 1ff9 n ASP 239 N 4.14 0.61 -3.98 0.00 8.00 0.08 -4.80 116.55 120.59 1ff9 n ASP 239 Ca 0.08 0.28 -0.29 0.00 0.71 0.00 0.00 54.79 55.57 1ff9 n ASP 239 Cb 0.48 0.34 -0.16 0.00 -0.02 0.00 0.00 41.12 41.76 1ff9 n ASP 239 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1ff9 s ASN 240 N -5.81 2.71 -0.10 -2.24 0.01 -1.12 0.48 114.94 108.86 1ff9 s ASN 240 Ca -0.06 -0.53 -0.01 0.00 -0.71 0.00 0.00 52.86 51.55 1ff9 s ASN 240 Cb 0.08 -1.11 0.03 0.00 0.41 0.00 0.00 41.25 40.67 1ff9 s ASN 240 CO 0.83 -0.09 -0.01 -0.63 -1.51 0.00 0.00 177.10 175.69 1ff9 s ILE 241 N 1.53 0.54 -0.10 0.60 1.01 -0.48 -0.16 121.20 124.14 1ff9 s ILE 241 Ca 0.04 -0.08 -0.05 0.00 0.00 0.00 0.00 60.65 60.56 1ff9 s ILE 241 Cb -0.13 -0.72 0.05 0.00 0.01 0.00 0.00 42.46 41.66 1ff9 s ILE 241 CO -0.10 0.21 0.23 -0.69 0.00 0.00 0.00 174.94 174.59 1ff9 s VAL 242 N 1.90 -0.13 -0.11 2.92 1.01 -0.57 -1.29 120.40 124.13 1ff9 s VAL 242 Ca 0.04 0.19 0.03 0.00 0.00 0.00 0.00 61.98 62.24 1ff9 s VAL 242 Cb -0.13 -0.37 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 1ff9 s VAL 242 CO -0.06 0.08 -0.20 -0.13 0.00 0.00 0.00 175.10 174.78 1ff9 s ARG 243 N 1.53 3.13 0.00 2.72 0.52 -1.26 -0.84 118.95 124.75 1ff9 s ARG 243 Ca -0.07 -0.81 0.00 0.00 -0.52 0.00 0.00 55.73 54.33 1ff9 s ARG 243 Cb -0.11 -2.41 0.00 0.00 0.52 0.00 0.00 34.95 32.95 1ff9 s ARG 243 CO -0.08 0.21 0.00 0.41 0.02 0.00 0.00 175.30 175.86 1ff9 n GLY 244 N 3.48 3.80 3.36 -3.53 0.00 0.93 -1.34 105.19 111.88 1ff9 n GLY 244 Ca -0.19 -1.04 -0.21 0.00 0.00 0.00 0.00 46.02 44.59 1ff9 n GLY 244 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ff9 s THR 245 N -2.24 1.90 -0.05 2.61 -4.23 -0.30 -2.36 115.64 110.97 1ff9 s THR 245 Ca 0.00 -2.11 -0.01 0.00 -1.18 0.00 0.00 61.69 58.39 1ff9 s THR 245 Cb 0.00 -2.00 -0.03 0.00 1.34 0.00 0.00 72.50 71.81 1ff9 s THR 245 CO 0.00 -0.43 0.01 -0.76 -0.54 0.00 0.00 174.62 172.90 1ff9 s LEU 246 N -3.04 3.60 0.25 4.79 1.43 -0.60 -2.41 118.68 122.70 1ff9 s LEU 246 Ca 0.21 0.10 0.02 0.00 -1.03 0.00 0.00 54.13 53.42 1ff9 s LEU 246 Cb -0.04 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 44.21 1ff9 s LEU 246 CO 0.08 0.34 0.17 -0.13 0.23 0.00 0.00 176.35 177.04 1ff9 s ARG 247 N -1.19 1.40 0.42 1.70 1.81 -0.77 -4.53 118.95 117.79 1ff9 s ARG 247 Ca 0.16 -1.77 0.02 0.00 -1.72 0.00 0.00 55.73 52.42 1ff9 s ARG 247 Cb -0.11 0.21 -0.00 0.00 -0.45 0.00 0.00 34.95 34.60 1ff9 s ARG 247 CO 0.06 -0.46 0.61 0.71 -0.68 0.00 0.00 175.30 175.54 1ff9 s TYR 248 N -3.89 3.17 0.38 -0.53 4.12 -1.26 -0.68 117.35 118.66 1ff9 s TYR 248 Ca 0.39 0.07 -0.26 0.00 0.02 0.00 0.00 57.07 57.29 1ff9 s TYR 248 Cb 0.06 -2.23 -0.11 0.00 -1.52 0.00 0.00 41.96 38.16 1ff9 s TYR 248 CO 0.17 -0.26 1.13 0.00 0.02 0.00 0.00 175.55 176.60 1ff9 n GLN 249 N -1.94 1.65 0.00 -0.62 10.64 -0.49 -2.28 117.38 124.33 1ff9 n GLN 249 Ca 0.01 0.58 0.00 0.00 -1.83 0.00 0.00 57.00 55.76 1ff9 n GLN 249 Cb 0.58 -2.14 0.00 0.00 -0.86 0.00 0.00 30.24 27.82 1ff9 n GLN 249 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1ff9 n GLY 250 N 1.02 3.15 0.10 2.61 0.00 -1.26 -4.86 105.19 105.95 1ff9 n GLY 250 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 1ff9 n GLY 250 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1ff9 h PHE 251 N 0.00 -0.13 -0.99 1.61 3.57 -1.68 -2.05 116.94 117.28 1ff9 h PHE 251 Ca 0.00 0.01 0.12 0.00 3.53 0.00 0.00 57.97 61.62 1ff9 h PHE 251 Cb 0.00 0.06 -0.08 0.00 2.79 0.00 0.00 35.95 38.72 1ff9 h PHE 251 CO 0.00 -0.08 0.62 -1.35 -2.23 0.00 0.00 178.31 175.27 1ff9 h PRO 252 N -0.08 0.94 -0.15 6.41 0.11 -1.89 -2.25 132.00 135.09 1ff9 h PRO 252 Ca 0.04 -0.06 -0.20 0.00 0.11 0.00 0.00 66.00 65.89 1ff9 h PRO 252 Cb 0.12 -0.21 0.00 0.00 0.11 0.00 0.00 31.00 31.02 1ff9 h PRO 252 CO -0.08 0.62 -0.70 1.96 -0.21 0.00 0.00 178.00 179.59 1ff9 h GLN 253 N 0.97 0.64 -0.05 1.05 7.50 -1.83 -2.57 115.11 120.83 1ff9 h GLN 253 Ca 0.48 -0.49 -0.18 0.00 0.50 0.00 0.00 58.65 58.96 1ff9 h GLN 253 Cb 0.49 0.09 -0.01 0.00 0.05 0.00 0.00 27.48 28.10 1ff9 h GLN 253 CO -0.25 1.11 -0.75 0.35 -1.50 0.00 0.00 178.83 177.80 1ff9 h PHE 254 N 0.46 0.43 -0.43 2.96 3.57 -1.15 -2.69 116.94 120.09 1ff9 h PHE 254 Ca -0.03 -0.20 -0.03 0.00 3.53 0.00 0.00 57.97 61.25 1ff9 h PHE 254 Cb 1.30 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.95 1ff9 h PHE 254 CO 0.06 0.95 0.16 0.82 -2.23 0.00 0.00 178.31 178.08 1ff9 h ILE 255 N 0.21 1.20 -0.70 1.41 1.08 -1.44 -2.12 117.51 117.16 1ff9 h ILE 255 Ca -0.03 -0.64 -0.00 0.00 -0.39 0.00 0.00 64.86 63.80 1ff9 h ILE 255 Cb 1.32 0.82 -0.03 0.00 -3.07 0.00 0.00 36.82 35.86 1ff9 h ILE 255 CO 0.12 0.23 0.42 0.50 -0.69 0.00 0.00 178.15 178.73 1ff9 h LYS 256 N 0.55 0.96 -0.82 2.37 3.64 -1.37 -1.48 116.57 120.42 1ff9 h LYS 256 Ca 0.14 -0.09 -0.03 0.00 -1.27 0.00 0.00 60.65 59.40 1ff9 h LYS 256 Cb 0.20 -0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 31.79 1ff9 h LYS 256 CO -0.01 0.68 0.40 0.28 -2.27 0.00 0.00 179.45 178.53 1ff9 h VAL 257 N 0.96 1.25 -0.42 2.00 2.07 -1.32 0.56 116.25 121.36 1ff9 h VAL 257 Ca 0.25 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 1ff9 h VAL 257 Cb -0.02 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 29.93 1ff9 h VAL 257 CO -0.05 0.30 0.17 -0.07 0.02 0.00 0.00 177.57 177.95 1ff9 h LEU 258 N 1.16 0.53 0.49 2.57 3.38 -0.89 0.02 115.31 122.56 1ff9 h LEU 258 Ca 0.28 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 1ff9 h LEU 258 Cb 0.11 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1ff9 h LEU 258 CO -0.04 0.48 -0.23 0.58 0.09 0.00 0.00 178.44 179.32 1ff9 h VAL 259 N 0.59 0.14 -0.34 1.22 2.07 -0.23 -1.18 116.25 118.52 1ff9 h VAL 259 Ca 0.15 -0.53 0.09 0.00 0.82 0.00 0.00 66.70 67.22 1ff9 h VAL 259 Cb 0.11 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1ff9 h VAL 259 CO -0.02 0.03 0.24 0.44 0.02 0.00 0.00 177.57 178.28 1ff9 h ASP 260 N -1.12 0.02 1.03 0.57 3.32 -0.79 0.55 116.42 120.00 1ff9 h ASP 260 Ca -0.07 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.98 1ff9 h ASP 260 Cb 0.55 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.09 1ff9 h ASP 260 CO 0.11 0.01 0.00 -0.38 -1.72 0.00 0.00 179.24 177.26 1ff9 n ILE 261 N -4.44 0.46 -0.83 0.35 5.41 -0.02 -4.90 119.36 115.38 1ff9 n ILE 261 Ca 0.05 -0.02 0.00 0.00 1.00 0.00 0.00 62.75 63.78 1ff9 n ILE 261 Cb 0.40 -0.69 0.00 0.00 -0.71 0.00 0.00 39.64 38.64 1ff9 n ILE 261 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ff9 n GLY 262 N 1.00 0.64 0.12 7.39 0.00 0.19 -4.41 105.19 110.13 1ff9 n GLY 262 Ca 0.05 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.18 1ff9 n GLY 262 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ff9 n PHE 263 N -2.69 0.67 -0.19 1.61 3.01 -0.47 -2.04 117.46 117.36 1ff9 n PHE 263 Ca 0.00 0.30 0.08 0.00 1.01 0.00 0.00 57.45 58.84 1ff9 n PHE 263 Cb 0.00 -0.98 0.30 0.00 -0.01 0.00 0.00 39.48 38.79 1ff9 n PHE 263 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1ff9 n LEU 264 N -2.14 3.91 -4.74 4.37 4.77 -1.24 -2.06 117.00 119.87 1ff9 n LEU 264 Ca 0.01 -1.97 -0.41 0.00 -0.03 0.00 0.00 56.01 53.61 1ff9 n LEU 264 Cb 0.13 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.69 1ff9 n LEU 264 CO 0.14 0.73 1.01 -0.55 -1.33 0.00 0.00 177.39 177.40 1ff9 s SER 265 N -0.87 6.86 0.15 -1.43 0.15 -0.87 -4.74 113.70 112.94 1ff9 s SER 265 Ca 0.43 2.43 0.26 0.00 0.70 0.00 0.00 55.95 59.77 1ff9 s SER 265 Cb 0.26 -2.61 0.74 0.00 -1.71 0.00 0.00 66.02 62.70 1ff9 s SER 265 CO 0.23 -0.56 1.67 -0.67 1.20 0.00 0.00 173.24 175.10 1ff9 n ASP 266 N 2.75 0.67 -4.74 5.45 2.03 -1.26 -2.93 116.55 118.52 1ff9 n ASP 266 Ca 0.07 0.41 -0.42 0.00 0.52 0.00 0.00 54.79 55.38 1ff9 n ASP 266 Cb 0.42 -0.47 -0.02 0.00 -0.72 0.00 0.00 41.12 40.33 1ff9 n ASP 266 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1ff9 s GLU 267 N -3.10 4.12 -0.03 -0.67 2.02 -1.26 -4.85 118.70 114.92 1ff9 s GLU 267 Ca 0.10 2.60 -0.22 0.00 0.02 0.00 0.00 54.97 57.48 1ff9 s GLU 267 Cb 0.14 -3.04 -0.05 0.00 0.10 0.00 0.00 34.13 31.28 1ff9 s GLU 267 CO 0.62 -0.70 0.63 -1.21 0.02 0.00 0.00 175.26 174.63 1ff9 s GLU 268 N 0.26 4.38 -0.08 1.61 2.02 -1.26 -3.98 118.70 121.65 1ff9 s GLU 268 Ca 0.69 0.78 0.00 0.00 0.02 0.00 0.00 54.97 56.46 1ff9 s GLU 268 Cb -0.49 -3.39 -0.03 0.00 0.10 0.00 0.00 34.13 30.32 1ff9 s GLU 268 CO 0.41 0.23 -0.07 -0.65 0.02 0.00 0.00 175.26 175.20 1ff9 s GLN 269 N 0.26 2.84 0.57 1.61 -1.52 -0.22 -4.99 119.66 118.20 1ff9 s GLN 269 Ca 0.33 -0.55 0.32 0.00 -1.95 0.00 0.00 55.36 53.51 1ff9 s GLN 269 Cb -0.18 -2.62 1.71 0.00 -0.22 0.00 0.00 33.01 31.71 1ff9 s GLN 269 CO 0.17 0.62 2.15 -1.35 -0.25 0.00 0.00 175.29 176.63 1ff9 h PRO 270 N 5.41 0.00 -0.01 2.91 0.11 -1.97 -1.96 132.00 136.49 1ff9 h PRO 270 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1ff9 h PRO 270 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1ff9 h PRO 270 CO 0.53 0.06 -0.01 1.97 -0.21 0.00 0.00 178.00 180.34 1ff9 n PHE 271 N -3.48 0.00 -1.55 0.65 1.16 -1.26 -3.74 117.46 109.24 1ff9 n PHE 271 Ca -0.02 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.42 1ff9 n PHE 271 Cb 0.19 -0.02 0.14 0.00 -1.61 0.00 0.00 39.48 38.18 1ff9 n PHE 271 CO 0.00 0.00 0.00 1.28 -1.87 0.00 0.00 176.76 176.17 1ff9 n LEU 272 N -0.42 4.99 -0.01 5.98 4.77 -0.73 -4.57 117.00 127.00 1ff9 n LEU 272 Ca 0.21 -4.07 0.09 0.00 -0.03 0.00 0.00 56.01 52.20 1ff9 n LEU 272 Cb 0.25 -0.64 -0.16 0.00 -2.33 0.00 0.00 43.42 40.54 1ff9 n LEU 272 CO 0.18 1.48 -0.76 1.17 -1.33 0.00 0.00 177.39 178.13 1ff9 n LYS 273 N -1.01 0.66 -4.37 3.23 4.81 -1.24 -0.62 118.16 119.61 1ff9 n LYS 273 Ca 0.42 -0.16 -0.23 0.00 -0.87 0.00 0.00 58.31 57.46 1ff9 n LYS 273 Cb 1.00 -1.54 -0.11 0.00 0.02 0.00 0.00 35.03 34.40 1ff9 n LYS 273 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1ff9 s GLU 274 N -3.40 1.37 -0.45 1.64 2.12 -1.26 -4.87 118.70 113.84 1ff9 s GLU 274 Ca -0.08 -1.47 -0.29 0.00 0.36 0.00 0.00 54.97 53.49 1ff9 s GLU 274 Cb 0.13 -1.50 -0.32 0.00 0.26 0.00 0.00 34.13 32.70 1ff9 s GLU 274 CO 0.90 0.31 1.81 0.00 -0.54 0.00 0.00 175.26 177.73 1ff9 n ALA 275 N 0.19 0.64 -2.35 6.30 0.00 -1.26 -4.73 120.51 119.31 1ff9 n ALA 275 Ca -0.12 -2.53 -0.35 0.00 0.00 0.00 0.00 53.44 50.44 1ff9 n ALA 275 Cb 0.57 -3.59 -0.06 0.00 0.00 0.00 0.00 19.45 16.37 1ff9 n ALA 275 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ff9 s ILE 276 N 11.11 4.85 0.51 0.00 1.01 -1.26 -4.57 121.20 132.85 1ff9 s ILE 276 Ca 0.74 0.79 -0.21 0.00 0.00 0.00 0.00 60.65 61.97 1ff9 s ILE 276 Cb 0.07 -3.71 -0.08 0.00 0.01 0.00 0.00 42.46 38.74 1ff9 s ILE 276 CO 0.28 0.16 0.88 -2.65 0.00 0.00 0.00 174.94 173.62 1ff9 n PRO 277 N 0.57 1.01 -0.20 2.79 -0.02 -1.26 -1.69 135.00 136.20 1ff9 n PRO 277 Ca -0.04 0.37 0.15 0.00 -2.02 0.00 0.00 63.50 61.96 1ff9 n PRO 277 Cb 0.52 -1.99 0.47 0.00 -0.02 0.00 0.00 33.50 32.47 1ff9 n PRO 277 CO 0.00 0.00 0.00 -1.49 1.98 0.00 0.00 175.50 175.99 1ff9 h TRP 278 N 0.92 0.59 0.00 6.00 4.06 -0.58 -3.05 115.95 123.88 1ff9 h TRP 278 Ca -0.46 0.02 0.00 0.00 2.06 0.00 0.00 58.89 60.51 1ff9 h TRP 278 Cb 1.36 -0.19 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 1ff9 h TRP 278 CO 0.39 0.22 0.00 1.63 -3.56 0.00 0.00 178.44 177.12 1ff9 n LYS 279 N -4.50 0.00 -0.24 0.49 5.02 -0.86 -1.65 118.16 116.43 1ff9 n LYS 279 Ca 0.15 0.76 0.03 0.00 -2.02 0.00 0.00 58.31 57.24 1ff9 n LYS 279 Cb 0.52 -1.39 0.13 0.00 -0.02 0.00 0.00 35.03 34.27 1ff9 n LYS 279 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1ff9 h GLU 280 N 0.00 0.08 -0.10 1.97 5.08 -1.85 -0.20 114.58 119.56 1ff9 h GLU 280 Ca 0.00 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1ff9 h GLU 280 Cb 0.00 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 1ff9 h GLU 280 CO 0.00 0.05 -0.31 0.00 -1.00 0.00 0.00 179.01 177.75 1ff9 h ALA 281 N 1.66 -0.68 -0.46 3.43 0.00 -1.41 0.33 119.26 122.14 1ff9 h ALA 281 Ca 0.37 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 55.29 1ff9 h ALA 281 Cb 0.63 0.84 -0.04 0.00 0.00 0.00 0.00 17.79 19.22 1ff9 h ALA 281 CO -0.64 -0.79 0.23 1.79 0.00 0.00 0.00 179.25 179.84 1ff9 h THR 282 N -0.31 0.96 -0.75 0.00 1.35 -0.76 0.47 112.91 113.86 1ff9 h THR 282 Ca 0.02 -0.16 0.05 0.00 -0.55 0.00 0.00 66.41 65.78 1ff9 h THR 282 Cb 0.38 0.47 -0.05 0.00 -1.73 0.00 0.00 68.15 67.22 1ff9 h THR 282 CO -0.26 0.08 0.49 0.06 -0.25 0.00 0.00 175.52 175.64 1ff9 h GLN 283 N 0.45 0.80 0.10 4.72 -0.00 -0.64 1.12 115.11 121.67 1ff9 h GLN 283 Ca 0.20 -0.05 -0.00 0.00 -0.00 0.00 0.00 58.65 58.80 1ff9 h GLN 283 Cb 0.11 -0.18 0.00 0.00 -0.00 0.00 0.00 27.48 27.42 1ff9 h GLN 283 CO -0.15 0.53 -0.05 0.87 -0.00 0.00 0.00 178.83 180.03 1ff9 h LYS 284 N 0.82 -0.13 -0.97 0.06 1.57 0.63 0.25 116.57 118.81 1ff9 h LYS 284 Ca 0.31 0.01 0.04 0.00 -1.87 0.00 0.00 60.65 59.14 1ff9 h LYS 284 Cb 0.19 0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.47 1ff9 h LYS 284 CO -0.10 0.38 0.63 0.82 -0.57 0.00 0.00 179.45 180.61 1ff9 h ILE 285 N -0.83 1.16 0.04 1.86 2.04 0.35 -2.94 117.51 119.19 1ff9 h ILE 285 Ca -0.01 -0.42 -0.23 0.00 1.00 0.00 0.00 64.86 65.20 1ff9 h ILE 285 Cb 0.57 -0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.48 1ff9 h ILE 285 CO 0.02 0.22 -1.06 0.58 0.00 0.00 0.00 178.15 177.91 1ff9 h VAL 286 N 1.21 1.64 -1.43 1.67 2.07 0.12 -3.46 116.25 118.08 1ff9 h VAL 286 Ca 0.39 -3.27 0.00 0.00 0.82 0.00 0.00 66.70 64.63 1ff9 h VAL 286 Cb 0.02 2.85 0.00 0.00 -1.52 0.00 0.00 31.29 32.64 1ff9 h VAL 286 CO -0.12 0.94 0.00 0.29 0.02 0.00 0.00 177.57 178.70 1ff9 n LYS 287 N -3.42 0.00 -3.84 1.57 5.02 -0.33 -4.97 118.16 112.19 1ff9 n LYS 287 Ca -0.03 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.94 1ff9 n LYS 287 Cb 0.95 -1.23 -0.05 0.00 -0.02 0.00 0.00 35.03 34.69 1ff9 n LYS 287 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ff9 s ALA 288 N -2.35 3.92 0.45 7.82 0.00 0.73 -4.99 121.76 127.34 1ff9 s ALA 288 Ca 0.00 -0.71 0.32 0.00 0.00 0.00 0.00 51.96 51.57 1ff9 s ALA 288 Cb 0.00 -1.95 1.70 0.00 0.00 0.00 0.00 23.12 22.86 1ff9 s ALA 288 CO 0.00 0.73 2.15 0.77 0.00 0.00 0.00 175.76 179.42 1ff9 h SER 289 N 3.50 0.00 -3.05 0.00 0.02 -1.87 -3.46 113.55 108.69 1ff9 h SER 289 Ca -0.48 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.38 1ff9 h SER 289 Cb 1.18 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 1ff9 h SER 289 CO 0.71 0.06 0.12 -0.24 -1.14 0.00 0.00 176.83 176.34 1ff9 n SER 290 N -3.50 -1.75 -1.46 3.07 2.88 -1.26 -5.03 113.62 106.58 1ff9 n SER 290 Ca -0.02 -2.48 0.10 0.00 -1.33 0.00 0.00 58.87 55.13 1ff9 n SER 290 Cb 0.19 2.99 0.33 0.00 -0.75 0.00 0.00 64.21 66.97 1ff9 n SER 290 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ff9 n ALA 291 N -0.90 2.87 -1.94 -1.46 0.00 -1.26 -4.32 120.51 113.48 1ff9 n ALA 291 Ca -0.14 -1.41 -0.35 0.00 0.00 0.00 0.00 53.44 51.54 1ff9 n ALA 291 Cb 0.52 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.90 1ff9 n ALA 291 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ff9 s SER 292 N -0.91 7.11 0.18 0.00 1.04 -1.26 -4.81 113.70 115.06 1ff9 s SER 292 Ca 0.48 1.60 -0.15 0.00 0.48 0.00 0.00 55.95 58.36 1ff9 s SER 292 Cb 0.29 -2.49 0.17 0.00 0.10 0.00 0.00 66.02 64.09 1ff9 s SER 292 CO 0.26 -0.09 1.67 -0.33 0.98 0.00 0.00 173.24 175.73 1ff9 h GLU 293 N 2.95 0.07 -0.18 4.02 5.08 -1.92 -1.57 114.58 123.03 1ff9 h GLU 293 Ca -0.48 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 57.90 1ff9 h GLU 293 Cb 1.19 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 1ff9 h GLU 293 CO 0.64 0.05 -0.20 1.96 -1.00 0.00 0.00 179.01 180.46 1ff9 h GLN 294 N 0.07 -0.12 0.14 2.33 4.20 -1.98 0.49 115.11 120.25 1ff9 h GLN 294 Ca 0.24 0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.97 1ff9 h GLN 294 Cb 0.36 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 1ff9 h GLN 294 CO -0.44 -0.08 -0.28 -0.44 -0.67 0.00 0.00 178.83 176.93 1ff9 h ASP 295 N -0.12 -0.78 -0.36 1.46 5.19 -1.83 0.55 116.42 120.54 1ff9 h ASP 295 Ca 0.03 0.09 0.05 0.00 -0.62 0.00 0.00 57.03 56.58 1ff9 h ASP 295 Cb 0.20 0.29 -0.04 0.00 0.18 0.00 0.00 39.33 39.96 1ff9 h ASP 295 CO -0.23 -0.37 0.10 0.40 -3.12 0.00 0.00 179.24 176.02 1ff9 h ILE 296 N -0.50 0.86 -0.65 0.35 2.04 -1.13 0.60 117.51 119.08 1ff9 h ILE 296 Ca 0.02 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 1ff9 h ILE 296 Cb 0.52 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1ff9 h ILE 296 CO -0.15 0.04 0.25 0.58 0.00 0.00 0.00 178.15 178.87 1ff9 h VAL 297 N 0.23 1.24 -0.48 1.67 2.07 0.30 0.10 116.25 121.39 1ff9 h VAL 297 Ca 0.17 -0.77 -0.06 0.00 0.82 0.00 0.00 66.70 66.86 1ff9 h VAL 297 Cb 0.16 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.44 1ff9 h VAL 297 CO -0.19 0.30 0.04 0.77 0.02 0.00 0.00 177.57 178.51 1ff9 h SER 298 N 0.92 0.73 -0.24 0.57 4.64 0.63 -0.94 113.55 119.85 1ff9 h SER 298 Ca 0.21 -0.16 -0.12 0.00 -0.47 0.00 0.00 61.79 61.26 1ff9 h SER 298 Cb 0.23 -0.19 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1ff9 h SER 298 CO -0.02 0.77 -0.30 0.71 -0.87 0.00 0.00 176.83 177.12 1ff9 h THR 299 N 0.73 1.31 0.22 2.95 1.35 -0.54 -1.37 112.91 117.57 1ff9 h THR 299 Ca 0.15 -1.49 -0.00 0.00 -0.55 0.00 0.00 66.41 64.52 1ff9 h THR 299 Cb 0.38 1.70 -0.01 0.00 -1.73 0.00 0.00 68.15 68.50 1ff9 h THR 299 CO 0.01 0.47 -0.17 0.40 -0.25 0.00 0.00 175.52 175.98 1ff9 h ILE 300 N 0.35 0.64 0.20 6.82 2.04 -0.64 -2.76 117.51 124.15 1ff9 h ILE 300 Ca 0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.88 1ff9 h ILE 300 Cb 0.88 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 1ff9 h ILE 300 CO 0.07 0.00 -0.09 0.58 0.00 0.00 0.00 178.15 178.71 1ff9 h VAL 301 N -0.40 0.90 -0.71 1.67 2.07 -1.24 -0.83 116.25 117.72 1ff9 h VAL 301 Ca -0.01 -0.77 0.20 0.00 0.82 0.00 0.00 66.70 66.94 1ff9 h VAL 301 Cb 0.35 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 1ff9 h VAL 301 CO -0.01 0.17 0.64 0.28 0.02 0.00 0.00 177.57 178.67 1ff9 h SER 302 N -0.67 0.00 0.10 0.57 0.02 -1.30 -1.56 113.55 110.71 1ff9 h SER 302 Ca -0.03 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.56 1ff9 h SER 302 Cb 0.47 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.95 1ff9 h SER 302 CO 0.04 0.00 -2.25 0.59 -1.14 0.00 0.00 176.83 174.07 1ff9 n ASN 303 N -3.85 0.70 -4.87 3.07 3.02 -1.04 -4.96 115.26 107.33 1ff9 n ASN 303 Ca 0.14 0.06 -0.34 0.00 -0.03 0.00 0.00 54.58 54.42 1ff9 n ASN 303 Cb 0.90 0.40 -0.05 0.00 -0.61 0.00 0.00 39.78 40.41 1ff9 n ASN 303 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ff9 s ALA 304 N -2.52 3.69 -0.10 5.41 0.00 -0.32 -5.09 121.76 122.83 1ff9 s ALA 304 Ca -0.15 -0.35 -0.04 0.00 0.00 0.00 0.00 51.96 51.42 1ff9 s ALA 304 Cb 0.07 -2.31 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 1ff9 s ALA 304 CO 0.78 0.56 0.06 0.99 0.00 0.00 0.00 175.76 178.14 1ff9 s THR 305 N -1.49 4.78 0.39 0.00 2.01 -1.26 -4.74 115.64 115.32 1ff9 s THR 305 Ca 0.37 -0.07 0.04 0.00 0.31 0.00 0.00 61.69 62.34 1ff9 s THR 305 Cb -0.13 -3.04 -0.05 0.00 0.01 0.00 0.00 72.50 69.28 1ff9 s THR 305 CO 0.19 0.61 0.05 -0.36 -0.69 0.00 0.00 174.62 174.42 1ff9 s PHE 306 N -0.89 2.08 0.11 4.92 0.40 -1.26 -5.03 117.98 118.31 1ff9 s PHE 306 Ca 0.13 -0.93 -0.02 0.00 -0.60 0.00 0.00 56.93 55.52 1ff9 s PHE 306 Cb -0.12 -1.46 -0.17 0.00 0.51 0.00 0.00 43.02 41.78 1ff9 s PHE 306 CO 0.03 0.12 1.24 0.93 0.70 0.00 0.00 175.22 178.25 1ff9 h GLU 307 N 1.84 0.26 -2.88 0.44 5.08 -1.99 -3.48 114.58 113.84 1ff9 h GLU 307 Ca -0.41 -0.36 0.06 0.00 -1.00 0.00 0.00 59.36 57.64 1ff9 h GLU 307 Cb 1.26 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 30.60 1ff9 h GLU 307 CO 0.72 1.11 0.31 0.45 -1.00 0.00 0.00 179.01 180.59 1ff9 s SER 308 N -7.05 -0.13 0.20 1.42 0.15 -1.26 -5.00 113.70 102.04 1ff9 s SER 308 Ca -0.04 -0.79 -0.08 0.00 0.70 0.00 0.00 55.95 55.75 1ff9 s SER 308 Cb 0.08 0.73 0.14 0.00 -1.71 0.00 0.00 66.02 65.26 1ff9 s SER 308 CO 0.86 -1.40 1.71 0.71 1.20 0.00 0.00 173.24 176.32 1ff9 h THR 309 N 2.00 1.26 -0.38 6.45 1.35 -1.99 -1.30 112.91 120.31 1ff9 h THR 309 Ca -0.25 -1.02 -0.06 0.00 -0.55 0.00 0.00 66.41 64.53 1ff9 h THR 309 Cb 1.25 0.63 -0.01 0.00 -1.73 0.00 0.00 68.15 68.28 1ff9 h THR 309 CO 0.31 0.38 0.01 -0.33 -0.25 0.00 0.00 175.52 175.64 1ff9 h GLU 310 N 1.02 0.66 -0.45 4.72 4.39 -1.98 0.25 114.58 123.19 1ff9 h GLU 310 Ca 0.20 -0.21 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1ff9 h GLU 310 Cb 0.43 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.99 1ff9 h GLU 310 CO 0.01 0.76 0.24 1.49 -1.16 0.00 0.00 179.01 180.35 1ff9 h GLU 311 N 0.48 0.63 -0.01 2.33 4.81 -1.91 0.21 114.58 121.12 1ff9 h GLU 311 Ca 0.11 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1ff9 h GLU 311 Cb 0.46 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.69 1ff9 h GLU 311 CO 0.02 0.50 -0.14 0.37 -0.73 0.00 0.00 179.01 179.03 1ff9 h GLN 312 N 0.59 -0.22 -0.82 1.92 4.15 -1.01 0.46 115.11 120.18 1ff9 h GLN 312 Ca 0.16 0.01 0.08 0.00 0.77 0.00 0.00 58.65 59.67 1ff9 h GLN 312 Cb 0.06 0.05 -0.07 0.00 0.21 0.00 0.00 27.48 27.73 1ff9 h GLN 312 CO -0.02 -0.14 0.49 0.87 -1.93 0.00 0.00 178.83 178.09 1ff9 h LYS 313 N -0.22 0.82 -0.04 1.69 1.79 -0.06 0.68 116.57 121.24 1ff9 h LYS 313 Ca 0.05 -0.05 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 1ff9 h LYS 313 Cb 0.29 -0.19 -0.00 0.00 -1.58 0.00 0.00 32.23 30.75 1ff9 h LYS 313 CO -0.14 0.55 -0.01 -0.09 -1.08 0.00 0.00 179.45 178.68 1ff9 h ARG 314 N 0.85 0.07 -0.70 3.15 2.43 0.23 -1.94 114.38 118.47 1ff9 h ARG 314 Ca 0.38 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.50 1ff9 h ARG 314 Cb 0.27 -0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.79 1ff9 h ARG 314 CO -0.21 0.41 0.33 0.82 -1.51 0.00 0.00 179.97 179.81 1ff9 h ILE 315 N -0.28 1.22 -0.36 1.20 2.04 0.27 -0.44 117.51 121.16 1ff9 h ILE 315 Ca 0.01 -0.63 -0.04 0.00 1.00 0.00 0.00 64.86 65.19 1ff9 h ILE 315 Cb 0.38 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1ff9 h ILE 315 CO 0.00 0.27 0.05 0.58 0.00 0.00 0.00 178.15 179.05 1ff9 h VAL 316 N 0.99 1.24 -0.14 1.67 2.07 -0.82 -1.33 116.25 119.93 1ff9 h VAL 316 Ca 0.24 -0.85 -0.03 0.00 0.82 0.00 0.00 66.70 66.88 1ff9 h VAL 316 Cb 0.11 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.97 1ff9 h VAL 316 CO -0.03 0.29 -0.05 0.00 0.02 0.00 0.00 177.57 177.79 1ff9 h ALA 317 N 0.90 1.65 -0.52 1.67 0.00 -0.97 -1.05 119.26 120.95 1ff9 h ALA 317 Ca 0.11 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1ff9 h ALA 317 Cb 0.36 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1ff9 h ALA 317 CO 0.01 0.26 0.08 0.78 0.00 0.00 0.00 179.25 180.37 1ff9 h GLY 318 N 0.55 0.93 0.97 0.00 0.00 -0.49 0.12 103.07 105.16 1ff9 h GLY 318 Ca 0.05 -0.63 -0.03 0.00 0.00 0.00 0.00 47.33 46.72 1ff9 h GLY 318 CO 0.01 0.58 0.19 1.41 0.00 0.00 0.00 176.54 178.73 1ff9 h LEU 319 N 0.74 0.72 -0.77 3.11 3.38 -0.45 -1.89 115.31 120.15 1ff9 h LEU 319 Ca 0.16 -0.18 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 1ff9 h LEU 319 Cb 0.41 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1ff9 h LEU 319 CO 0.01 0.71 0.37 0.50 0.09 0.00 0.00 178.44 180.12 1ff9 h LYS 320 N 0.69 1.11 -0.75 1.13 3.64 -0.96 -1.88 116.57 119.54 1ff9 h LYS 320 Ca 0.17 -0.16 0.09 0.00 -1.27 0.00 0.00 60.65 59.47 1ff9 h LYS 320 Cb 0.23 -0.20 -0.05 0.00 -0.41 0.00 0.00 32.23 31.80 1ff9 h LYS 320 CO -0.01 0.87 0.49 2.35 -2.27 0.00 0.00 179.45 180.88 1ff9 h TRP 321 N 1.09 0.74 0.00 1.91 7.01 -0.24 0.32 115.95 126.78 1ff9 h TRP 321 Ca 0.27 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.26 1ff9 h TRP 321 Cb 0.12 -0.24 -0.00 0.00 -2.10 0.00 0.00 29.16 26.94 1ff9 h TRP 321 CO 0.01 0.36 -0.12 -0.07 -2.79 0.00 0.00 178.44 175.83 1ff9 h LEU 322 N 0.71 0.00 0.00 0.65 3.38 -0.56 -3.46 115.31 116.03 1ff9 h LEU 322 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1ff9 h LEU 322 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1ff9 h LEU 322 CO -0.12 0.12 0.00 0.61 0.09 0.00 0.00 178.44 179.14 1ff9 n GLY 323 N -0.98 0.88 0.00 0.83 0.00 0.11 -4.97 105.19 101.06 1ff9 n GLY 323 Ca -0.02 -0.06 0.10 0.00 0.00 0.00 0.00 46.02 46.04 1ff9 n GLY 323 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1ff9 n ILE 324 N -2.23 0.25 0.01 -0.61 -5.35 -1.23 -2.21 119.36 107.99 1ff9 n ILE 324 Ca 0.00 0.06 0.04 0.00 -0.27 0.00 0.00 62.75 62.58 1ff9 n ILE 324 Cb 0.00 -0.73 0.09 0.00 -1.74 0.00 0.00 39.64 37.26 1ff9 n ILE 324 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1ff9 n PHE 325 N -1.19 0.23 -2.85 4.28 0.99 -1.26 -3.93 117.46 113.74 1ff9 n PHE 325 Ca 0.12 -0.35 -0.15 0.00 -0.00 0.00 0.00 57.45 57.07 1ff9 n PHE 325 Cb 0.13 -0.02 0.06 0.00 -1.00 0.00 0.00 39.48 38.65 1ff9 n PHE 325 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.76 175.63 1ff9 n SER 326 N 0.30 1.34 -0.49 4.37 3.41 -0.94 -4.66 113.62 116.94 1ff9 n SER 326 Ca 0.07 -2.01 0.09 0.00 -0.26 0.00 0.00 58.87 56.76 1ff9 n SER 326 Cb 0.32 -0.37 0.33 0.00 -0.26 0.00 0.00 64.21 64.24 1ff9 n SER 326 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1ff9 n ASP 327 N -2.66 1.46 -4.67 4.04 8.00 -1.26 -2.02 116.55 119.44 1ff9 n ASP 327 Ca 0.12 -1.76 -0.42 0.00 0.71 0.00 0.00 54.79 53.44 1ff9 n ASP 327 Cb 0.43 -0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.39 1ff9 n ASP 327 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 1ff9 s LYS 328 N -1.76 4.20 0.50 -1.24 2.20 -1.26 -4.66 119.74 117.71 1ff9 s LYS 328 Ca 0.28 2.18 -0.22 0.00 -0.36 0.00 0.00 55.97 57.85 1ff9 s LYS 328 Cb 0.15 -3.87 -0.06 0.00 -1.51 0.00 0.00 37.83 32.54 1ff9 s LYS 328 CO 0.22 -0.79 1.25 0.15 -0.36 0.00 0.00 175.35 175.82 1ff9 s LYS 329 N 3.60 3.46 0.59 4.03 1.02 -1.26 -0.17 119.74 131.00 1ff9 s LYS 329 Ca 0.72 1.99 -0.08 0.00 0.02 0.00 0.00 55.97 58.61 1ff9 s LYS 329 Cb -0.34 -2.33 -0.02 0.00 -0.52 0.00 0.00 37.83 34.62 1ff9 s LYS 329 CO 0.29 -0.86 0.94 0.42 -0.92 0.00 0.00 175.35 175.23 1ff9 s ILE 330 N -1.44 4.40 -0.95 2.17 1.01 -0.68 -4.77 121.20 120.94 1ff9 s ILE 330 Ca 0.68 0.45 -0.13 0.00 0.00 0.00 0.00 60.65 61.65 1ff9 s ILE 330 Cb -0.34 -3.73 0.22 0.00 0.01 0.00 0.00 42.46 38.62 1ff9 s ILE 330 CO 0.41 -0.86 0.96 -0.89 0.00 0.00 0.00 174.94 174.56 1ff9 s THR 331 N -3.04 5.60 -0.42 2.92 2.01 -1.26 -4.56 115.64 116.89 1ff9 s THR 331 Ca 0.53 -2.68 -0.43 0.00 0.31 0.00 0.00 61.69 59.43 1ff9 s THR 331 Cb -0.11 -4.57 -0.17 0.00 0.01 0.00 0.00 72.50 67.66 1ff9 s THR 331 CO 0.49 -1.17 1.90 -0.81 -0.69 0.00 0.00 174.62 174.34 1ff9 n PRO 332 N 3.97 0.45 -0.24 4.92 -0.04 -1.26 -4.66 135.00 138.14 1ff9 n PRO 332 Ca 0.20 0.15 0.02 0.00 -0.04 0.00 0.00 63.50 63.82 1ff9 n PRO 332 Cb 0.45 -1.80 0.03 0.00 -0.04 0.00 0.00 33.50 32.14 1ff9 n PRO 332 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ff9 n ARG 333 N 6.08 0.55 0.00 0.54 5.12 -1.24 -4.97 116.66 122.74 1ff9 n ARG 333 Ca 0.39 -1.22 0.00 0.00 -1.93 0.00 0.00 57.85 55.09 1ff9 n ARG 333 Cb 0.04 -0.74 0.00 0.00 -1.16 0.00 0.00 32.46 30.60 1ff9 n ARG 333 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1ff9 n GLY 334 N -0.32 0.36 3.89 -0.13 0.00 0.21 -4.62 105.19 104.57 1ff9 n GLY 334 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 1ff9 n GLY 334 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ff9 s ASN 335 N 0.00 6.53 0.09 1.61 0.01 -1.26 -1.06 114.94 120.86 1ff9 s ASN 335 Ca 0.00 0.63 -0.20 0.00 -0.71 0.00 0.00 52.86 52.58 1ff9 s ASN 335 Cb 0.00 -2.11 -0.09 0.00 0.41 0.00 0.00 41.25 39.46 1ff9 s ASN 335 CO 0.00 0.13 1.62 0.00 -1.51 0.00 0.00 177.10 177.34 1ff9 h ALA 336 N 3.30 0.24 0.20 0.60 0.00 -1.69 0.15 119.26 122.06 1ff9 h ALA 336 Ca -0.48 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 1ff9 h ALA 336 Cb 1.18 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1ff9 h ALA 336 CO 0.70 -0.17 -0.10 1.25 0.00 0.00 0.00 179.25 180.93 1ff9 h LEU 337 N 0.14 -0.23 -0.20 0.00 5.85 -1.29 -0.04 115.31 119.54 1ff9 h LEU 337 Ca 0.06 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1ff9 h LEU 337 Cb 0.18 0.06 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1ff9 h LEU 337 CO -0.00 -0.13 0.07 0.44 -0.34 0.00 0.00 178.44 178.48 1ff9 h ASP 338 N -0.30 0.09 -0.10 1.25 5.19 -1.83 0.26 116.42 120.97 1ff9 h ASP 338 Ca -0.03 0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1ff9 h ASP 338 Cb 0.23 0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.74 1ff9 h ASP 338 CO 0.04 0.08 0.05 0.71 -3.12 0.00 0.00 179.24 177.01 1ff9 h THR 339 N 0.17 1.01 -0.25 0.35 1.35 -0.61 -1.82 112.91 113.10 1ff9 h THR 339 Ca 0.09 -0.04 0.02 0.00 -0.55 0.00 0.00 66.41 65.93 1ff9 h THR 339 Cb 0.05 0.88 -0.03 0.00 -1.73 0.00 0.00 68.15 67.32 1ff9 h THR 339 CO -0.09 0.02 0.09 0.25 -0.25 0.00 0.00 175.52 175.54 1ff9 h LEU 340 N 0.12 0.11 -1.21 3.87 5.85 -0.71 -2.51 115.31 120.82 1ff9 h LEU 340 Ca 0.04 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.92 1ff9 h LEU 340 Cb 0.00 0.01 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 1ff9 h LEU 340 CO -0.02 0.09 0.59 0.00 -0.34 0.00 0.00 178.44 178.76 1ff9 h ALA 342 N 1.59 0.57 -0.36 0.00 0.00 -0.88 0.56 119.26 120.73 1ff9 h ALA 342 Ca 0.46 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.22 1ff9 h ALA 342 Cb 0.66 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ff9 h ALA 342 CO -0.22 -0.05 -0.34 1.15 0.00 0.00 0.00 179.25 179.79 1ff9 h THR 343 N 0.54 1.28 -0.04 0.00 2.02 -1.14 -2.13 112.91 113.43 1ff9 h THR 343 Ca 0.18 -1.51 0.01 0.00 0.77 0.00 0.00 66.41 65.86 1ff9 h THR 343 Cb 0.01 1.36 -0.01 0.00 -1.74 0.00 0.00 68.15 67.77 1ff9 h THR 343 CO -0.08 0.50 -0.01 -0.07 0.37 0.00 0.00 175.52 176.23 1ff9 h LEU 344 N 0.69 -0.03 -0.30 2.58 3.38 0.17 0.26 115.31 122.06 1ff9 h LEU 344 Ca 0.07 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1ff9 h LEU 344 Cb 0.90 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 41.59 1ff9 h LEU 344 CO 0.08 -0.01 -0.29 -0.33 0.09 0.00 0.00 178.44 177.99 1ff9 h GLU 345 N 0.01 -0.26 -0.42 1.13 4.39 0.26 0.48 114.58 120.17 1ff9 h GLU 345 Ca 0.02 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 1ff9 h GLU 345 Cb 0.03 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 1ff9 h GLU 345 CO -0.04 -0.17 0.21 1.49 -1.16 0.00 0.00 179.01 179.34 1ff9 h GLU 346 N -0.27 0.60 0.00 2.33 4.22 -0.92 -3.24 114.58 117.30 1ff9 h GLU 346 Ca 0.15 -0.08 -0.12 0.00 0.08 0.00 0.00 59.36 59.38 1ff9 h GLU 346 Cb 0.51 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 1ff9 h GLU 346 CO -0.45 0.51 -0.64 0.87 -2.18 0.00 0.00 179.01 177.12 1ff9 h LYS 347 N 0.54 0.00 -2.26 1.92 1.79 -0.04 -3.39 116.57 115.12 1ff9 h LYS 347 Ca 0.14 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 58.03 1ff9 h LYS 347 Cb 0.10 0.00 -0.42 0.00 -1.58 0.00 0.00 32.23 30.33 1ff9 h LYS 347 CO -0.02 0.55 -0.65 -1.33 -1.08 0.00 0.00 179.45 176.92 1ff9 n MET 348 N -3.21 3.03 -4.47 3.15 2.81 0.16 -5.05 117.12 113.54 1ff9 n MET 348 Ca 0.01 -4.78 -0.24 0.00 -1.81 0.00 0.00 57.70 50.88 1ff9 n MET 348 Cb 0.77 -2.22 -0.10 0.00 -0.71 0.00 0.00 33.22 30.96 1ff9 n MET 348 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1ff9 s GLN 349 N -3.24 1.68 -0.00 0.03 -0.21 -1.25 -0.54 119.66 116.12 1ff9 s GLN 349 Ca 0.47 -1.79 -0.30 0.00 0.02 0.00 0.00 55.36 53.76 1ff9 s GLN 349 Cb 0.26 -1.68 -0.04 0.00 1.00 0.00 0.00 33.01 32.55 1ff9 s GLN 349 CO -0.11 0.27 1.14 -0.06 -2.12 0.00 0.00 175.29 174.40 1ff9 s PHE 350 N -2.59 3.41 0.32 0.91 0.40 -1.26 -4.93 117.98 114.24 1ff9 s PHE 350 Ca 0.30 1.38 0.08 0.00 -0.60 0.00 0.00 56.93 58.09 1ff9 s PHE 350 Cb -0.03 -3.34 -0.04 0.00 0.51 0.00 0.00 43.02 40.13 1ff9 s PHE 350 CO 0.15 -0.93 0.15 -1.21 0.70 0.00 0.00 175.22 174.08 1ff9 s GLU 351 N 1.49 2.46 0.13 0.44 2.02 -1.26 -5.02 118.70 118.97 1ff9 s GLU 351 Ca 0.55 -1.45 -0.33 0.00 0.02 0.00 0.00 54.97 53.77 1ff9 s GLU 351 Cb -0.25 -2.25 -0.18 0.00 0.10 0.00 0.00 34.13 31.55 1ff9 s GLU 351 CO 0.26 0.17 0.81 -1.91 0.02 0.00 0.00 175.26 174.60 1ff9 n GLU 352 N -1.15 0.19 0.00 1.61 2.13 -1.26 -0.74 120.64 121.42 1ff9 n GLU 352 Ca -0.04 0.07 0.00 0.00 0.66 0.00 0.00 57.16 57.85 1ff9 n GLU 352 Cb 0.60 -1.32 0.00 0.00 0.27 0.00 0.00 31.44 30.99 1ff9 n GLU 352 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ff9 n GLY 353 N 1.80 2.99 3.80 8.31 0.00 -0.29 -4.83 105.19 116.98 1ff9 n GLY 353 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1ff9 n GLY 353 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ff9 s GLU 354 N -0.10 3.68 0.13 1.61 2.02 0.09 -4.51 118.70 121.62 1ff9 s GLU 354 Ca 0.00 1.28 0.08 0.00 0.02 0.00 0.00 54.97 56.35 1ff9 s GLU 354 Cb 0.00 -2.08 -0.04 0.00 0.10 0.00 0.00 34.13 32.11 1ff9 s GLU 354 CO 0.00 -0.52 -0.13 1.03 0.02 0.00 0.00 175.26 175.66 1ff9 s ARG 355 N -3.54 1.96 0.44 1.61 0.52 -1.26 -1.20 118.95 117.48 1ff9 s ARG 355 Ca 0.65 -1.15 -0.01 0.00 -0.52 0.00 0.00 55.73 54.71 1ff9 s ARG 355 Cb -0.16 -2.19 -0.01 0.00 0.52 0.00 0.00 34.95 33.11 1ff9 s ARG 355 CO 0.25 0.48 0.68 0.34 0.02 0.00 0.00 175.30 177.07 1ff9 s ASP 356 N -2.31 5.99 -0.13 0.23 2.15 -1.26 -1.76 116.67 119.58 1ff9 s ASP 356 Ca 0.21 0.45 -0.06 0.00 0.43 0.00 0.00 52.55 53.58 1ff9 s ASP 356 Cb -0.10 -1.77 0.06 0.00 -0.30 0.00 0.00 42.92 40.81 1ff9 s ASP 356 CO 0.12 -0.61 0.29 -0.22 -0.17 0.00 0.00 175.17 174.58 1ff9 s LEU 357 N -4.56 0.03 -0.15 -1.34 2.96 0.67 -0.73 118.68 115.56 1ff9 s LEU 357 Ca 0.47 0.63 0.01 0.00 -0.22 0.00 0.00 54.13 55.02 1ff9 s LEU 357 Cb -0.10 0.85 0.00 0.00 0.50 0.00 0.00 46.19 47.45 1ff9 s LEU 357 CO 0.39 -0.20 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.36 1ff9 s VAL 358 N 1.75 2.50 -0.16 1.68 1.01 0.53 -0.26 120.40 127.45 1ff9 s VAL 358 Ca -0.05 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.11 1ff9 s VAL 358 Cb -0.11 -2.04 0.02 0.00 0.00 0.00 0.00 36.38 34.25 1ff9 s VAL 358 CO -0.09 0.53 -0.18 -0.32 0.00 0.00 0.00 175.10 175.03 1ff9 s MET 359 N 0.78 2.69 -0.09 2.72 1.75 -0.96 -0.91 119.30 125.27 1ff9 s MET 359 Ca -0.06 -0.71 0.00 0.00 -1.25 0.00 0.00 55.69 53.67 1ff9 s MET 359 Cb -0.15 -2.34 0.02 0.00 2.84 0.00 0.00 34.83 35.20 1ff9 s MET 359 CO 0.00 -0.19 -0.09 -1.17 -0.65 0.00 0.00 175.02 172.93 1ff9 s LEU 360 N 1.29 1.32 -0.10 4.11 2.96 0.41 -1.35 118.68 127.31 1ff9 s LEU 360 Ca 0.03 -0.28 -0.04 0.00 -0.22 0.00 0.00 54.13 53.62 1ff9 s LEU 360 Cb -0.13 -0.80 0.05 0.00 0.50 0.00 0.00 46.19 45.81 1ff9 s LEU 360 CO -0.10 -0.07 0.21 -1.58 -1.32 0.00 0.00 176.35 173.48 1ff9 s GLN 361 N 1.34 0.11 0.11 1.98 0.74 0.13 -0.93 119.66 123.14 1ff9 s GLN 361 Ca -0.02 0.59 -0.10 0.00 0.05 0.00 0.00 55.36 55.88 1ff9 s GLN 361 Cb -0.14 -0.16 -0.06 0.00 1.10 0.00 0.00 33.01 33.76 1ff9 s GLN 361 CO -0.04 -0.25 0.43 -1.01 -0.55 0.00 0.00 175.29 173.87 1ff9 s HIS 362 N 1.97 3.56 -0.04 1.67 3.76 0.02 -1.87 115.29 124.36 1ff9 s HIS 362 Ca -0.02 0.81 0.01 0.00 -0.15 0.00 0.00 55.06 55.71 1ff9 s HIS 362 Cb -0.12 -2.18 0.02 0.00 1.11 0.00 0.00 32.58 31.41 1ff9 s HIS 362 CO -0.07 0.47 -0.04 0.21 -0.85 0.00 0.00 174.74 174.47 1ff9 s LYS 363 N -2.09 0.70 -0.17 1.40 2.20 0.21 -1.66 119.74 120.34 1ff9 s LYS 363 Ca 0.36 -0.07 0.00 0.00 -0.36 0.00 0.00 55.97 55.90 1ff9 s LYS 363 Cb -0.14 -0.74 0.04 0.00 -1.51 0.00 0.00 37.83 35.48 1ff9 s LYS 363 CO 0.19 -0.08 -0.09 -0.06 -0.36 0.00 0.00 175.35 174.95 1ff9 s PHE 364 N 0.88 2.06 -0.33 4.03 0.40 0.56 -0.72 117.98 124.85 1ff9 s PHE 364 Ca -0.11 -1.29 -0.20 0.00 -0.60 0.00 0.00 56.93 54.74 1ff9 s PHE 364 Cb -0.14 -1.49 -0.00 0.00 0.51 0.00 0.00 43.02 41.89 1ff9 s PHE 364 CO -0.00 -0.67 0.60 -1.21 0.70 0.00 0.00 175.22 174.63 1ff9 s GLU 365 N 1.52 3.76 0.03 0.44 2.02 -0.83 -1.09 118.70 124.55 1ff9 s GLU 365 Ca 0.01 0.10 0.04 0.00 0.02 0.00 0.00 54.97 55.14 1ff9 s GLU 365 Cb -0.15 -3.77 -0.03 0.00 0.10 0.00 0.00 34.13 30.27 1ff9 s GLU 365 CO -0.09 -0.63 -0.09 0.42 0.02 0.00 0.00 175.26 174.89 1ff9 s ILE 366 N 2.57 3.49 -0.33 -1.63 1.01 0.31 -1.90 121.20 124.73 1ff9 s ILE 366 Ca 0.23 -0.91 -0.04 0.00 0.00 0.00 0.00 60.65 59.93 1ff9 s ILE 366 Cb -0.15 -2.53 0.05 0.00 0.01 0.00 0.00 42.46 39.84 1ff9 s ILE 366 CO 0.13 0.34 0.08 -0.70 0.00 0.00 0.00 174.94 174.78 1ff9 s GLU 367 N -1.56 2.50 0.83 2.79 2.12 -0.79 -0.70 118.70 123.88 1ff9 s GLU 367 Ca 0.18 -1.27 -0.11 0.00 0.36 0.00 0.00 54.97 54.12 1ff9 s GLU 367 Cb -0.11 -3.37 0.09 0.00 0.26 0.00 0.00 34.13 31.00 1ff9 s GLU 367 CO 0.08 -0.69 1.09 -0.80 -0.54 0.00 0.00 175.26 174.41 1ff9 s ASN 368 N 1.41 4.14 0.36 -1.70 0.01 0.15 -1.39 114.94 117.92 1ff9 s ASN 368 Ca -0.02 1.49 0.10 0.00 -0.71 0.00 0.00 52.86 53.72 1ff9 s ASN 368 Cb -0.20 -2.21 0.84 0.00 0.41 0.00 0.00 41.25 40.09 1ff9 s ASN 368 CO 0.01 -2.22 1.87 0.50 -1.51 0.00 0.00 177.10 175.75 1ff9 h LYS 369 N -1.26 0.64 0.00 -0.60 3.64 -1.79 0.38 116.57 117.58 1ff9 h LYS 369 Ca -0.47 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1ff9 h LYS 369 Cb 1.26 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1ff9 h LYS 369 CO 0.56 0.43 0.00 -0.40 -2.27 0.00 0.00 179.45 177.76 1ff9 n ASP 370 N -4.56 0.00 0.00 4.20 5.68 -1.26 -4.83 116.55 115.78 1ff9 n ASP 370 Ca 0.17 -1.70 0.00 0.00 -0.50 0.00 0.00 54.79 52.76 1ff9 n ASP 370 Cb 0.49 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.47 1ff9 n ASP 370 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ff9 n GLY 371 N 0.39 2.93 3.39 6.12 0.00 0.13 -5.00 105.19 113.15 1ff9 n GLY 371 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 1ff9 n GLY 371 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ff9 n SER 372 N 0.27 -2.59 -4.28 1.61 7.64 -1.26 -4.54 113.62 110.48 1ff9 n SER 372 Ca 0.00 -0.41 -0.16 0.00 1.01 0.00 0.00 58.87 59.31 1ff9 n SER 372 Cb 0.00 -1.17 -0.10 0.00 -1.01 0.00 0.00 64.21 61.92 1ff9 n SER 372 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1ff9 s ARG 373 N -4.57 1.14 0.04 1.43 0.52 -1.26 0.34 118.95 116.60 1ff9 s ARG 373 Ca 0.69 -1.48 -0.27 0.00 -0.52 0.00 0.00 55.73 54.14 1ff9 s ARG 373 Cb -0.22 -0.79 0.09 0.00 0.52 0.00 0.00 34.95 34.55 1ff9 s ARG 373 CO 0.63 0.11 0.74 -1.83 0.02 0.00 0.00 175.30 174.98 1ff9 s GLU 374 N -3.66 1.03 -0.13 3.54 -1.05 0.12 -4.91 118.70 113.65 1ff9 s GLU 374 Ca 0.18 -0.24 0.03 0.00 -0.15 0.00 0.00 54.97 54.79 1ff9 s GLU 374 Cb 0.01 0.48 0.01 0.00 -0.44 0.00 0.00 34.13 34.19 1ff9 s GLU 374 CO 0.03 -0.42 -0.22 0.99 0.95 0.00 0.00 175.26 176.58 1ff9 s THR 375 N -2.87 2.07 0.08 1.83 2.01 -1.16 0.11 115.64 117.71 1ff9 s THR 375 Ca -0.00 -0.99 0.08 0.00 0.31 0.00 0.00 61.69 61.10 1ff9 s THR 375 Cb -0.01 -1.81 -0.03 0.00 0.01 0.00 0.00 72.50 70.66 1ff9 s THR 375 CO -0.06 0.55 -0.22 -0.60 -0.69 0.00 0.00 174.62 173.59 1ff9 s ARG 376 N 0.71 1.33 0.21 4.92 3.52 -0.25 0.11 118.95 129.49 1ff9 s ARG 376 Ca -0.10 -1.11 0.09 0.00 -0.13 0.00 0.00 55.73 54.48 1ff9 s ARG 376 Cb -0.16 -1.57 -0.05 0.00 -1.56 0.00 0.00 34.95 31.61 1ff9 s ARG 376 CO 0.01 0.38 -0.16 0.95 -0.81 0.00 0.00 175.30 175.67 1ff9 s THR 377 N -0.99 1.87 -0.16 4.11 -4.23 0.14 -0.33 115.64 116.06 1ff9 s THR 377 Ca 0.08 -2.17 -0.03 0.00 -1.18 0.00 0.00 61.69 58.40 1ff9 s THR 377 Cb -0.10 -2.03 0.05 0.00 1.34 0.00 0.00 72.50 71.76 1ff9 s THR 377 CO 0.03 -0.50 0.03 -0.55 -0.54 0.00 0.00 174.62 173.09 1ff9 s SER 378 N -3.19 2.58 0.17 3.99 0.15 -0.66 -1.56 113.70 115.18 1ff9 s SER 378 Ca 0.22 -0.64 0.08 0.00 0.70 0.00 0.00 55.95 56.31 1ff9 s SER 378 Cb -0.03 -0.55 -0.04 0.00 -1.71 0.00 0.00 66.02 63.69 1ff9 s SER 378 CO 0.08 -0.28 -0.17 -0.44 1.20 0.00 0.00 173.24 173.63 1ff9 s SER 379 N 1.89 2.63 -0.11 5.45 0.01 -0.53 -0.80 113.70 122.25 1ff9 s SER 379 Ca 0.01 -0.89 -0.04 0.00 1.31 0.00 0.00 55.95 56.33 1ff9 s SER 379 Cb -0.16 -0.15 0.06 0.00 0.21 0.00 0.00 66.02 65.98 1ff9 s SER 379 CO -0.07 -0.07 0.22 -0.22 0.41 0.00 0.00 173.24 173.51 1ff9 s LEU 380 N -2.79 -0.10 -0.11 2.44 2.96 -0.11 -0.74 118.68 120.23 1ff9 s LEU 380 Ca 0.17 0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 54.56 1ff9 s LEU 380 Cb -0.05 0.56 0.03 0.00 0.50 0.00 0.00 46.19 47.23 1ff9 s LEU 380 CO 0.07 -0.23 -0.01 0.00 -1.32 0.00 0.00 176.35 174.85 1ff9 s GLU 382 N 1.86 0.01 0.03 0.00 2.12 -0.08 -4.98 118.70 117.66 1ff9 s GLU 382 Ca 0.03 0.04 -0.03 0.00 0.36 0.00 0.00 54.97 55.38 1ff9 s GLU 382 Cb -0.14 -0.02 -0.04 0.00 0.26 0.00 0.00 34.13 34.19 1ff9 s GLU 382 CO -0.07 -0.02 0.23 0.71 -0.54 0.00 0.00 175.26 175.57 1ff9 s TYR 383 N 0.13 3.54 0.73 5.30 1.51 -1.26 -0.35 117.35 126.96 1ff9 s TYR 383 Ca -0.01 0.39 -0.06 0.00 -1.01 0.00 0.00 57.07 56.39 1ff9 s TYR 383 Cb -0.02 -1.86 0.10 0.00 -0.11 0.00 0.00 41.96 40.07 1ff9 s TYR 383 CO -0.00 0.60 1.03 0.20 -1.11 0.00 0.00 175.55 176.27 1ff9 s GLY 384 N -2.09 1.74 0.38 0.71 0.00 0.09 -4.50 107.32 103.65 1ff9 s GLY 384 Ca 0.31 -1.23 -0.21 0.00 0.00 0.00 0.00 44.72 43.59 1ff9 s GLY 384 CO 0.21 -0.74 0.90 0.00 0.00 0.00 0.00 173.10 173.47 1ff9 s ALA 385 N -3.27 3.14 0.34 3.20 0.00 0.07 -4.27 121.76 120.97 1ff9 s ALA 385 Ca 0.64 0.34 -0.27 0.00 0.00 0.00 0.00 51.96 52.67 1ff9 s ALA 385 Cb -0.08 -3.07 -0.13 0.00 0.00 0.00 0.00 23.12 19.85 1ff9 s ALA 385 CO 0.45 0.19 1.10 -2.30 0.00 0.00 0.00 175.76 175.20 1ff9 n PRO 386 N -0.33 1.60 -1.74 0.00 -0.02 -1.26 -4.64 135.00 128.61 1ff9 n PRO 386 Ca 0.05 0.56 -0.39 0.00 -2.02 0.00 0.00 63.50 61.70 1ff9 n PRO 386 Cb 0.53 -2.05 0.03 0.00 -0.02 0.00 0.00 33.50 31.99 1ff9 n PRO 386 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1ff9 n ILE 387 N 0.07 3.31 -0.13 4.25 2.08 -0.34 -1.56 119.36 127.04 1ff9 n ILE 387 Ca 0.08 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.89 1ff9 n ILE 387 Cb 0.35 -1.71 0.00 0.00 -0.75 0.00 0.00 39.64 37.53 1ff9 n ILE 387 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1ff9 n GLY 388 N 0.71 2.47 0.03 7.39 0.00 -1.26 -1.14 105.19 113.39 1ff9 n GLY 388 Ca 0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 1ff9 n GLY 388 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ff9 n SER 389 N 0.00 0.42 0.00 1.61 3.41 -0.60 -4.93 113.62 113.53 1ff9 n SER 389 Ca 0.00 0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 1ff9 n SER 389 Cb 0.00 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 1ff9 n SER 389 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ff9 n GLY 390 N 1.43 2.39 3.61 5.00 0.00 -1.26 -5.03 105.19 111.33 1ff9 n GLY 390 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1ff9 n GLY 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ff9 n GLY 391 N -2.00 -1.77 3.87 -0.02 0.00 -1.26 -5.05 105.19 98.95 1ff9 n GLY 391 Ca 0.00 -1.66 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 1ff9 n GLY 391 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ff9 s TYR 392 N -3.58 3.48 0.71 1.61 2.02 -1.26 -4.78 117.35 115.54 1ff9 s TYR 392 Ca 0.71 0.93 -0.11 0.00 -0.37 0.00 0.00 57.07 58.22 1ff9 s TYR 392 Cb -0.03 -2.29 0.02 0.00 -0.40 0.00 0.00 41.96 39.26 1ff9 s TYR 392 CO 0.51 0.32 1.09 -1.54 -1.57 0.00 0.00 175.55 174.35 1ff9 s SER 393 N -2.17 5.35 0.19 2.29 1.04 -1.26 -0.75 113.70 118.39 1ff9 s SER 393 Ca 0.44 1.24 -0.10 0.00 0.48 0.00 0.00 55.95 58.01 1ff9 s SER 393 Cb -0.12 -2.06 0.10 0.00 0.10 0.00 0.00 66.02 64.03 1ff9 s SER 393 CO 0.20 -1.41 1.72 0.00 0.98 0.00 0.00 173.24 174.74 1ff9 h ALA 394 N -0.70 0.86 -0.41 5.32 0.00 -1.85 -2.03 119.26 120.45 1ff9 h ALA 394 Ca -0.45 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.23 1ff9 h ALA 394 Cb 1.24 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1ff9 h ALA 394 CO 0.62 0.53 0.15 1.98 0.00 0.00 0.00 179.25 182.53 1ff9 h MET 395 N 0.95 0.62 -0.39 0.00 1.85 -1.92 -1.05 114.93 115.00 1ff9 h MET 395 Ca 0.21 -0.12 -0.01 0.00 -0.61 0.00 0.00 59.70 59.18 1ff9 h MET 395 Cb 0.28 -0.10 -0.02 0.00 0.43 0.00 0.00 31.60 32.19 1ff9 h MET 395 CO -0.01 0.60 0.22 0.00 -0.40 0.00 0.00 176.91 177.32 1ff9 h ALA 396 N 1.00 0.50 0.08 0.39 0.00 -1.86 -2.01 119.26 117.36 1ff9 h ALA 396 Ca 0.14 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1ff9 h ALA 396 Cb 0.21 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ff9 h ALA 396 CO -0.01 0.02 -0.04 -0.22 0.00 0.00 0.00 179.25 179.00 1ff9 h LYS 397 N 0.50 -0.10 0.00 0.00 3.64 -1.24 0.11 116.57 119.49 1ff9 h LYS 397 Ca 0.14 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1ff9 h LYS 397 Cb 0.04 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.89 1ff9 h LYS 397 CO -0.02 0.09 0.00 -0.07 -2.27 0.00 0.00 179.45 177.18 1ff9 h LEU 398 N -0.29 0.00 0.00 5.20 3.38 -1.14 -0.33 115.31 122.13 1ff9 h LEU 398 Ca -0.01 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.55 1ff9 h LEU 398 Cb 0.25 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.94 1ff9 h LEU 398 CO 0.02 0.00 -2.27 1.33 0.09 0.00 0.00 178.44 177.61 1ff9 n VAL 399 N -2.67 1.53 -0.13 1.22 0.24 -0.76 -3.00 118.33 114.76 1ff9 n VAL 399 Ca 0.01 -0.33 -0.08 0.00 -2.04 0.00 0.00 64.34 61.90 1ff9 n VAL 399 Cb 0.24 -1.88 0.07 0.00 -1.47 0.00 0.00 33.84 30.80 1ff9 n VAL 399 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1ff9 h GLY 400 N -0.76 0.95 0.66 7.63 0.00 -0.74 -3.03 103.07 107.78 1ff9 h GLY 400 Ca -0.62 -0.77 -0.05 0.00 0.00 0.00 0.00 47.33 45.89 1ff9 h GLY 400 CO -0.35 0.71 -0.13 -2.08 0.00 0.00 0.00 176.54 174.68 1ff9 h VAL 401 N 0.78 1.38 -0.91 4.60 2.07 -1.22 -1.69 116.25 121.25 1ff9 h VAL 401 Ca 0.12 -1.35 0.08 0.00 0.82 0.00 0.00 66.70 66.36 1ff9 h VAL 401 Cb 0.68 2.05 -0.06 0.00 -1.52 0.00 0.00 31.29 32.44 1ff9 h VAL 401 CO 0.05 0.38 0.59 -0.65 0.02 0.00 0.00 177.57 177.97 1ff9 h PRO 402 N -0.18 0.96 -0.28 1.57 0.11 -1.75 0.01 132.00 132.44 1ff9 h PRO 402 Ca 0.01 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 66.05 1ff9 h PRO 402 Cb 0.68 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 1ff9 h PRO 402 CO 0.03 0.63 0.12 0.00 -0.21 0.00 0.00 178.00 178.57 1ff9 h ALA 404 N 0.96 1.04 -0.39 0.00 0.00 -0.48 -0.98 119.26 119.41 1ff9 h ALA 404 Ca 0.09 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ff9 h ALA 404 Cb 0.17 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1ff9 h ALA 404 CO -0.01 0.55 0.16 0.28 0.00 0.00 0.00 179.25 180.23 1ff9 h VAL 405 N 1.13 1.19 -0.76 0.00 2.07 -0.81 -1.52 116.25 117.55 1ff9 h VAL 405 Ca 0.29 -0.59 0.02 0.00 0.82 0.00 0.00 66.70 67.23 1ff9 h VAL 405 Cb 0.03 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.61 1ff9 h VAL 405 CO -0.05 0.21 0.50 0.00 0.02 0.00 0.00 177.57 178.26 1ff9 h ALA 406 N 1.00 0.98 -0.60 1.67 0.00 -0.82 -1.26 119.26 120.24 1ff9 h ALA 406 Ca 0.13 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.04 1ff9 h ALA 406 Cb 0.19 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1ff9 h ALA 406 CO -0.01 0.34 0.34 0.28 0.00 0.00 0.00 179.25 180.21 1ff9 h VAL 407 N 1.00 1.02 -0.34 0.00 2.07 -0.84 -0.58 116.25 118.57 1ff9 h VAL 407 Ca 0.29 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.51 1ff9 h VAL 407 Cb -0.07 0.30 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 1ff9 h VAL 407 CO -0.08 0.12 -0.08 0.11 0.02 0.00 0.00 177.57 177.66 1ff9 h LYS 408 N 0.66 0.57 -0.08 1.57 1.57 -0.55 -1.75 116.57 118.57 1ff9 h LYS 408 Ca 0.25 -0.16 -0.17 0.00 -1.87 0.00 0.00 60.65 58.71 1ff9 h LYS 408 Cb 0.09 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1ff9 h LYS 408 CO -0.14 0.65 -0.68 0.74 -0.57 0.00 0.00 179.45 179.46 1ff9 h PHE 409 N 0.53 0.44 -0.11 -1.35 0.04 -0.50 -1.48 116.94 114.51 1ff9 h PHE 409 Ca 0.10 -0.18 -0.19 0.00 2.80 0.00 0.00 57.97 60.50 1ff9 h PHE 409 Cb 0.46 -0.07 -0.00 0.00 2.20 0.00 0.00 35.95 38.54 1ff9 h PHE 409 CO 0.02 0.90 -0.73 0.28 -0.60 0.00 0.00 178.31 178.19 1ff9 h VAL 410 N 0.23 1.34 -0.16 -0.55 2.07 -0.94 0.18 116.25 118.43 1ff9 h VAL 410 Ca -0.02 -2.06 -0.11 0.00 0.82 0.00 0.00 66.70 65.33 1ff9 h VAL 410 Cb 1.22 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 33.02 1ff9 h VAL 410 CO 0.11 0.63 -0.40 -0.07 0.02 0.00 0.00 177.57 177.86 1ff9 h LEU 411 N 0.37 0.37 -1.17 2.57 3.38 -1.21 -3.20 115.31 116.41 1ff9 h LEU 411 Ca -0.03 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1ff9 h LEU 411 Cb 1.31 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1ff9 h LEU 411 CO 0.13 0.73 -0.34 -0.90 0.09 0.00 0.00 178.44 178.16 1ff9 n ASP 412 N -4.03 2.17 0.00 -0.43 5.68 -0.57 -4.97 116.55 114.39 1ff9 n ASP 412 Ca -0.01 -1.58 0.00 0.00 -0.50 0.00 0.00 54.79 52.69 1ff9 n ASP 412 Cb 0.49 0.33 0.00 0.00 -1.14 0.00 0.00 41.12 40.80 1ff9 n ASP 412 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ff9 n GLY 413 N 1.39 0.51 0.36 6.12 0.00 -0.59 -4.95 105.19 108.04 1ff9 n GLY 413 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.13 1ff9 n GLY 413 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ff9 h THR 414 N 0.00 1.18 -3.57 2.61 2.02 -0.99 -3.28 112.91 110.88 1ff9 h THR 414 Ca 0.00 -0.39 -0.70 0.00 0.77 0.00 0.00 66.41 66.09 1ff9 h THR 414 Cb 0.00 -0.05 -0.30 0.00 -1.74 0.00 0.00 68.15 66.07 1ff9 h THR 414 CO 0.00 0.21 -0.55 -0.63 0.37 0.00 0.00 175.52 174.91 1ff9 s ILE 415 N -5.95 3.81 -0.43 3.11 1.01 -0.64 -4.94 121.20 117.16 1ff9 s ILE 415 Ca -0.12 -1.39 0.04 0.00 0.00 0.00 0.00 60.65 59.19 1ff9 s ILE 415 Cb 0.18 -3.29 0.01 0.00 0.01 0.00 0.00 42.46 39.37 1ff9 s ILE 415 CO 0.80 -0.37 0.48 -1.54 0.00 0.00 0.00 174.94 174.31 1ff9 n SER 416 N 4.80 0.97 -4.75 3.58 3.41 -1.24 -4.35 113.62 116.03 1ff9 n SER 416 Ca -0.10 -0.98 -0.41 0.00 -0.26 0.00 0.00 58.87 57.11 1ff9 n SER 416 Cb 0.43 0.34 -0.02 0.00 -0.26 0.00 0.00 64.21 64.71 1ff9 n SER 416 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1ff9 s ASP 417 N -0.72 6.57 0.30 4.04 1.01 -1.26 -4.98 116.67 121.64 1ff9 s ASP 417 Ca 0.04 2.78 0.00 0.00 0.71 0.00 0.00 52.55 56.08 1ff9 s ASP 417 Cb 0.03 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 1ff9 s ASP 417 CO 0.09 -0.74 0.50 -0.13 0.21 0.00 0.00 175.17 175.10 1ff9 s ARG 418 N -0.88 3.50 0.00 8.23 1.81 -1.26 -4.57 118.95 125.79 1ff9 s ARG 418 Ca 0.57 -0.34 0.00 0.00 -1.72 0.00 0.00 55.73 54.25 1ff9 s ARG 418 Cb -0.43 -2.71 0.00 0.00 -0.45 0.00 0.00 34.95 31.35 1ff9 s ARG 418 CO 0.49 0.23 0.00 0.41 -0.68 0.00 0.00 175.30 175.74 1ff9 n GLY 419 N -1.46 -0.64 3.48 -3.53 0.00 0.07 -4.82 105.19 98.30 1ff9 n GLY 419 Ca -0.05 -2.17 -0.43 0.00 0.00 0.00 0.00 46.02 43.37 1ff9 n GLY 419 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ff9 s VAL 420 N 0.00 5.18 0.40 1.61 1.01 -1.26 -0.59 120.40 126.75 1ff9 s VAL 420 Ca 0.00 -0.45 0.07 0.00 0.00 0.00 0.00 61.98 61.61 1ff9 s VAL 420 Cb 0.00 -3.96 -0.06 0.00 0.00 0.00 0.00 36.38 32.36 1ff9 s VAL 420 CO 0.00 -0.32 0.08 -0.76 0.00 0.00 0.00 175.10 174.10 1ff9 s LEU 421 N 1.90 3.00 0.07 3.92 1.43 0.69 -4.99 118.68 124.70 1ff9 s LEU 421 Ca 0.09 -1.19 -0.07 0.00 -1.03 0.00 0.00 54.13 51.93 1ff9 s LEU 421 Cb -0.18 -1.20 -0.01 0.00 0.03 0.00 0.00 46.19 44.83 1ff9 s LEU 421 CO 0.12 -0.46 0.13 0.00 0.23 0.00 0.00 176.35 176.37 1ff9 s ALA 422 N -2.64 -0.06 -1.19 4.21 0.00 -1.26 -1.27 121.76 119.55 1ff9 s ALA 422 Ca 0.38 -0.71 -0.19 0.00 0.00 0.00 0.00 51.96 51.43 1ff9 s ALA 422 Cb 0.06 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.55 1ff9 s ALA 422 CO 0.20 -0.45 1.93 -2.30 0.00 0.00 0.00 175.76 175.15 1ff9 n PRO 423 N 0.12 2.33 -0.37 0.00 -0.02 -1.26 -4.64 135.00 131.16 1ff9 n PRO 423 Ca -0.16 -2.62 0.07 0.00 -2.02 0.00 0.00 63.50 58.78 1ff9 n PRO 423 Cb 0.61 -3.40 0.23 0.00 -0.02 0.00 0.00 33.50 30.93 1ff9 n PRO 423 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1ff9 n MET 424 N 7.60 3.06 -3.52 -0.52 2.81 -1.26 -4.58 117.12 120.71 1ff9 n MET 424 Ca 0.49 -2.55 -0.09 0.00 -1.81 0.00 0.00 57.70 53.74 1ff9 n MET 424 Cb 0.44 -1.64 -0.02 0.00 -0.71 0.00 0.00 33.22 31.29 1ff9 n MET 424 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1ff9 s ASN 425 N -1.41 -0.42 0.52 7.83 2.20 -1.26 -5.00 114.94 117.39 1ff9 s ASN 425 Ca 0.36 -0.08 0.24 0.00 -0.94 0.00 0.00 52.86 52.44 1ff9 s ASN 425 Cb 0.25 0.50 1.40 0.00 -2.00 0.00 0.00 41.25 41.41 1ff9 s ASN 425 CO 0.14 -0.84 2.09 0.77 -2.94 0.00 0.00 177.10 176.32 1ff9 h SER 426 N 2.00 0.00 -1.01 3.54 4.64 -1.95 0.28 113.55 121.05 1ff9 h SER 426 Ca -0.27 0.00 0.05 0.00 -0.47 0.00 0.00 61.79 61.10 1ff9 h SER 426 Cb 1.27 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.29 1ff9 h SER 426 CO 0.32 0.11 0.66 0.50 -0.87 0.00 0.00 176.83 177.55 1ff9 h LYS 427 N 0.00 1.20 0.06 4.77 3.64 -2.01 -1.22 116.57 123.01 1ff9 h LYS 427 Ca -0.00 -0.07 -0.34 0.00 -1.27 0.00 0.00 60.65 58.97 1ff9 h LYS 427 Cb 0.26 -0.27 -0.04 0.00 -0.41 0.00 0.00 32.23 31.77 1ff9 h LYS 427 CO 0.01 0.79 -1.91 -0.89 -2.27 0.00 0.00 179.45 175.19 1ff9 n ILE 428 N -4.47 1.64 -0.13 2.00 5.41 -0.93 -4.59 119.36 118.29 1ff9 n ILE 428 Ca 0.15 -0.43 -0.10 0.00 1.00 0.00 0.00 62.75 63.37 1ff9 n ILE 428 Cb 0.14 -1.80 0.04 0.00 -0.71 0.00 0.00 39.64 37.31 1ff9 n ILE 428 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 176.55 177.33 1ff9 h ASN 429 N -0.37 0.92 0.13 4.38 -0.26 -0.42 -3.22 115.58 116.75 1ff9 h ASN 429 Ca -0.45 -0.34 -0.01 0.00 -0.56 0.00 0.00 56.30 54.94 1ff9 h ASN 429 Cb 1.76 -0.25 0.00 0.00 -1.06 0.00 0.00 38.32 38.76 1ff9 h ASN 429 CO -0.08 1.10 -0.06 0.44 -1.06 0.00 0.00 177.43 177.76 1ff9 h ASP 430 N 0.79 -0.15 -0.84 5.81 3.32 -1.44 0.00 116.42 123.91 1ff9 h ASP 430 Ca 0.11 -0.02 0.05 0.00 0.02 0.00 0.00 57.03 57.18 1ff9 h ASP 430 Cb 0.75 0.04 -0.06 0.00 0.22 0.00 0.00 39.33 40.29 1ff9 h ASP 430 CO 0.06 -0.08 0.53 -0.65 -1.72 0.00 0.00 179.24 177.38 1ff9 h PRO 431 N -0.21 0.96 -0.40 3.56 0.11 -1.78 -1.07 132.00 133.17 1ff9 h PRO 431 Ca -0.02 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.04 1ff9 h PRO 431 Cb 0.17 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.04 1ff9 h PRO 431 CO 0.03 0.64 0.26 -0.07 -0.21 0.00 0.00 178.00 178.64 1ff9 h LEU 432 N 0.99 0.44 -0.60 2.35 3.38 -1.49 -2.05 115.31 118.33 1ff9 h LEU 432 Ca 0.35 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.20 1ff9 h LEU 432 Cb 0.09 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1ff9 h LEU 432 CO -0.15 0.32 -0.09 0.24 0.09 0.00 0.00 178.44 178.85 1ff9 h MET 433 N 0.52 1.02 -0.24 1.13 2.86 -0.56 -2.21 114.93 117.45 1ff9 h MET 433 Ca 0.15 -0.36 -0.01 0.00 -2.06 0.00 0.00 59.70 57.42 1ff9 h MET 433 Cb -0.05 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 31.53 1ff9 h MET 433 CO -0.04 1.05 0.13 -0.22 1.06 0.00 0.00 176.91 178.89 1ff9 h LYS 434 N 0.91 0.34 -0.37 1.72 3.64 -1.01 -0.91 116.57 120.89 1ff9 h LYS 434 Ca 0.15 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.43 1ff9 h LYS 434 Cb 0.65 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 1ff9 h LYS 434 CO 0.05 0.33 0.03 1.49 -2.27 0.00 0.00 179.45 179.07 1ff9 h GLU 435 N 0.28 0.64 -0.72 1.90 4.57 -1.37 0.78 114.58 120.65 1ff9 h GLU 435 Ca 0.09 -0.19 -0.01 0.00 -1.18 0.00 0.00 59.36 58.07 1ff9 h GLU 435 Cb 0.09 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 28.57 1ff9 h GLU 435 CO -0.01 0.72 0.40 -0.07 -1.18 0.00 0.00 179.01 178.87 1ff9 h LEU 436 N 0.47 0.90 0.00 1.64 3.38 -1.31 -0.57 115.31 119.82 1ff9 h LEU 436 Ca 0.11 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 1ff9 h LEU 436 Cb 0.41 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.93 1ff9 h LEU 436 CO 0.01 0.73 -0.01 0.50 0.09 0.00 0.00 178.44 179.76 1ff9 h LYS 437 N 0.99 0.00 -0.42 1.13 3.64 -0.88 1.00 116.57 122.04 1ff9 h LYS 437 Ca 0.26 -0.01 -0.12 0.00 -1.27 0.00 0.00 60.65 59.50 1ff9 h LYS 437 Cb 0.03 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1ff9 h LYS 437 CO -0.04 0.90 -0.24 0.93 -2.27 0.00 0.00 179.45 178.74 1ff9 h GLU 438 N -0.89 0.86 0.01 1.90 5.08 -0.88 -0.52 114.58 120.14 1ff9 h GLU 438 Ca -0.00 -0.36 -0.33 0.00 -1.00 0.00 0.00 59.36 57.67 1ff9 h GLU 438 Cb 0.91 -0.03 -0.05 0.00 0.50 0.00 0.00 28.75 30.07 1ff9 h GLU 438 CO 0.00 1.00 -2.00 1.17 -1.00 0.00 0.00 179.01 178.19 1ff9 n LYS 439 N -4.10 0.66 0.00 2.33 4.81 -0.22 -4.58 118.16 117.06 1ff9 n LYS 439 Ca -0.00 0.19 0.01 0.00 -0.87 0.00 0.00 58.31 57.64 1ff9 n LYS 439 Cb 0.45 -1.68 0.01 0.00 0.02 0.00 0.00 35.03 33.82 1ff9 n LYS 439 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1ff9 n TYR 440 N -3.01 0.00 -1.67 5.64 4.02 -0.83 -4.99 117.16 116.31 1ff9 n TYR 440 Ca -0.25 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.50 1ff9 n TYR 440 Cb 1.08 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 40.36 1ff9 n TYR 440 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ff9 n GLY 441 N 0.29 0.90 3.61 2.72 0.00 -0.20 -4.94 105.19 107.57 1ff9 n GLY 441 Ca 0.01 -0.37 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 1ff9 n GLY 441 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ff9 s ILE 442 N -2.56 5.17 0.00 -0.61 1.01 0.24 -4.90 121.20 119.56 1ff9 s ILE 442 Ca 0.00 0.60 -0.29 0.00 0.00 0.00 0.00 60.65 60.95 1ff9 s ILE 442 Cb 0.00 -3.71 0.10 0.00 0.01 0.00 0.00 42.46 38.87 1ff9 s ILE 442 CO 0.00 0.16 1.11 -1.83 0.00 0.00 0.00 174.94 174.37 1ff9 s GLU 443 N 2.05 0.69 -0.11 2.79 -1.05 -1.26 -2.55 118.70 119.27 1ff9 s GLU 443 Ca 0.16 -0.34 -0.01 0.00 -0.15 0.00 0.00 54.97 54.62 1ff9 s GLU 443 Cb -0.16 0.26 -0.03 0.00 -0.44 0.00 0.00 34.13 33.76 1ff9 s GLU 443 CO 0.10 -0.31 -0.04 0.00 0.95 0.00 0.00 175.26 175.95 1ff9 s LYS 445 N -0.37 3.40 0.24 0.00 1.02 0.08 -4.78 119.74 119.34 1ff9 s LYS 445 Ca 0.06 -0.30 -0.12 0.00 0.02 0.00 0.00 55.97 55.64 1ff9 s LYS 445 Cb -0.12 -3.04 -0.08 0.00 -0.52 0.00 0.00 37.83 34.07 1ff9 s LYS 445 CO 0.02 0.62 0.60 -1.21 -0.92 0.00 0.00 175.35 174.46 1ff9 s GLU 446 N -0.60 3.88 -0.09 1.68 2.02 -1.26 -1.45 118.70 122.88 1ff9 s GLU 446 Ca 0.11 0.41 -0.28 0.00 0.02 0.00 0.00 54.97 55.23 1ff9 s GLU 446 Cb -0.12 -2.63 0.06 0.00 0.10 0.00 0.00 34.13 31.55 1ff9 s GLU 446 CO 0.02 0.30 0.64 0.21 0.02 0.00 0.00 175.26 176.45 1ff9 s LYS 447 N -2.75 0.96 0.25 1.61 2.20 -0.60 -4.98 119.74 116.42 1ff9 s LYS 447 Ca 0.48 0.37 0.07 0.00 -0.36 0.00 0.00 55.97 56.54 1ff9 s LYS 447 Cb -0.11 0.45 -0.04 0.00 -1.51 0.00 0.00 37.83 36.62 1ff9 s LYS 447 CO 0.20 -0.26 0.17 0.08 -0.36 0.00 0.00 175.35 175.18 1ff9 s VAL 448 N -0.85 4.34 0.00 4.02 1.01 -1.26 0.26 120.40 127.93 1ff9 s VAL 448 Ca -0.09 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 60.46 1ff9 s VAL 448 Cb -0.02 -3.33 0.00 0.00 0.00 0.00 0.00 36.38 33.03 1ff9 s VAL 448 CO 0.07 -0.33 0.00 0.52 0.00 0.00 0.00 175.10 175.36 1ff9 n VAL 449 N -1.09 0.00 -0.97 2.92 0.31 0.31 -4.95 118.33 114.86 1ff9 n VAL 449 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.25 1ff9 n VAL 449 Cb 0.58 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.51 1ff9 n VAL 449 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51