#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f1x s ILE 5 N 0.00 4.84 0.56 6.31 1.01 -1.26 -5.03 121.20 127.62 1f1x s ILE 5 Ca 0.00 1.25 -0.19 0.00 0.00 0.00 0.00 60.65 61.71 1f1x s ILE 5 Cb 0.00 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.32 1f1x s ILE 5 CO 0.00 -0.16 1.14 -2.16 0.00 0.00 0.00 174.94 173.76 1f1x s PRO 6 N 2.85 3.27 -0.25 2.79 0.04 -1.26 -4.77 135.00 137.68 1f1x s PRO 6 Ca 0.32 1.64 -0.28 0.00 0.04 0.00 0.00 61.00 62.71 1f1x s PRO 6 Cb -0.15 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.41 1f1x s PRO 6 CO 0.11 -0.92 1.02 0.21 0.04 0.00 0.00 177.00 177.46 1f1x s LYS 7 N -3.33 4.22 0.89 4.56 2.20 -1.26 -4.99 119.74 122.03 1f1x s LYS 7 Ca 0.73 1.27 -0.10 0.00 -0.36 0.00 0.00 55.97 57.51 1f1x s LYS 7 Cb -0.25 -3.66 0.13 0.00 -1.51 0.00 0.00 37.83 32.55 1f1x s LYS 7 CO 0.28 -0.66 1.14 -2.14 -0.36 0.00 0.00 175.35 173.62 1f1x s PRO 8 N 3.23 1.23 0.06 4.03 0.02 -1.26 -4.93 135.00 137.37 1f1x s PRO 8 Ca 0.43 1.50 -0.13 0.00 0.02 0.00 0.00 61.00 62.82 1f1x s PRO 8 Cb -0.15 -1.76 -0.29 0.00 0.02 0.00 0.00 34.50 32.33 1f1x s PRO 8 CO 0.08 -2.47 1.10 0.28 -0.33 0.00 0.00 177.00 175.66 1f1x h VAL 9 N -1.72 1.31 -3.87 3.83 2.07 -1.97 -3.45 116.25 112.45 1f1x h VAL 9 Ca -0.43 -2.55 -0.54 0.00 0.82 0.00 0.00 66.70 63.99 1f1x h VAL 9 Cb 1.26 2.76 0.11 0.00 -1.52 0.00 0.00 31.29 33.91 1f1x h VAL 9 CO 0.43 0.77 0.74 0.00 0.02 0.00 0.00 177.57 179.54 1f1x n ALA 10 N -2.67 2.25 -1.76 1.67 0.00 -1.26 -4.94 120.51 113.80 1f1x n ALA 10 Ca -0.13 0.33 -0.39 0.00 0.00 0.00 0.00 53.44 53.25 1f1x n ALA 10 Cb 1.00 -2.40 0.01 0.00 0.00 0.00 0.00 19.45 18.06 1f1x n ALA 10 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1f1x s PRO 11 N -2.12 3.72 0.46 0.00 0.04 -1.26 -4.89 135.00 130.94 1f1x s PRO 11 Ca 0.54 2.09 -0.22 0.00 0.04 0.00 0.00 61.00 63.46 1f1x s PRO 11 Cb -0.48 -2.55 -0.08 0.00 0.04 0.00 0.00 34.50 31.43 1f1x s PRO 11 CO 0.63 -0.68 1.08 0.00 0.04 0.00 0.00 177.00 178.08 1f1x s ALA 12 N -1.34 2.93 0.53 8.56 0.00 -1.26 -4.73 121.76 126.45 1f1x s ALA 12 Ca 0.62 0.74 -0.20 0.00 0.00 0.00 0.00 51.96 53.12 1f1x s ALA 12 Cb -0.37 -3.30 -0.06 0.00 0.00 0.00 0.00 23.12 19.39 1f1x s ALA 12 CO 0.45 -0.43 1.16 -1.25 0.00 0.00 0.00 175.76 175.70 1f1x s PRO 13 N -2.90 3.37 -0.63 0.00 0.04 -1.26 -4.94 135.00 128.68 1f1x s PRO 13 Ca 0.64 1.72 -0.25 0.00 0.04 0.00 0.00 61.00 63.16 1f1x s PRO 13 Cb -0.22 -2.10 0.05 0.00 0.04 0.00 0.00 34.50 32.27 1f1x s PRO 13 CO 0.27 -0.86 1.05 0.34 0.04 0.00 0.00 177.00 177.84 1f1x s ASP 14 N -1.60 6.25 -0.01 6.66 -1.08 -1.26 -4.95 116.67 120.68 1f1x s ASP 14 Ca 0.71 -0.56 -0.27 0.00 -0.52 0.00 0.00 52.55 51.91 1f1x s ASP 14 Cb -0.27 -2.47 -0.04 0.00 -1.46 0.00 0.00 42.92 38.68 1f1x s ASP 14 CO 0.31 -1.47 0.85 -0.63 0.52 0.00 0.00 175.17 174.75 1f1x s ILE 15 N 4.49 4.89 -0.18 4.11 1.01 -1.26 -1.10 121.20 133.17 1f1x s ILE 15 Ca 0.30 1.78 -0.23 0.00 0.00 0.00 0.00 60.65 62.50 1f1x s ILE 15 Cb -0.13 -4.19 -0.22 0.00 0.01 0.00 0.00 42.46 37.93 1f1x s ILE 15 CO 0.16 0.23 0.43 -0.07 0.00 0.00 0.00 174.94 175.68 1f1x h LEU 16 N 6.56 0.04 -7.17 2.97 3.38 -0.82 -3.46 115.31 116.81 1f1x h LEU 16 Ca -0.41 -0.70 0.33 0.00 0.09 0.00 0.00 57.88 57.19 1f1x h LEU 16 Cb 1.21 -0.01 -0.13 0.00 0.09 0.00 0.00 40.66 41.82 1f1x h LEU 16 CO 0.74 1.35 0.86 0.00 0.09 0.00 0.00 178.44 181.48 1f1x s ARG 17 N -2.33 0.32 0.20 1.13 1.70 -1.17 -3.46 118.95 115.35 1f1x s ARG 17 Ca -0.25 -0.18 -0.30 0.00 -0.47 0.00 0.00 55.73 54.53 1f1x s ARG 17 Cb 0.03 0.11 -0.09 0.00 -0.57 0.00 0.00 34.95 34.43 1f1x s ARG 17 CO 0.64 -0.15 1.43 0.00 -1.08 0.00 0.00 175.30 176.14 1f1x n ALA 19 N 2.95 2.33 -3.57 0.00 0.00 0.21 -4.83 120.51 117.59 1f1x n ALA 19 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.43 1f1x n ALA 19 Cb 0.41 0.48 -0.02 0.00 0.00 0.00 0.00 19.45 20.32 1f1x n ALA 19 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1f1x s TYR 20 N -1.97 -0.41 0.04 0.00 -0.85 -1.07 -4.34 117.35 108.74 1f1x s TYR 20 Ca 0.00 0.13 0.07 0.00 -0.52 0.00 0.00 57.07 56.75 1f1x s TYR 20 Cb 0.00 0.60 -0.02 0.00 0.38 0.00 0.00 41.96 42.92 1f1x s TYR 20 CO 0.00 -0.94 -0.19 0.00 -1.52 0.00 0.00 175.55 172.90 1f1x s ALA 21 N -3.74 1.63 -0.28 9.51 0.00 -0.80 -0.81 121.76 127.27 1f1x s ALA 21 Ca 0.05 -0.99 -0.06 0.00 0.00 0.00 0.00 51.96 50.96 1f1x s ALA 21 Cb -0.02 -0.32 0.01 0.00 0.00 0.00 0.00 23.12 22.78 1f1x s ALA 21 CO -0.06 0.36 0.04 -2.00 0.00 0.00 0.00 175.76 174.10 1f1x s GLU 22 N -1.10 3.12 -0.14 0.00 2.12 -0.04 -0.77 118.70 121.89 1f1x s GLU 22 Ca 0.06 -0.82 -0.03 0.00 0.36 0.00 0.00 54.97 54.54 1f1x s GLU 22 Cb -0.08 -3.27 -0.03 0.00 0.26 0.00 0.00 34.13 31.01 1f1x s GLU 22 CO 0.01 -0.39 -0.05 -0.51 -0.54 0.00 0.00 175.26 173.78 1f1x s LEU 23 N 1.48 3.18 0.07 2.70 1.43 -0.00 -0.55 118.68 126.98 1f1x s LEU 23 Ca 0.03 -0.14 -0.24 0.00 -1.03 0.00 0.00 54.13 52.75 1f1x s LEU 23 Cb -0.17 -1.75 -0.06 0.00 0.03 0.00 0.00 46.19 44.24 1f1x s LEU 23 CO 0.01 0.19 0.74 -0.69 0.23 0.00 0.00 176.35 176.84 1f1x s VAL 24 N 0.21 4.66 0.12 -1.59 1.01 0.75 -1.04 120.40 124.52 1f1x s VAL 24 Ca -0.03 1.59 0.07 0.00 0.00 0.00 0.00 61.98 63.61 1f1x s VAL 24 Cb -0.14 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 1f1x s VAL 24 CO 0.03 0.42 -0.16 0.68 0.00 0.00 0.00 175.10 176.07 1f1x s VAL 25 N -0.39 1.49 -0.09 2.92 -7.23 -0.12 -2.64 120.40 114.35 1f1x s VAL 25 Ca 0.37 -1.67 0.15 0.00 -1.81 0.00 0.00 61.98 59.01 1f1x s VAL 25 Cb -0.21 -1.55 -0.17 0.00 0.56 0.00 0.00 36.38 35.02 1f1x s VAL 25 CO 0.23 -0.30 0.79 0.71 -0.31 0.00 0.00 175.10 176.22 1f1x h THR 26 N 3.67 0.66 -3.30 5.32 1.35 -1.87 0.63 112.91 119.37 1f1x h THR 26 Ca -0.42 -2.30 -0.58 0.00 -0.55 0.00 0.00 66.41 62.56 1f1x h THR 26 Cb 1.19 2.21 -0.40 0.00 -1.73 0.00 0.00 68.15 69.43 1f1x h THR 26 CO 0.47 0.38 -0.76 -0.62 -0.25 0.00 0.00 175.52 174.74 1f1x s ASP 27 N -5.94 3.81 0.23 5.36 -1.08 -1.26 -4.74 116.67 113.06 1f1x s ASP 27 Ca -0.03 -1.42 -0.07 0.00 -0.52 0.00 0.00 52.55 50.50 1f1x s ASP 27 Cb 0.08 -0.91 0.21 0.00 -1.46 0.00 0.00 42.92 40.84 1f1x s ASP 27 CO 0.82 -0.36 1.87 0.25 0.52 0.00 0.00 175.17 178.27 1f1x h LEU 28 N 8.07 1.10 -0.32 -1.34 5.85 -1.94 -1.79 115.31 124.94 1f1x h LEU 28 Ca -0.14 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.51 1f1x h LEU 28 Cb 1.05 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.78 1f1x h LEU 28 CO 0.44 0.85 0.21 0.00 -0.34 0.00 0.00 178.44 179.60 1f1x h ALA 29 N 1.29 0.40 -0.73 1.25 0.00 -1.96 0.17 119.26 119.69 1f1x h ALA 29 Ca 0.32 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.16 1f1x h ALA 29 Cb -0.04 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1f1x h ALA 29 CO -0.06 -0.13 0.26 0.87 0.00 0.00 0.00 179.25 180.19 1f1x h LYS 30 N 0.43 1.10 -0.54 0.00 1.57 -1.95 -1.11 116.57 116.07 1f1x h LYS 30 Ca 0.12 -0.21 -0.10 0.00 -1.87 0.00 0.00 60.65 58.59 1f1x h LYS 30 Cb -0.04 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.08 1f1x h LYS 30 CO -0.02 0.92 -0.03 0.77 -0.57 0.00 0.00 179.45 180.51 1f1x h SER 31 N 1.07 0.97 -0.77 0.86 0.02 -0.96 -2.06 113.55 112.68 1f1x h SER 31 Ca 0.24 -0.32 -0.03 0.00 -0.84 0.00 0.00 61.79 60.83 1f1x h SER 31 Cb 0.25 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.50 1f1x h SER 31 CO -0.01 1.06 0.35 -0.09 -1.14 0.00 0.00 176.83 176.99 1f1x h ARG 32 N 0.85 1.13 -0.57 3.45 2.43 -0.39 -0.75 114.38 120.54 1f1x h ARG 32 Ca 0.15 -0.18 -0.01 0.00 -0.81 0.00 0.00 59.98 59.13 1f1x h ARG 32 Cb 0.58 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.91 1f1x h ARG 32 CO 0.03 0.89 0.31 -0.97 -1.51 0.00 0.00 179.97 178.72 1f1x h ASN 33 N 1.12 0.72 0.34 -3.80 -1.24 -0.79 0.99 115.58 112.92 1f1x h ASN 33 Ca 0.27 -0.10 -0.02 0.00 0.71 0.00 0.00 56.30 57.16 1f1x h ASN 33 Cb 0.15 -0.18 0.00 0.00 0.73 0.00 0.00 38.32 39.02 1f1x h ASN 33 CO -0.03 0.62 -0.16 0.15 -1.29 0.00 0.00 177.43 176.71 1f1x h PHE 34 N 0.77 -0.43 -0.08 0.67 3.57 -0.89 -0.15 116.94 120.41 1f1x h PHE 34 Ca 0.20 -0.01 -0.18 0.00 3.53 0.00 0.00 57.97 61.51 1f1x h PHE 34 Cb 0.06 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.93 1f1x h PHE 34 CO -0.01 -0.13 -0.71 1.88 -2.23 0.00 0.00 178.31 177.11 1f1x h TYR 35 N -0.69 0.49 0.00 0.41 0.05 -1.07 0.14 116.97 116.30 1f1x h TYR 35 Ca -0.05 -0.21 -0.16 0.00 0.05 0.00 0.00 58.73 58.36 1f1x h TYR 35 Cb 0.48 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.12 1f1x h TYR 35 CO 0.00 0.96 -1.35 0.28 -1.05 0.00 0.00 178.16 177.00 1f1x n VAL 36 N -3.84 1.50 -0.04 -2.88 0.31 0.34 -1.41 118.33 112.30 1f1x n VAL 36 Ca -0.04 -0.01 -0.16 0.00 -0.01 0.00 0.00 64.34 64.13 1f1x n VAL 36 Cb 0.69 -2.19 -0.07 0.00 -0.91 0.00 0.00 33.84 31.36 1f1x n VAL 36 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1f1x h ASP 37 N -1.00 0.81 0.00 4.52 3.32 -1.23 -0.98 116.42 121.86 1f1x h ASP 37 Ca -0.23 -0.59 -0.01 0.00 0.02 0.00 0.00 57.03 56.21 1f1x h ASP 37 Cb 1.10 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 40.42 1f1x h ASP 37 CO -0.14 1.26 -0.07 0.58 -1.72 0.00 0.00 179.24 179.15 1f1x h VAL 38 N 0.40 0.63 0.00 -1.35 2.07 -0.93 -3.39 116.25 113.68 1f1x h VAL 38 Ca -0.02 -1.49 0.00 0.00 0.82 0.00 0.00 66.70 66.01 1f1x h VAL 38 Cb 1.19 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1f1x h VAL 38 CO 0.12 0.21 -0.26 0.18 0.02 0.00 0.00 177.57 177.85 1f1x n LEU 39 N -4.70 0.71 -0.10 2.57 4.77 0.02 -4.97 117.00 115.30 1f1x n LEU 39 Ca -0.05 0.42 -0.01 0.00 -0.03 0.00 0.00 56.01 56.33 1f1x n LEU 39 Cb 0.20 -0.27 -0.01 0.00 -2.33 0.00 0.00 43.42 41.01 1f1x n LEU 39 CO 0.13 -0.11 -0.01 0.61 -1.33 0.00 0.00 177.39 176.67 1f1x n GLY 40 N 1.34 0.51 3.73 -0.72 0.00 -0.37 -4.51 105.19 105.17 1f1x n GLY 40 Ca 0.05 -0.48 -0.32 0.00 0.00 0.00 0.00 46.02 45.27 1f1x n GLY 40 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1f1x s LEU 41 N -0.29 3.12 -0.14 0.99 1.43 -0.50 -4.87 118.68 118.41 1f1x s LEU 41 Ca 0.00 2.11 -0.10 0.00 -1.03 0.00 0.00 54.13 55.11 1f1x s LEU 41 Cb 0.00 -4.56 -0.05 0.00 0.03 0.00 0.00 46.19 41.61 1f1x s LEU 41 CO 0.00 -2.35 0.19 -1.00 0.23 0.00 0.00 176.35 173.42 1f1x s HIS 42 N -2.47 3.53 -0.17 0.29 3.76 -0.57 -4.62 115.29 115.03 1f1x s HIS 42 Ca 0.68 0.53 -0.26 0.00 -0.15 0.00 0.00 55.06 55.86 1f1x s HIS 42 Cb -0.23 -2.12 -0.01 0.00 1.11 0.00 0.00 32.58 31.33 1f1x s HIS 42 CO 0.51 0.50 0.85 0.08 -0.85 0.00 0.00 174.74 175.84 1f1x s VAL 43 N -0.34 4.86 -0.11 -0.90 1.01 -1.26 -0.67 120.40 122.99 1f1x s VAL 43 Ca 0.14 1.68 0.13 0.00 0.00 0.00 0.00 61.98 63.93 1f1x s VAL 43 Cb -0.12 -4.16 -0.24 0.00 0.00 0.00 0.00 36.38 31.86 1f1x s VAL 43 CO 0.03 0.01 0.41 -1.20 0.00 0.00 0.00 175.10 174.34 1f1x n SER 44 N 5.33 0.69 -3.59 3.32 7.64 0.56 -4.97 113.62 122.60 1f1x n SER 44 Ca 0.05 0.24 -0.11 0.00 1.01 0.00 0.00 58.87 60.06 1f1x n SER 44 Cb 0.48 0.24 -0.06 0.00 -1.01 0.00 0.00 64.21 63.87 1f1x n SER 44 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1f1x s TYR 45 N -2.56 -0.41 0.03 1.43 5.04 -1.19 -5.01 117.35 114.69 1f1x s TYR 45 Ca -0.09 0.78 -0.21 0.00 -2.44 0.00 0.00 57.07 55.11 1f1x s TYR 45 Cb 0.07 0.43 0.05 0.00 0.35 0.00 0.00 41.96 42.86 1f1x s TYR 45 CO 0.82 -0.34 0.48 -1.83 -1.34 0.00 0.00 175.55 173.33 1f1x s GLU 46 N -0.84 0.97 0.00 4.97 -1.05 -1.26 -0.57 118.70 120.92 1f1x s GLU 46 Ca -0.01 -0.24 0.00 0.00 -0.15 0.00 0.00 54.97 54.56 1f1x s GLU 46 Cb -0.01 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 34.12 1f1x s GLU 46 CO 0.01 -0.33 0.00 -0.40 0.95 0.00 0.00 175.26 175.48 1f1x n ASP 47 N 0.54 0.00 0.00 0.83 5.68 -0.58 -5.00 116.55 118.02 1f1x n ASP 47 Ca -0.19 -0.24 0.14 0.00 -0.50 0.00 0.00 54.79 54.00 1f1x n ASP 47 Cb 0.60 0.00 0.71 0.00 -1.14 0.00 0.00 41.12 41.29 1f1x n ASP 47 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1f1x n GLU 48 N 0.00 0.42 -0.00 0.11 1.02 -1.26 -3.71 120.64 117.22 1f1x n GLU 48 Ca 0.00 0.02 0.01 0.00 -0.02 0.00 0.00 57.16 57.17 1f1x n GLU 48 Cb 0.00 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 29.90 1f1x n GLU 48 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1f1x n ASN 49 N -1.27 4.18 -3.86 1.62 3.02 -1.26 -4.97 115.26 112.72 1f1x n ASN 49 Ca 0.14 -0.02 -0.11 0.00 -0.03 0.00 0.00 54.58 54.56 1f1x n ASN 49 Cb 0.22 1.13 -0.09 0.00 -0.61 0.00 0.00 39.78 40.42 1f1x n ASN 49 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1f1x s GLN 50 N -2.17 0.58 -0.06 3.52 -0.21 -1.24 -1.26 119.66 118.83 1f1x s GLN 50 Ca -0.01 -0.51 0.02 0.00 0.02 0.00 0.00 55.36 54.88 1f1x s GLN 50 Cb 0.02 0.24 0.01 0.00 1.00 0.00 0.00 33.01 34.28 1f1x s GLN 50 CO 0.12 -0.15 -0.11 0.42 -2.12 0.00 0.00 175.29 173.45 1f1x s ILE 51 N -1.95 1.01 -0.21 1.08 1.01 -0.24 -1.52 121.20 120.38 1f1x s ILE 51 Ca -0.10 -0.42 -0.05 0.00 0.00 0.00 0.00 60.65 60.08 1f1x s ILE 51 Cb -0.04 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.48 1f1x s ILE 51 CO -0.01 0.32 -0.01 -0.31 0.00 0.00 0.00 174.94 174.93 1f1x s TYR 52 N 0.60 3.01 0.08 3.97 1.51 0.27 -0.50 117.35 126.29 1f1x s TYR 52 Ca -0.12 -0.63 0.07 0.00 -1.01 0.00 0.00 57.07 55.38 1f1x s TYR 52 Cb -0.14 -2.10 -0.03 0.00 -0.11 0.00 0.00 41.96 39.57 1f1x s TYR 52 CO 0.03 -0.36 -0.19 -0.51 -1.11 0.00 0.00 175.55 173.40 1f1x s LEU 53 N 1.23 2.26 0.09 -1.29 1.43 0.46 -0.32 118.68 122.54 1f1x s LEU 53 Ca 0.03 -0.62 0.02 0.00 -1.03 0.00 0.00 54.13 52.53 1f1x s LEU 53 Cb -0.15 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 45.22 1f1x s LEU 53 CO 0.00 0.06 -0.06 0.00 0.23 0.00 0.00 176.35 176.58 1f1x s ARG 54 N -1.65 0.79 0.78 1.70 1.70 0.16 -0.05 118.95 122.37 1f1x s ARG 54 Ca 0.05 -1.28 -0.10 0.00 -0.47 0.00 0.00 55.73 53.93 1f1x s ARG 54 Cb -0.10 -0.18 0.08 0.00 -0.57 0.00 0.00 34.95 34.18 1f1x s ARG 54 CO 0.03 -0.02 1.12 -1.54 -1.08 0.00 0.00 175.30 173.81 1f1x s SER 55 N -2.91 4.55 0.40 -2.89 1.04 -1.26 -1.51 113.70 111.12 1f1x s SER 55 Ca 0.10 0.61 0.07 0.00 0.48 0.00 0.00 55.95 57.21 1f1x s SER 55 Cb 0.04 -1.14 0.81 0.00 0.10 0.00 0.00 66.02 65.83 1f1x s SER 55 CO -0.05 -1.83 2.01 0.15 0.98 0.00 0.00 173.24 174.51 1f1x h PHE 56 N -0.90 0.49 -0.48 5.02 3.57 -1.37 -2.95 116.94 120.33 1f1x h PHE 56 Ca -0.45 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.04 1f1x h PHE 56 Cb 1.32 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.90 1f1x h PHE 56 CO 0.24 0.37 0.00 0.39 -2.23 0.00 0.00 178.31 177.08 1f1x n GLU 57 N -4.42 2.53 -2.75 1.11 1.02 -0.53 -1.89 120.64 115.72 1f1x n GLU 57 Ca 0.02 -2.30 -0.37 0.00 -0.02 0.00 0.00 57.16 54.49 1f1x n GLU 57 Cb 0.11 -1.46 -0.06 0.00 -0.02 0.00 0.00 31.44 30.01 1f1x n GLU 57 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1f1x s GLU 58 N -1.18 4.53 -0.01 3.49 2.56 -1.12 -4.79 118.70 122.19 1f1x s GLU 58 Ca 0.38 1.36 0.07 0.00 0.00 0.00 0.00 54.97 56.77 1f1x s GLU 58 Cb 0.21 -2.77 -0.11 0.00 2.00 0.00 0.00 34.13 33.46 1f1x s GLU 58 CO 0.28 0.23 0.15 1.97 -0.56 0.00 0.00 175.26 177.32 1f1x n PHE 59 N 0.48 0.00 -1.63 5.30 -1.74 -1.26 -4.23 117.46 114.39 1f1x n PHE 59 Ca 0.02 0.00 -0.29 0.00 -0.56 0.00 0.00 57.45 56.62 1f1x n PHE 59 Cb 0.50 -0.17 0.11 0.00 1.52 0.00 0.00 39.48 41.44 1f1x n PHE 59 CO 0.00 0.00 0.00 0.96 -0.56 0.00 0.00 176.76 177.16 1f1x s ILE 60 N -2.48 2.39 0.29 1.97 -4.36 -1.26 -0.85 121.20 116.90 1f1x s ILE 60 Ca -0.03 0.13 -0.00 0.00 -0.26 0.00 0.00 60.65 60.48 1f1x s ILE 60 Cb 0.04 -2.93 0.28 0.00 1.25 0.00 0.00 42.46 41.10 1f1x s ILE 60 CO 0.29 -0.16 1.91 -0.74 0.24 0.00 0.00 174.94 176.48 1f1x h HIS 61 N -1.26 1.09 -2.95 1.37 -0.00 -1.58 -3.42 115.15 108.40 1f1x h HIS 61 Ca -0.48 0.03 0.03 0.00 -0.00 0.00 0.00 60.37 59.94 1f1x h HIS 61 Cb 1.31 -0.36 -0.09 0.00 -0.00 0.00 0.00 27.41 28.27 1f1x h HIS 61 CO 0.36 0.58 0.24 -3.38 -0.00 0.00 0.00 177.93 175.73 1f1x s HIS 62 N -5.94 -0.37 -0.20 5.26 0.00 -1.26 -4.70 115.29 108.08 1f1x s HIS 62 Ca -0.12 0.05 0.06 0.00 -3.00 0.00 0.00 55.06 52.05 1f1x s HIS 62 Cb 0.20 0.63 -0.08 0.00 -4.00 0.00 0.00 32.58 29.33 1f1x s HIS 62 CO 0.80 -1.01 0.22 0.09 -1.00 0.00 0.00 174.74 173.85 1f1x n ASN 63 N -0.41 1.33 -3.69 7.38 5.03 0.93 -4.63 115.26 121.19 1f1x n ASN 63 Ca -0.11 -0.44 -0.10 0.00 0.87 0.00 0.00 54.58 54.80 1f1x n ASN 63 Cb 0.62 1.09 -0.10 0.00 -1.02 0.00 0.00 39.78 40.37 1f1x n ASN 63 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1f1x s LEU 64 N -2.66 -0.21 -0.17 3.41 2.96 -0.61 -1.91 118.68 119.49 1f1x s LEU 64 Ca 0.01 0.97 0.00 0.00 -0.22 0.00 0.00 54.13 54.89 1f1x s LEU 64 Cb 0.05 1.47 0.01 0.00 0.50 0.00 0.00 46.19 48.21 1f1x s LEU 64 CO 0.26 -0.20 -0.16 -0.69 -1.32 0.00 0.00 176.35 174.23 1f1x s VAL 65 N 1.48 2.48 -0.27 1.68 1.01 0.05 -0.40 120.40 126.41 1f1x s VAL 65 Ca -0.09 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 60.96 1f1x s VAL 65 Cb -0.08 -2.05 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 1f1x s VAL 65 CO -0.14 0.52 0.17 -0.76 0.00 0.00 0.00 175.10 174.89 1f1x s LEU 66 N 1.03 3.92 -0.14 3.92 1.43 0.35 -0.82 118.68 128.36 1f1x s LEU 66 Ca -0.01 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.07 1f1x s LEU 66 Cb -0.15 -2.08 0.01 0.00 0.03 0.00 0.00 46.19 44.00 1f1x s LEU 66 CO -0.04 -0.04 -0.22 -0.89 0.23 0.00 0.00 176.35 175.39 1f1x s THR 67 N 1.72 2.03 0.26 5.49 2.01 -0.21 -1.07 115.64 125.87 1f1x s THR 67 Ca 0.07 -0.96 -0.30 0.00 0.31 0.00 0.00 61.69 60.81 1f1x s THR 67 Cb -0.16 -1.80 -0.10 0.00 0.01 0.00 0.00 72.50 70.45 1f1x s THR 67 CO 0.10 0.54 1.48 -0.75 -0.69 0.00 0.00 174.62 175.30 1f1x s LYS 68 N 0.84 4.23 0.32 4.92 2.20 -0.39 -0.94 119.74 130.92 1f1x s LYS 68 Ca -0.07 2.38 -0.19 0.00 -0.36 0.00 0.00 55.97 57.74 1f1x s LYS 68 Cb -0.15 -3.08 0.03 0.00 -1.51 0.00 0.00 37.83 33.12 1f1x s LYS 68 CO -0.02 -0.48 0.74 0.20 -0.36 0.00 0.00 175.35 175.44 1f1x s GLY 69 N 0.38 0.12 0.17 5.54 0.00 0.21 -4.83 107.32 108.91 1f1x s GLY 69 Ca 0.60 -0.51 0.07 0.00 0.00 0.00 0.00 44.72 44.88 1f1x s GLY 69 CO 0.45 -0.19 1.40 -0.56 0.00 0.00 0.00 173.10 174.19 1f1x h PRO 70 N 2.00 0.05 -4.27 2.90 0.13 -1.94 -3.37 132.00 127.51 1f1x h PRO 70 Ca -0.25 -0.06 -0.54 0.00 -0.87 0.00 0.00 66.00 64.28 1f1x h PRO 70 Cb 1.25 0.02 -0.37 0.00 0.13 0.00 0.00 31.00 32.03 1f1x h PRO 70 CO 0.31 0.88 -0.81 0.08 -0.23 0.00 0.00 178.00 178.23 1f1x s VAL 71 N -3.09 1.08 0.28 1.56 1.01 -1.26 -4.94 120.40 115.04 1f1x s VAL 71 Ca -0.01 -0.34 -0.30 0.00 0.00 0.00 0.00 61.98 61.34 1f1x s VAL 71 Cb 0.11 -1.10 -0.10 0.00 0.00 0.00 0.00 36.38 35.28 1f1x s VAL 71 CO 0.81 0.36 1.44 0.00 0.00 0.00 0.00 175.10 177.71 1f1x s ALA 72 N 1.68 3.62 -0.04 5.51 0.00 -1.26 -4.78 121.76 126.49 1f1x s ALA 72 Ca 0.05 1.37 -0.31 0.00 0.00 0.00 0.00 51.96 53.06 1f1x s ALA 72 Cb -0.13 -3.56 0.12 0.00 0.00 0.00 0.00 23.12 19.55 1f1x s ALA 72 CO -0.08 -0.78 1.24 0.00 0.00 0.00 0.00 175.76 176.14 1f1x s ALA 73 N -0.27 -2.16 -0.06 0.00 0.00 -1.08 -4.54 121.76 113.65 1f1x s ALA 73 Ca 0.58 0.86 -0.30 0.00 0.00 0.00 0.00 51.96 53.10 1f1x s ALA 73 Cb -0.43 0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.95 1f1x s ALA 73 CO 0.47 -0.95 0.99 -1.17 0.00 0.00 0.00 175.76 175.10 1f1x s LEU 74 N -2.79 4.30 -0.18 0.00 2.96 0.11 -0.18 118.68 122.90 1f1x s LEU 74 Ca 0.13 1.58 0.09 0.00 -0.22 0.00 0.00 54.13 55.71 1f1x s LEU 74 Cb 0.03 -3.55 -0.22 0.00 0.50 0.00 0.00 46.19 42.95 1f1x s LEU 74 CO -0.04 -0.36 0.13 1.17 -1.32 0.00 0.00 176.35 175.94 1f1x n LYS 75 N 4.50 0.68 -3.63 1.98 4.81 0.28 -0.80 118.16 125.98 1f1x n LYS 75 Ca 0.07 0.13 -0.14 0.00 -0.87 0.00 0.00 58.31 57.50 1f1x n LYS 75 Cb 0.50 -1.60 -0.07 0.00 0.02 0.00 0.00 35.03 33.88 1f1x n LYS 75 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1f1x s ALA 76 N -2.53 -1.72 -0.22 3.14 0.00 -1.06 -4.76 121.76 114.61 1f1x s ALA 76 Ca -0.18 1.93 -0.01 0.00 0.00 0.00 0.00 51.96 53.70 1f1x s ALA 76 Cb 0.07 -1.09 0.02 0.00 0.00 0.00 0.00 23.12 22.12 1f1x s ALA 76 CO 0.75 -0.33 -0.10 0.00 0.00 0.00 0.00 175.76 176.08 1f1x s MET 77 N 0.30 2.96 -0.11 0.00 0.23 -0.20 -0.86 119.30 121.62 1f1x s MET 77 Ca -0.00 -0.88 -0.02 0.00 -1.03 0.00 0.00 55.69 53.76 1f1x s MET 77 Cb -0.05 -2.85 -0.03 0.00 -1.53 0.00 0.00 34.83 30.37 1f1x s MET 77 CO 0.01 -0.31 -0.05 0.00 -2.03 0.00 0.00 175.02 172.65 1f1x s ALA 78 N 1.33 3.01 -0.09 3.16 0.00 0.01 -0.99 121.76 128.20 1f1x s ALA 78 Ca 0.02 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.16 1f1x s ALA 78 Cb -0.15 -1.41 -0.02 0.00 0.00 0.00 0.00 23.12 21.54 1f1x s ALA 78 CO -0.07 0.40 -0.15 -0.06 0.00 0.00 0.00 175.76 175.88 1f1x s PHE 79 N -0.25 2.72 0.05 0.00 0.08 0.01 -0.62 117.98 119.96 1f1x s PHE 79 Ca 0.04 -0.46 -0.20 0.00 0.12 0.00 0.00 56.93 56.43 1f1x s PHE 79 Cb -0.13 -1.72 -0.06 0.00 -0.57 0.00 0.00 43.02 40.54 1f1x s PHE 79 CO 0.02 -0.05 0.58 0.50 -0.10 0.00 0.00 175.22 176.17 1f1x s ARG 80 N -0.15 4.24 0.32 0.44 3.52 -0.65 -2.76 118.95 123.89 1f1x s ARG 80 Ca -0.01 0.74 0.07 0.00 -0.13 0.00 0.00 55.73 56.40 1f1x s ARG 80 Cb -0.14 -3.27 -0.03 0.00 -1.56 0.00 0.00 34.95 29.96 1f1x s ARG 80 CO 0.03 0.56 0.29 0.14 -0.81 0.00 0.00 175.30 175.51 1f1x s VAL 81 N -0.84 3.79 0.23 7.11 -7.23 -0.17 -0.11 120.40 123.18 1f1x s VAL 81 Ca 0.30 -1.34 0.01 0.00 -1.81 0.00 0.00 61.98 59.13 1f1x s VAL 81 Cb -0.19 -3.26 -0.01 0.00 0.56 0.00 0.00 36.38 33.48 1f1x s VAL 81 CO 0.18 -0.21 1.59 -0.09 -0.31 0.00 0.00 175.10 176.27 1f1x h ARG 82 N 1.26 0.45 -4.22 4.82 2.43 -1.44 -3.42 114.38 114.26 1f1x h ARG 82 Ca -0.46 -0.25 -0.13 0.00 -0.81 0.00 0.00 59.98 58.34 1f1x h ARG 82 Cb 1.25 0.01 -0.15 0.00 -0.42 0.00 0.00 29.97 30.67 1f1x h ARG 82 CO 0.58 0.82 -0.62 0.95 -1.51 0.00 0.00 179.97 180.20 1f1x s THR 83 N -4.11 0.17 0.37 0.20 -4.23 -1.26 -5.03 115.64 101.75 1f1x s THR 83 Ca -0.06 -1.74 0.10 0.00 -1.18 0.00 0.00 61.69 58.81 1f1x s THR 83 Cb 0.12 -1.65 0.33 0.00 1.34 0.00 0.00 72.50 72.64 1f1x s THR 83 CO 0.81 -0.79 1.89 -0.65 -0.54 0.00 0.00 174.62 175.34 1f1x h PRO 84 N 3.00 0.62 0.00 3.99 0.11 -1.96 0.04 132.00 137.80 1f1x h PRO 84 Ca -0.34 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.73 1f1x h PRO 84 Cb 1.17 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1f1x h PRO 84 CO 0.62 0.41 0.00 0.93 -0.21 0.00 0.00 178.00 179.75 1f1x h GLU 85 N 0.63 0.00 0.00 1.05 3.07 -1.99 -1.97 114.58 115.37 1f1x h GLU 85 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.28 1f1x h GLU 85 Cb 0.71 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 1f1x h GLU 85 CO -0.18 0.00 0.00 -0.44 -1.40 0.00 0.00 179.01 176.99 1f1x h ASP 86 N 0.00 0.00 -0.18 1.42 3.32 -1.38 -2.03 116.42 117.58 1f1x h ASP 86 Ca 0.00 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 1f1x h ASP 86 Cb 0.44 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.00 1f1x h ASP 86 CO 0.00 0.00 -0.71 0.58 -1.72 0.00 0.00 179.24 177.39 1f1x h VAL 87 N 0.00 1.28 -0.68 -1.35 2.07 -1.44 -0.60 116.25 115.52 1f1x h VAL 87 Ca 0.00 -1.90 -0.04 0.00 0.82 0.00 0.00 66.70 65.58 1f1x h VAL 87 Cb 0.44 1.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.06 1f1x h VAL 87 CO 0.00 0.61 0.28 0.44 0.02 0.00 0.00 177.57 178.92 1f1x h ASP 88 N 0.58 0.93 -0.46 0.57 3.32 -1.61 -1.53 116.42 118.21 1f1x h ASP 88 Ca -0.03 -0.17 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 1f1x h ASP 88 Cb 1.33 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 40.62 1f1x h ASP 88 CO 0.15 0.84 0.27 0.11 -1.72 0.00 0.00 179.24 178.89 1f1x h LYS 89 N 0.95 0.62 -0.77 3.56 1.57 -1.22 -1.13 116.57 120.16 1f1x h LYS 89 Ca 0.23 -0.06 0.05 0.00 -1.87 0.00 0.00 60.65 59.00 1f1x h LYS 89 Cb 0.20 -0.13 -0.05 0.00 0.08 0.00 0.00 32.23 32.32 1f1x h LYS 89 CO -0.02 0.46 0.47 0.00 -0.57 0.00 0.00 179.45 179.79 1f1x h ALA 90 N 1.13 1.04 -0.50 3.86 0.00 -0.78 -0.21 119.26 123.79 1f1x h ALA 90 Ca 0.16 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1f1x h ALA 90 Cb 0.00 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 1f1x h ALA 90 CO -0.03 0.21 0.23 1.49 0.00 0.00 0.00 179.25 181.15 1f1x h GLU 91 N 0.87 0.72 -0.44 0.00 4.81 -0.82 -1.27 114.58 118.46 1f1x h GLU 91 Ca 0.33 -0.11 -0.11 0.00 -0.13 0.00 0.00 59.36 59.34 1f1x h GLU 91 Cb 0.13 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1f1x h GLU 91 CO -0.16 0.61 -0.18 0.00 -0.73 0.00 0.00 179.01 178.56 1f1x h ALA 92 N 1.07 0.86 -0.01 2.92 0.00 -0.94 -1.92 119.26 121.25 1f1x h ALA 92 Ca 0.17 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1f1x h ALA 92 Cb 0.13 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1f1x h ALA 92 CO -0.02 0.64 0.01 -0.92 0.00 0.00 0.00 179.25 178.95 1f1x h TYR 93 N 0.74 0.02 0.00 0.00 3.20 -0.78 -1.34 116.97 118.81 1f1x h TYR 93 Ca 0.11 -0.00 -0.14 0.00 3.14 0.00 0.00 58.73 61.84 1f1x h TYR 93 Cb 0.70 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.94 1f1x h TYR 93 CO 0.04 0.12 -0.66 1.88 -1.64 0.00 0.00 178.16 177.90 1f1x h TYR 94 N -0.09 0.00 -0.28 -3.82 0.05 -1.22 -1.91 116.97 109.71 1f1x h TYR 94 Ca 0.00 0.00 -0.11 0.00 0.05 0.00 0.00 58.73 58.67 1f1x h TYR 94 Cb 0.11 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.84 1f1x h TYR 94 CO -0.04 0.66 -0.30 1.96 -1.05 0.00 0.00 178.16 179.40 1f1x h GLN 95 N 0.00 0.57 -0.22 4.88 1.08 -1.30 -0.82 115.11 119.31 1f1x h GLN 95 Ca -0.01 -0.24 -0.09 0.00 -1.45 0.00 0.00 58.65 56.86 1f1x h GLN 95 Cb 1.19 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.59 1f1x h GLN 95 CO 0.09 0.81 -0.24 1.49 -0.95 0.00 0.00 178.83 180.03 1f1x h GLU 96 N 0.50 0.42 0.00 1.46 4.81 -0.79 0.67 114.58 121.65 1f1x h GLU 96 Ca 0.06 -0.15 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1f1x h GLU 96 Cb 0.76 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.11 1f1x h GLU 96 CO 0.06 0.63 0.00 1.28 -0.73 0.00 0.00 179.01 180.25 1f1x n LEU 97 N -4.14 0.00 0.00 1.64 4.77 -0.76 -4.89 117.00 113.62 1f1x n LEU 97 Ca -0.00 0.46 0.00 0.00 -0.03 0.00 0.00 56.01 56.43 1f1x n LEU 97 Cb 0.39 -0.46 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1f1x n LEU 97 CO 0.41 -0.16 0.00 0.61 -1.33 0.00 0.00 177.39 176.92 1f1x n GLY 98 N 0.41 0.45 3.89 -0.72 0.00 0.23 -5.04 105.19 104.42 1f1x n GLY 98 Ca 0.05 -0.95 -0.31 0.00 0.00 0.00 0.00 46.02 44.81 1f1x n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1f1x s ARG 100 N -2.73 4.46 0.14 0.00 3.52 -1.26 -4.51 118.95 118.56 1f1x s ARG 100 Ca 0.42 1.94 0.04 0.00 -0.13 0.00 0.00 55.73 58.01 1f1x s ARG 100 Cb -0.12 -3.22 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 1f1x s ARG 100 CO 0.24 -0.14 -0.10 0.95 -0.81 0.00 0.00 175.30 175.43 1f1x s THR 101 N -0.01 1.15 -0.07 4.11 -4.23 -1.26 -1.44 115.64 113.88 1f1x s THR 101 Ca 0.54 -2.00 -0.03 0.00 -1.18 0.00 0.00 61.69 59.02 1f1x s THR 101 Cb -0.34 -1.78 0.04 0.00 1.34 0.00 0.00 72.50 71.76 1f1x s THR 101 CO 0.37 -0.71 0.15 -0.70 -0.54 0.00 0.00 174.62 173.19 1f1x s GLU 102 N -3.59 0.08 -0.12 3.99 2.12 -0.14 -5.00 118.70 116.04 1f1x s GLU 102 Ca 0.15 0.42 0.00 0.00 0.36 0.00 0.00 54.97 55.90 1f1x s GLU 102 Cb 0.02 -0.20 -0.02 0.00 0.26 0.00 0.00 34.13 34.19 1f1x s GLU 102 CO 0.01 -0.20 -0.12 0.50 -0.54 0.00 0.00 175.26 174.91 1f1x s ARG 103 N 1.46 3.27 -0.21 4.30 6.06 -1.26 -0.93 118.95 131.63 1f1x s ARG 103 Ca -0.06 -0.66 -0.01 0.00 -2.50 0.00 0.00 55.73 52.50 1f1x s ARG 103 Cb -0.12 -2.63 0.06 0.00 0.06 0.00 0.00 34.95 32.32 1f1x s ARG 103 CO -0.06 0.30 -0.02 1.03 -2.50 0.00 0.00 175.30 174.05 1f1x s ARG 104 N 0.14 1.24 0.51 5.12 0.52 -0.25 -5.00 118.95 121.24 1f1x s ARG 104 Ca -0.06 -0.73 0.20 0.00 -0.52 0.00 0.00 55.73 54.62 1f1x s ARG 104 Cb -0.15 -2.35 1.30 0.00 0.52 0.00 0.00 34.95 34.27 1f1x s ARG 104 CO 0.04 -0.60 2.05 0.87 0.02 0.00 0.00 175.30 177.69 1f1x h LYS 105 N 8.08 0.06 -0.46 3.54 1.57 -1.88 -1.25 116.57 126.23 1f1x h LYS 105 Ca -0.18 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.60 1f1x h LYS 105 Cb 1.09 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.39 1f1x h LYS 105 CO 0.38 0.04 0.00 -0.25 -0.57 0.00 0.00 179.45 179.05 1f1x n ASP 106 N -4.45 3.64 0.00 0.86 8.00 -1.26 -1.93 116.55 121.41 1f1x n ASP 106 Ca 0.05 -2.26 0.00 0.00 0.71 0.00 0.00 54.79 53.29 1f1x n ASP 106 Cb 0.38 -0.40 0.00 0.00 -0.02 0.00 0.00 41.12 41.08 1f1x n ASP 106 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f1x n GLY 107 N 0.67 -0.72 0.05 0.44 0.00 -0.59 -4.66 105.19 100.37 1f1x n GLY 107 Ca 0.18 -1.67 0.05 0.00 0.00 0.00 0.00 46.02 44.59 1f1x n GLY 107 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1f1x n PHE 108 N -0.69 0.20 -4.15 1.61 3.01 -1.26 -4.90 117.46 111.28 1f1x n PHE 108 Ca 0.00 0.06 -0.10 0.00 1.01 0.00 0.00 57.45 58.42 1f1x n PHE 108 Cb 0.00 -0.72 -0.10 0.00 -0.01 0.00 0.00 39.48 38.65 1f1x n PHE 108 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 1f1x s VAL 109 N -3.21 0.56 0.66 -4.37 -7.23 -1.26 -5.13 120.40 100.42 1f1x s VAL 109 Ca -0.07 -1.91 -0.17 0.00 -1.81 0.00 0.00 61.98 58.02 1f1x s VAL 109 Cb 0.11 -1.68 -0.00 0.00 0.56 0.00 0.00 36.38 35.37 1f1x s VAL 109 CO 0.87 -0.87 1.21 -0.54 -0.31 0.00 0.00 175.10 175.46 1f1x s LYS 110 N -3.87 2.58 0.00 4.82 1.02 -1.26 -2.84 119.74 120.19 1f1x s LYS 110 Ca 0.12 1.81 0.00 0.00 0.02 0.00 0.00 55.97 57.92 1f1x s LYS 110 Cb 0.06 -1.88 0.00 0.00 -0.52 0.00 0.00 37.83 35.49 1f1x s LYS 110 CO -0.05 -1.51 0.00 0.41 -0.92 0.00 0.00 175.35 173.28 1f1x n GLY 111 N 0.46 1.75 3.27 -3.33 0.00 -1.26 -4.98 105.19 101.10 1f1x n GLY 111 Ca 0.14 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 1f1x n GLY 111 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1f1x s ILE 112 N -3.27 1.87 0.00 -0.61 -1.09 -1.13 -1.50 121.20 115.48 1f1x s ILE 112 Ca 0.00 -1.02 0.00 0.00 -2.23 0.00 0.00 60.65 57.40 1f1x s ILE 112 Cb 0.00 -1.56 0.00 0.00 -1.58 0.00 0.00 42.46 39.32 1f1x s ILE 112 CO 0.00 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 174.84 1f1x n GLY 113 N 2.47 1.31 3.67 6.18 0.00 -0.15 -4.00 105.19 114.66 1f1x n GLY 113 Ca -0.16 -1.10 -0.51 0.00 0.00 0.00 0.00 46.02 44.25 1f1x n GLY 113 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1f1x n ASP 114 N 0.00 2.81 -3.87 1.61 2.03 -0.81 -2.20 116.55 116.11 1f1x n ASP 114 Ca 0.00 1.04 -0.11 0.00 0.52 0.00 0.00 54.79 56.24 1f1x n ASP 114 Cb 0.00 -1.29 -0.10 0.00 -0.72 0.00 0.00 41.12 39.02 1f1x n ASP 114 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1f1x s ALA 115 N 2.81 -0.31 -0.14 -1.67 0.00 -0.57 -4.08 121.76 117.79 1f1x s ALA 115 Ca 0.91 -0.18 0.02 0.00 0.00 0.00 0.00 51.96 52.70 1f1x s ALA 115 Cb -0.84 0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.42 1f1x s ALA 115 CO 0.52 -0.23 -0.19 -1.17 0.00 0.00 0.00 175.76 174.69 1f1x s LEU 116 N -1.52 2.31 0.01 0.00 2.96 -0.07 -1.08 118.68 121.28 1f1x s LEU 116 Ca -0.13 -0.52 0.05 0.00 -0.22 0.00 0.00 54.13 53.31 1f1x s LEU 116 Cb -0.06 -1.50 -0.03 0.00 0.50 0.00 0.00 46.19 45.09 1f1x s LEU 116 CO 0.01 0.10 -0.12 -0.13 -1.32 0.00 0.00 176.35 174.89 1f1x s ARG 117 N 0.71 2.37 0.05 1.98 0.52 -0.11 -0.78 118.95 123.70 1f1x s ARG 117 Ca -0.08 -0.81 0.01 0.00 -0.52 0.00 0.00 55.73 54.33 1f1x s ARG 117 Cb -0.16 -2.37 -0.03 0.00 0.52 0.00 0.00 34.95 32.91 1f1x s ARG 117 CO 0.01 0.58 -0.06 0.14 0.02 0.00 0.00 175.30 175.99 1f1x s VAL 118 N -0.93 0.46 -0.55 3.52 -7.23 0.02 -0.96 120.40 114.73 1f1x s VAL 118 Ca 0.15 -1.39 -0.18 0.00 -1.81 0.00 0.00 61.98 58.75 1f1x s VAL 118 Cb -0.11 -0.98 0.09 0.00 0.56 0.00 0.00 36.38 35.95 1f1x s VAL 118 CO 0.06 -0.63 0.63 -1.61 -0.31 0.00 0.00 175.10 173.23 1f1x s GLU 119 N -2.53 3.05 1.12 4.82 2.02 -0.52 -2.20 118.70 124.46 1f1x s GLU 119 Ca -0.03 -1.28 -0.17 0.00 0.02 0.00 0.00 54.97 53.52 1f1x s GLU 119 Cb -0.03 -4.22 0.25 0.00 0.10 0.00 0.00 34.13 30.23 1f1x s GLU 119 CO -0.03 -1.39 1.11 0.16 0.02 0.00 0.00 175.26 175.14 1f1x s ASP 120 N 3.31 1.62 0.61 -0.19 -4.77 -0.14 -4.18 116.67 112.94 1f1x s ASP 120 Ca 0.10 0.81 0.39 0.00 -3.30 0.00 0.00 52.55 50.55 1f1x s ASP 120 Cb -0.24 -1.20 2.11 0.00 -1.09 0.00 0.00 42.92 42.51 1f1x s ASP 120 CO 0.07 -3.71 2.19 -0.65 0.70 0.00 0.00 175.17 173.77 1f1x h PRO 121 N -2.29 0.00 -0.30 2.11 0.11 -1.96 0.70 132.00 130.37 1f1x h PRO 121 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1f1x h PRO 121 Cb 1.31 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1f1x h PRO 121 CO 0.43 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.50 1f1x n LEU 122 N -2.91 3.27 0.00 2.35 4.77 -1.26 -4.97 117.00 118.25 1f1x n LEU 122 Ca -0.03 -1.40 0.00 0.00 -0.03 0.00 0.00 56.01 54.56 1f1x n LEU 122 Cb 0.12 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 1f1x n LEU 122 CO 0.17 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.52 1f1x n GLY 123 N 1.38 0.65 3.86 -0.72 0.00 0.24 -4.31 105.19 106.28 1f1x n GLY 123 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 1f1x n GLY 123 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1f1x s PHE 124 N -2.08 3.56 -1.00 1.61 0.40 -1.26 -4.73 117.98 114.49 1f1x s PHE 124 Ca 0.00 0.92 -0.20 0.00 -0.60 0.00 0.00 56.93 57.04 1f1x s PHE 124 Cb 0.00 -2.26 0.10 0.00 0.51 0.00 0.00 43.02 41.36 1f1x s PHE 124 CO 0.00 0.44 1.31 -1.25 0.70 0.00 0.00 175.22 176.42 1f1x s PRO 125 N -2.10 3.64 0.22 0.24 0.04 -1.26 -0.97 135.00 134.81 1f1x s PRO 125 Ca 0.38 -1.55 -0.15 0.00 0.04 0.00 0.00 61.00 59.72 1f1x s PRO 125 Cb -0.14 -5.14 -0.08 0.00 0.04 0.00 0.00 34.50 29.18 1f1x s PRO 125 CO 0.19 -1.98 0.63 0.71 0.04 0.00 0.00 177.00 176.59 1f1x s TYR 126 N 3.67 3.53 -0.00 0.56 1.51 -0.94 -1.03 117.35 124.66 1f1x s TYR 126 Ca 0.40 1.13 0.07 0.00 -1.01 0.00 0.00 57.07 57.66 1f1x s TYR 126 Cb -0.02 -2.44 -0.02 0.00 -0.11 0.00 0.00 41.96 39.37 1f1x s TYR 126 CO -0.08 0.30 -0.22 -2.00 -1.11 0.00 0.00 175.55 172.44 1f1x s GLU 127 N -2.35 1.72 -0.07 -0.62 2.12 -0.16 -0.80 118.70 118.54 1f1x s GLU 127 Ca 0.44 -0.83 0.03 0.00 0.36 0.00 0.00 54.97 54.98 1f1x s GLU 127 Cb -0.14 -1.71 0.00 0.00 0.26 0.00 0.00 34.13 32.55 1f1x s GLU 127 CO 0.20 0.46 -0.18 -0.06 -0.54 0.00 0.00 175.26 175.14 1f1x s PHE 128 N -0.58 1.97 0.09 5.30 0.08 0.04 -0.81 117.98 124.07 1f1x s PHE 128 Ca 0.09 -0.73 -0.16 0.00 0.12 0.00 0.00 56.93 56.25 1f1x s PHE 128 Cb -0.09 -1.35 0.03 0.00 -0.57 0.00 0.00 43.02 41.04 1f1x s PHE 128 CO -0.00 -0.31 0.38 -0.59 -0.10 0.00 0.00 175.22 174.60 1f1x s PHE 129 N 0.39 -0.19 -0.02 0.36 -0.71 -1.11 -0.89 117.98 115.81 1f1x s PHE 129 Ca -0.14 -0.03 -0.03 0.00 -1.04 0.00 0.00 56.93 55.70 1f1x s PHE 129 Cb -0.16 0.21 -0.02 0.00 -1.21 0.00 0.00 43.02 41.84 1f1x s PHE 129 CO 0.05 -0.63 -0.06 0.34 -1.34 0.00 0.00 175.22 173.58 1f1x n PHE 130 N 0.10 0.00 -1.89 3.49 7.35 -1.26 -1.00 117.46 124.25 1f1x n PHE 130 Ca -0.17 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.10 1f1x n PHE 130 Cb 0.62 -0.15 -0.03 0.00 0.35 0.00 0.00 39.48 40.27 1f1x n PHE 130 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1f1x s GLU 131 N -2.11 4.20 -0.12 -4.13 2.02 -1.26 -4.92 118.70 112.36 1f1x s GLU 131 Ca -0.06 2.42 -0.24 0.00 0.02 0.00 0.00 54.97 57.11 1f1x s GLU 131 Cb 0.02 -3.12 0.06 0.00 0.10 0.00 0.00 34.13 31.18 1f1x s GLU 131 CO 0.08 -0.61 0.58 -0.08 0.02 0.00 0.00 175.26 175.25 1f1x s THR 132 N 0.92 0.01 -0.10 3.63 -1.32 -1.26 -0.98 115.64 116.54 1f1x s THR 132 Ca 0.69 -0.08 -0.30 0.00 -1.21 0.00 0.00 61.69 60.79 1f1x s THR 132 Cb -0.45 -0.86 -0.03 0.00 -1.51 0.00 0.00 72.50 69.65 1f1x s THR 132 CO 0.34 -0.04 1.35 -0.89 -2.21 0.00 0.00 174.62 173.17 1f1x s THR 133 N -0.52 4.04 0.44 5.08 2.01 -0.56 -4.88 115.64 121.26 1f1x s THR 133 Ca -0.06 1.31 -0.22 0.00 0.31 0.00 0.00 61.69 63.03 1f1x s THR 133 Cb -0.03 -3.84 -0.09 0.00 0.01 0.00 0.00 72.50 68.55 1f1x s THR 133 CO 0.05 -0.08 1.03 -1.00 -0.69 0.00 0.00 174.62 173.94 1f1x s HIS 134 N 3.20 3.14 0.36 4.92 3.76 -1.26 -1.71 115.29 127.70 1f1x s HIS 134 Ca 0.60 1.61 0.03 0.00 -0.15 0.00 0.00 55.06 57.16 1f1x s HIS 134 Cb -0.26 -3.07 -0.04 0.00 1.11 0.00 0.00 32.58 30.32 1f1x s HIS 134 CO 0.21 -0.68 0.11 0.14 -0.85 0.00 0.00 174.74 173.67 1f1x s VAL 135 N -1.86 0.71 -0.02 -0.90 -7.23 -0.03 -4.92 120.40 106.15 1f1x s VAL 135 Ca 0.63 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.50 1f1x s VAL 135 Cb -0.18 -2.51 -0.08 0.00 0.56 0.00 0.00 36.38 34.18 1f1x s VAL 135 CO 0.23 0.00 1.94 -0.70 -0.31 0.00 0.00 175.10 176.26 1f1x s GLU 136 N -3.80 4.01 -0.15 4.82 2.12 -1.26 -4.77 118.70 119.67 1f1x s GLU 136 Ca 0.30 2.45 -0.29 0.00 0.36 0.00 0.00 54.97 57.78 1f1x s GLU 136 Cb 0.05 -4.16 -0.01 0.00 0.26 0.00 0.00 34.13 30.26 1f1x s GLU 136 CO 0.15 -1.10 1.21 0.50 -0.54 0.00 0.00 175.26 175.48 1f1x s ARG 137 N 4.65 4.27 -0.11 4.30 3.52 -1.26 -4.88 118.95 129.44 1f1x s ARG 137 Ca 0.87 1.61 0.10 0.00 -0.13 0.00 0.00 55.73 58.18 1f1x s ARG 137 Cb -0.39 -3.70 0.47 0.00 -1.56 0.00 0.00 34.95 29.77 1f1x s ARG 137 CO 0.39 -0.63 1.27 1.28 -0.81 0.00 0.00 175.30 176.79 1f1x n LEU 138 N 6.25 3.50 0.33 -0.88 4.77 -1.05 -4.59 117.00 125.32 1f1x n LEU 138 Ca 0.13 -1.77 0.21 0.00 -0.03 0.00 0.00 56.01 54.55 1f1x n LEU 138 Cb 0.45 -0.54 1.12 0.00 -2.33 0.00 0.00 43.42 42.13 1f1x n LEU 138 CO 0.55 0.51 1.16 1.12 -1.33 0.00 0.00 177.39 179.39 1f1x h HIS 139 N 2.45 0.00 -0.17 -1.77 2.07 -1.69 0.12 115.15 116.16 1f1x h HIS 139 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1f1x h HIS 139 Cb 1.20 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.18 1f1x h HIS 139 CO 0.57 0.00 0.00 -1.33 -3.07 0.00 0.00 177.93 174.11 1f1x n MET 140 N -3.21 2.49 -2.13 5.12 2.81 -1.26 -4.83 117.12 116.11 1f1x n MET 140 Ca -0.03 -2.37 -0.42 0.00 -1.81 0.00 0.00 57.70 53.07 1f1x n MET 140 Cb 0.10 -1.49 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 1f1x n MET 140 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1f1x n ARG 141 N -0.53 3.65 0.18 0.03 5.12 0.41 -4.69 116.66 120.83 1f1x n ARG 141 Ca 0.14 -3.30 0.13 0.00 -1.93 0.00 0.00 57.85 52.89 1f1x n ARG 141 Cb 0.62 -2.93 0.61 0.00 -1.16 0.00 0.00 32.46 29.60 1f1x n ARG 141 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1f1x h TYR 142 N 5.57 0.00 0.00 -1.55 0.05 -1.88 0.81 116.97 119.97 1f1x h TYR 142 Ca 0.49 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.27 1f1x h TYR 142 Cb 0.56 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.30 1f1x h TYR 142 CO 1.37 0.00 0.00 -0.40 -1.05 0.00 0.00 178.16 178.08 1f1x n ASP 143 N -2.44 0.55 -0.00 3.88 5.75 -1.26 -2.93 116.55 120.09 1f1x n ASP 143 Ca 0.00 0.63 0.06 0.00 -0.01 0.00 0.00 54.79 55.48 1f1x n ASP 143 Cb 0.17 -0.75 -0.09 0.00 -1.03 0.00 0.00 41.12 39.42 1f1x n ASP 143 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1f1x n LEU 144 N -2.11 0.32 -4.69 -2.12 4.77 0.26 -5.02 117.00 108.41 1f1x n LEU 144 Ca 0.02 -0.26 -0.42 0.00 -0.03 0.00 0.00 56.01 55.32 1f1x n LEU 144 Cb 0.23 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.29 1f1x n LEU 144 CO 0.19 0.08 1.50 -0.47 -1.33 0.00 0.00 177.39 177.36 1f1x s TYR 145 N -2.54 1.97 0.27 -1.77 5.04 -1.08 -5.00 117.35 114.25 1f1x s TYR 145 Ca 0.00 -0.12 0.02 0.00 -2.44 0.00 0.00 57.07 54.53 1f1x s TYR 145 Cb 0.09 -4.20 -0.03 0.00 0.35 0.00 0.00 41.96 38.17 1f1x s TYR 145 CO 0.53 -5.05 0.44 -1.54 -1.34 0.00 0.00 175.55 168.59 1f1x s SER 146 N 3.06 6.32 0.65 4.32 1.04 -1.26 -4.98 113.70 122.85 1f1x s SER 146 Ca 0.83 0.27 0.42 0.00 0.48 0.00 0.00 55.95 57.95 1f1x s SER 146 Cb -0.46 -1.95 2.33 0.00 0.10 0.00 0.00 66.02 66.04 1f1x s SER 146 CO 0.38 -0.15 2.35 0.00 0.98 0.00 0.00 173.24 176.80 1f1x h ALA 147 N 1.17 1.10 -0.37 5.32 0.00 -1.96 -1.68 119.26 122.83 1f1x h ALA 147 Ca -0.50 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.17 1f1x h ALA 147 Cb 1.22 -0.00 -0.16 0.00 0.00 0.00 0.00 17.79 18.85 1f1x h ALA 147 CO 0.62 0.00 -0.31 0.41 0.00 0.00 0.00 179.25 179.98 1f1x n GLY 148 N -1.12 5.36 3.66 0.00 0.00 -1.26 -4.35 105.19 107.48 1f1x n GLY 148 Ca -0.03 -1.62 -0.48 0.00 0.00 0.00 0.00 46.02 43.89 1f1x n GLY 148 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1f1x n GLU 149 N -1.03 1.94 -2.95 1.61 4.07 -0.64 -4.90 120.64 118.75 1f1x n GLU 149 Ca 0.33 0.70 -0.42 0.00 -0.06 0.00 0.00 57.16 57.72 1f1x n GLU 149 Cb 0.90 -2.46 -0.05 0.00 -0.06 0.00 0.00 31.44 29.77 1f1x n GLU 149 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1f1x s LEU 150 N 1.63 4.08 -0.09 4.31 1.43 -1.26 -4.45 118.68 124.33 1f1x s LEU 150 Ca 0.84 0.72 0.20 0.00 -1.03 0.00 0.00 54.13 54.85 1f1x s LEU 150 Cb -0.75 -3.07 -0.27 0.00 0.03 0.00 0.00 46.19 42.13 1f1x s LEU 150 CO 0.44 -0.58 0.34 1.33 0.23 0.00 0.00 176.35 178.11 1f1x n VAL 151 N 5.47 0.80 -3.70 -1.59 0.24 0.28 -1.67 118.33 118.15 1f1x n VAL 151 Ca 0.04 -0.69 -0.12 0.00 -2.04 0.00 0.00 64.34 61.52 1f1x n VAL 151 Cb 0.48 -0.31 -0.07 0.00 -1.47 0.00 0.00 33.84 32.47 1f1x n VAL 151 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1f1x s ARG 152 N -2.97 0.88 0.02 7.34 0.52 -1.22 -1.45 118.95 122.07 1f1x s ARG 152 Ca -0.08 -0.42 -0.23 0.00 -0.52 0.00 0.00 55.73 54.48 1f1x s ARG 152 Cb 0.10 0.39 -0.05 0.00 0.52 0.00 0.00 34.95 35.90 1f1x s ARG 152 CO 0.86 -0.29 0.69 -1.17 0.02 0.00 0.00 175.30 175.41 1f1x s LEU 153 N -2.03 4.44 -0.08 2.53 2.96 -1.26 -0.78 118.68 124.46 1f1x s LEU 153 Ca -0.05 1.32 -0.02 0.00 -0.22 0.00 0.00 54.13 55.16 1f1x s LEU 153 Cb -0.01 -3.09 -0.04 0.00 0.50 0.00 0.00 46.19 43.55 1f1x s LEU 153 CO -0.03 0.06 -0.09 -0.67 -1.32 0.00 0.00 176.35 174.30 1f1x n ASP 154 N 2.76 1.68 -3.79 3.68 2.03 0.10 -4.91 116.55 118.10 1f1x n ASP 154 Ca -0.04 0.04 -0.06 0.00 0.52 0.00 0.00 54.79 55.25 1f1x n ASP 154 Cb 0.51 -0.19 -0.02 0.00 -0.72 0.00 0.00 41.12 40.70 1f1x n ASP 154 CO 0.00 0.00 0.00 -1.38 -1.92 0.00 0.00 177.20 173.90 1f1x s HIS 155 N -2.15 -0.15 0.30 -0.67 -3.43 -1.20 -4.47 115.29 103.52 1f1x s HIS 155 Ca -0.11 -0.25 0.09 0.00 -0.80 0.00 0.00 55.06 53.99 1f1x s HIS 155 Cb 0.04 0.69 -0.04 0.00 -1.43 0.00 0.00 32.58 31.83 1f1x s HIS 155 CO 0.16 -1.08 0.09 -0.06 -2.00 0.00 0.00 174.74 171.85 1f1x s PHE 156 N -3.60 2.74 -0.05 0.38 0.08 -0.52 -0.98 117.98 116.02 1f1x s PHE 156 Ca 0.12 -0.29 -0.02 0.00 0.12 0.00 0.00 56.93 56.85 1f1x s PHE 156 Cb -0.04 -1.45 0.03 0.00 -0.57 0.00 0.00 43.02 41.00 1f1x s PHE 156 CO 0.05 0.46 0.08 1.21 -0.10 0.00 0.00 175.22 176.93 1f1x s ASN 157 N -3.78 0.93 0.00 1.36 3.84 -0.63 -2.52 114.94 114.14 1f1x s ASN 157 Ca 0.35 0.14 0.03 0.00 0.21 0.00 0.00 52.86 53.59 1f1x s ASN 157 Cb -0.04 -0.03 -0.03 0.00 -0.55 0.00 0.00 41.25 40.59 1f1x s ASN 157 CO 0.22 -0.24 -0.07 -1.10 -2.79 0.00 0.00 177.10 173.12 1f1x s GLN 158 N 2.08 2.53 -0.18 0.43 -0.21 -0.05 0.18 119.66 124.45 1f1x s GLN 158 Ca 0.03 -0.73 -0.05 0.00 0.02 0.00 0.00 55.36 54.63 1f1x s GLN 158 Cb -0.12 -2.49 -0.03 0.00 1.00 0.00 0.00 33.01 31.37 1f1x s GLN 158 CO -0.04 0.60 0.01 0.08 -2.12 0.00 0.00 175.29 173.82 1f1x s VAL 159 N -0.98 4.24 -0.01 1.09 1.01 0.43 -0.85 120.40 125.33 1f1x s VAL 159 Ca 0.17 -0.23 -0.12 0.00 0.00 0.00 0.00 61.98 61.80 1f1x s VAL 159 Cb -0.11 -2.89 0.01 0.00 0.00 0.00 0.00 36.38 33.39 1f1x s VAL 159 CO 0.07 0.47 0.24 0.28 0.00 0.00 0.00 175.10 176.16 1f1x s THR 160 N 0.51 0.07 0.34 3.92 -1.32 -0.54 -2.55 115.64 116.06 1f1x s THR 160 Ca -0.00 -0.57 0.09 0.00 -1.21 0.00 0.00 61.69 59.99 1f1x s THR 160 Cb -0.14 -0.55 0.09 0.00 -1.51 0.00 0.00 72.50 70.39 1f1x s THR 160 CO 0.02 -0.31 1.80 -0.65 -2.21 0.00 0.00 174.62 173.26 1f1x h PRO 161 N 4.00 0.18 -3.67 7.08 0.11 -1.64 -1.81 132.00 136.25 1f1x h PRO 161 Ca -0.30 -0.07 -0.63 0.00 0.11 0.00 0.00 66.00 65.11 1f1x h PRO 161 Cb 1.18 -0.01 -0.40 0.00 0.11 0.00 0.00 31.00 31.88 1f1x h PRO 161 CO 0.40 0.49 -0.71 0.34 -0.21 0.00 0.00 178.00 178.31 1f1x s ASP 162 N -6.89 4.21 0.09 -2.05 -1.08 -1.26 -4.57 116.67 105.12 1f1x s ASP 162 Ca -0.04 -2.40 -0.18 0.00 -0.52 0.00 0.00 52.55 49.41 1f1x s ASP 162 Cb 0.14 -1.32 -0.07 0.00 -1.46 0.00 0.00 42.92 40.22 1f1x s ASP 162 CO 0.75 -0.32 1.54 0.58 0.52 0.00 0.00 175.17 178.24 1f1x h VAL 163 N 5.94 1.25 -0.89 1.11 2.07 -1.86 -2.50 116.25 121.38 1f1x h VAL 163 Ca -0.06 -0.92 0.10 0.00 0.82 0.00 0.00 66.70 66.64 1f1x h VAL 163 Cb 0.96 1.29 -0.07 0.00 -1.52 0.00 0.00 31.29 31.95 1f1x h VAL 163 CO 0.54 0.29 0.54 -0.65 0.02 0.00 0.00 177.57 178.32 1f1x h PRO 164 N 0.29 0.87 -0.44 1.57 0.11 -1.95 0.28 132.00 132.74 1f1x h PRO 164 Ca 0.08 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.13 1f1x h PRO 164 Cb 0.42 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.31 1f1x h PRO 164 CO 0.01 0.58 0.22 -0.09 -0.21 0.00 0.00 178.00 178.52 1f1x h ARG 165 N 0.90 0.63 -0.01 1.05 2.43 -1.94 -2.05 114.38 115.39 1f1x h ARG 165 Ca 0.43 -0.09 -0.17 0.00 -0.81 0.00 0.00 59.98 59.34 1f1x h ARG 165 Cb 0.36 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.78 1f1x h ARG 165 CO -0.24 0.53 -0.76 0.78 -1.51 0.00 0.00 179.97 178.77 1f1x h GLY 166 N 0.58 0.13 0.98 2.80 0.00 -0.92 -3.10 103.07 103.54 1f1x h GLY 166 Ca 0.15 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.27 1f1x h GLY 166 CO -0.02 0.18 0.28 -0.09 0.00 0.00 0.00 176.54 176.89 1f1x h ARG 167 N 0.07 0.71 -0.45 4.80 2.43 -0.22 -0.09 114.38 121.63 1f1x h ARG 167 Ca -0.02 -0.08 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 1f1x h ARG 167 Cb 1.33 -0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 30.72 1f1x h ARG 167 CO 0.11 0.55 0.26 -0.22 -1.51 0.00 0.00 179.97 179.16 1f1x h LYS 168 N 0.68 0.62 -0.74 0.20 3.11 -1.34 -0.07 116.57 119.02 1f1x h LYS 168 Ca 0.18 -0.06 0.04 0.00 -2.81 0.00 0.00 60.65 57.99 1f1x h LYS 168 Cb 0.04 -0.13 -0.05 0.00 -1.00 0.00 0.00 32.23 31.10 1f1x h LYS 168 CO -0.03 0.47 0.46 -0.92 -2.81 0.00 0.00 179.45 176.62 1f1x h TYR 169 N 0.60 0.87 -0.09 1.91 3.20 -1.42 0.12 116.97 122.15 1f1x h TYR 169 Ca 0.16 0.02 -0.16 0.00 3.14 0.00 0.00 58.73 61.89 1f1x h TYR 169 Cb 0.02 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 38.00 1f1x h TYR 169 CO -0.03 0.48 -0.65 -0.07 -1.64 0.00 0.00 178.16 176.26 1f1x h LEU 170 N 0.90 0.39 -0.84 2.82 3.38 -0.60 -1.88 115.31 119.49 1f1x h LEU 170 Ca 0.30 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1f1x h LEU 170 Cb 0.04 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 1f1x h LEU 170 CO -0.12 0.94 0.28 -0.33 0.09 0.00 0.00 178.44 179.30 1f1x h GLU 171 N 0.25 1.14 -0.12 1.13 5.08 -0.61 -1.63 114.58 119.81 1f1x h GLU 171 Ca -0.01 -0.21 -0.05 0.00 -1.00 0.00 0.00 59.36 58.08 1f1x h GLU 171 Cb 1.19 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 1f1x h GLU 171 CO 0.11 0.94 -0.17 -0.44 -1.00 0.00 0.00 179.01 178.45 1f1x h ASP 172 N 1.11 0.19 0.58 1.42 3.32 -0.62 -0.22 116.42 122.20 1f1x h ASP 172 Ca 0.25 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.26 1f1x h ASP 172 Cb 0.24 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1f1x h ASP 172 CO -0.02 0.38 0.00 0.18 -1.72 0.00 0.00 179.24 178.06 1f1x n LEU 173 N -4.25 0.00 0.00 1.55 4.77 -0.74 -4.83 117.00 113.50 1f1x n LEU 173 Ca -0.01 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1f1x n LEU 173 Cb 0.29 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1f1x n LEU 173 CO 0.38 -0.12 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 1f1x n GLY 174 N 0.57 0.75 3.77 -0.72 0.00 -0.09 -4.80 105.19 104.67 1f1x n GLY 174 Ca 0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 1f1x n GLY 174 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1f1x s PHE 175 N -2.00 2.97 -0.11 1.61 0.40 -0.66 -4.86 117.98 115.32 1f1x s PHE 175 Ca 0.00 1.54 0.00 0.00 -0.60 0.00 0.00 56.93 57.87 1f1x s PHE 175 Cb 0.00 -3.41 -0.02 0.00 0.51 0.00 0.00 43.02 40.10 1f1x s PHE 175 CO 0.00 -1.46 -0.13 1.03 0.70 0.00 0.00 175.22 175.37 1f1x s ARG 176 N -2.47 3.21 -0.09 0.44 3.00 -0.26 -4.21 118.95 118.58 1f1x s ARG 176 Ca 0.60 -0.67 -0.30 0.00 0.00 0.00 0.00 55.73 55.36 1f1x s ARG 176 Cb -0.30 -2.60 -0.02 0.00 0.00 0.00 0.00 34.95 32.03 1f1x s ARG 176 CO 0.38 0.31 1.05 0.08 0.00 0.00 0.00 175.30 177.12 1f1x s VAL 177 N 0.09 4.66 -0.22 3.52 1.01 -1.26 -0.89 120.40 127.31 1f1x s VAL 177 Ca -0.05 1.94 0.05 0.00 0.00 0.00 0.00 61.98 63.92 1f1x s VAL 177 Cb -0.15 -4.24 -0.20 0.00 0.00 0.00 0.00 36.38 31.79 1f1x s VAL 177 CO 0.04 0.01 -0.06 0.35 0.00 0.00 0.00 175.10 175.44 1f1x n THR 178 N 4.55 1.50 -3.87 3.92 -2.24 -0.46 -4.70 114.28 112.98 1f1x n THR 178 Ca 0.09 -0.66 -0.11 0.00 -2.27 0.00 0.00 64.05 61.10 1f1x n THR 178 Cb 0.48 -1.21 -0.11 0.00 -2.10 0.00 0.00 70.33 67.40 1f1x n THR 178 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1f1x s GLU 179 N -2.52 0.40 0.20 -0.78 2.02 -1.25 -1.44 118.70 115.34 1f1x s GLU 179 Ca -0.26 -0.30 -0.10 0.00 0.02 0.00 0.00 54.97 54.33 1f1x s GLU 179 Cb 0.08 0.17 -0.01 0.00 0.10 0.00 0.00 34.13 34.47 1f1x s GLU 179 CO 0.68 -0.09 0.35 0.16 0.02 0.00 0.00 175.26 176.38 1f1x s ASP 180 N -1.09 -0.01 -0.14 -0.19 1.47 -0.15 -0.78 116.67 115.78 1f1x s ASP 180 Ca -0.12 -0.94 0.02 0.00 1.18 0.00 0.00 52.55 52.69 1f1x s ASP 180 Cb -0.06 0.49 0.00 0.00 -0.34 0.00 0.00 42.92 43.01 1f1x s ASP 180 CO 0.01 -0.99 -0.20 -0.63 0.68 0.00 0.00 175.17 174.04 1f1x s ILE 181 N -4.01 2.26 0.15 2.11 1.01 -0.66 -1.23 121.20 120.83 1f1x s ILE 181 Ca 0.22 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 60.01 1f1x s ILE 181 Cb 0.02 -1.91 -0.04 0.00 0.01 0.00 0.00 42.46 40.54 1f1x s ILE 181 CO 0.05 0.54 -0.14 -1.10 0.00 0.00 0.00 174.94 174.29 1f1x s GLN 182 N 0.74 1.12 0.31 2.79 -0.21 -0.29 -0.61 119.66 123.51 1f1x s GLN 182 Ca -0.08 -1.37 -0.01 0.00 0.02 0.00 0.00 55.36 53.92 1f1x s GLN 182 Cb -0.16 -0.94 0.06 0.00 1.00 0.00 0.00 33.01 32.98 1f1x s GLN 182 CO 0.00 0.17 0.43 -0.40 -2.12 0.00 0.00 175.29 173.37 1f1x n ASP 183 N 0.19 0.45 0.24 5.90 5.68 -0.90 -1.23 116.55 126.88 1f1x n ASP 183 Ca -0.13 -1.41 0.10 0.00 -0.50 0.00 0.00 54.79 52.86 1f1x n ASP 183 Cb 0.58 -0.29 0.61 0.00 -1.14 0.00 0.00 41.12 40.88 1f1x n ASP 183 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1f1x h ASP 184 N -0.33 0.00 0.80 -1.12 3.32 -1.99 -1.62 116.42 115.48 1f1x h ASP 184 Ca -0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1f1x h ASP 184 Cb 0.49 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1f1x h ASP 184 CO 0.14 0.18 0.00 -0.62 -1.72 0.00 0.00 179.24 177.22 1f1x n GLU 185 N -3.65 0.02 -0.23 3.56 1.02 -1.26 -4.89 120.64 115.20 1f1x n GLU 185 Ca -0.01 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1f1x n GLU 185 Cb 0.31 -1.53 0.00 0.00 -0.02 0.00 0.00 31.44 30.20 1f1x n GLU 185 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1f1x n GLY 186 N 0.78 0.72 3.72 0.62 0.00 -0.61 -5.05 105.19 105.38 1f1x n GLY 186 Ca 0.05 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1f1x n GLY 186 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f1x s THR 187 N -2.27 4.14 -0.02 2.61 2.01 -1.26 -4.82 115.64 116.03 1f1x s THR 187 Ca 0.00 1.63 -0.30 0.00 0.31 0.00 0.00 61.69 63.33 1f1x s THR 187 Cb 0.00 -4.04 -0.03 0.00 0.01 0.00 0.00 72.50 68.44 1f1x s THR 187 CO 0.00 0.18 1.08 -0.89 -0.69 0.00 0.00 174.62 174.30 1f1x s THR 188 N 0.63 4.54 -0.09 -0.82 2.01 -1.26 -2.12 115.64 118.53 1f1x s THR 188 Ca 0.54 1.83 0.16 0.00 0.31 0.00 0.00 61.69 64.53 1f1x s THR 188 Cb -0.28 -4.17 -0.23 0.00 0.01 0.00 0.00 72.50 67.83 1f1x s THR 188 CO 0.31 0.08 0.22 -1.22 -0.69 0.00 0.00 174.62 173.32 1f1x n TYR 189 N 4.46 0.00 -3.51 4.92 4.02 0.21 -4.30 117.16 122.97 1f1x n TYR 189 Ca 0.08 0.00 -0.17 0.00 -0.01 0.00 0.00 57.90 57.81 1f1x n TYR 189 Cb 0.48 -0.58 -0.05 0.00 -0.02 0.00 0.00 39.34 39.17 1f1x n TYR 189 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1f1x s ALA 190 N -2.80 -1.71 -0.06 -0.72 0.00 -1.22 -3.48 121.76 111.78 1f1x s ALA 190 Ca -0.07 1.12 -0.12 0.00 0.00 0.00 0.00 51.96 52.88 1f1x s ALA 190 Cb 0.08 0.19 0.02 0.00 0.00 0.00 0.00 23.12 23.41 1f1x s ALA 190 CO 0.68 -0.45 0.30 0.00 0.00 0.00 0.00 175.76 176.29 1f1x s ALA 191 N -1.74 -0.74 -0.17 0.00 0.00 -0.24 -1.65 121.76 117.22 1f1x s ALA 191 Ca -0.08 0.53 -0.03 0.00 0.00 0.00 0.00 51.96 52.38 1f1x s ALA 191 Cb -0.00 -0.19 -0.02 0.00 0.00 0.00 0.00 23.12 22.91 1f1x s ALA 191 CO 0.05 -0.21 -0.05 -1.58 0.00 0.00 0.00 175.76 173.98 1f1x s TRP 192 N -0.66 2.98 0.01 0.00 0.51 0.04 -0.75 118.94 121.07 1f1x s TRP 192 Ca -0.08 -0.50 0.02 0.00 -2.12 0.00 0.00 56.10 53.42 1f1x s TRP 192 Cb -0.04 -1.99 -0.01 0.00 -0.81 0.00 0.00 33.47 30.62 1f1x s TRP 192 CO 0.02 -0.20 -0.05 0.00 -0.51 0.00 0.00 176.95 176.21 1f1x s MET 193 N 0.68 0.40 0.16 4.98 0.23 -0.49 -1.35 119.30 123.91 1f1x s MET 193 Ca -0.03 -0.37 0.05 0.00 -1.03 0.00 0.00 55.69 54.31 1f1x s MET 193 Cb -0.15 -0.30 -0.04 0.00 -1.53 0.00 0.00 34.83 32.81 1f1x s MET 193 CO 0.02 0.07 -0.10 -3.38 -2.03 0.00 0.00 175.02 169.60 1f1x s HIS 194 N -0.58 1.32 0.00 3.16 -3.43 -0.07 -0.85 115.29 114.84 1f1x s HIS 194 Ca -0.03 -0.75 0.00 0.00 -0.80 0.00 0.00 55.06 53.48 1f1x s HIS 194 Cb -0.05 -0.67 0.00 0.00 -1.43 0.00 0.00 32.58 30.44 1f1x s HIS 194 CO -0.00 0.10 0.00 0.54 -2.00 0.00 0.00 174.74 173.38 1f1x n ARG 195 N -0.22 1.70 0.00 -0.38 5.12 -1.26 -1.10 116.66 120.52 1f1x n ARG 195 Ca -0.10 0.00 0.14 0.00 -1.93 0.00 0.00 57.85 55.96 1f1x n ARG 195 Cb 0.61 -0.97 0.57 0.00 -1.16 0.00 0.00 32.46 31.51 1f1x n ARG 195 CO 0.00 0.00 0.00 0.36 -1.93 0.00 0.00 177.63 176.06 1f1x n LYS 196 N -2.20 1.30 -0.03 5.56 2.85 -1.22 -4.93 118.16 119.49 1f1x n LYS 196 Ca 0.00 -0.65 0.00 0.00 -1.05 0.00 0.00 58.31 56.61 1f1x n LYS 196 Cb 0.47 -1.49 0.00 0.00 -0.65 0.00 0.00 35.03 33.36 1f1x n LYS 196 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1f1x n GLY 197 N 1.19 0.98 2.38 2.58 0.00 -1.26 -4.93 105.19 106.13 1f1x n GLY 197 Ca 0.18 -0.01 -0.17 0.00 0.00 0.00 0.00 46.02 46.02 1f1x n GLY 197 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1f1x n THR 198 N -2.03 0.00 -0.33 2.61 -2.24 -1.26 -1.18 114.28 109.85 1f1x n THR 198 Ca 0.00 -1.40 0.05 0.00 -2.27 0.00 0.00 64.05 60.43 1f1x n THR 198 Cb 0.00 -0.12 0.20 0.00 -2.10 0.00 0.00 70.33 68.31 1f1x n THR 198 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1f1x h VAL 199 N 0.70 0.92 -2.67 2.28 2.07 -1.95 -3.42 116.25 114.17 1f1x h VAL 199 Ca -0.23 -0.31 0.02 0.00 0.82 0.00 0.00 66.70 67.00 1f1x h VAL 199 Cb 0.80 -0.07 -0.14 0.00 -1.52 0.00 0.00 31.29 30.37 1f1x h VAL 199 CO 0.36 0.16 0.31 -1.38 0.02 0.00 0.00 177.57 177.04 1f1x s HIS 200 N -6.00 -0.48 -0.12 1.57 0.00 -1.26 -4.16 115.29 104.84 1f1x s HIS 200 Ca -0.12 0.35 0.11 0.00 -3.00 0.00 0.00 55.06 52.40 1f1x s HIS 200 Cb 0.21 0.54 -0.16 0.00 -4.00 0.00 0.00 32.58 29.17 1f1x s HIS 200 CO 0.80 -0.73 0.05 -0.25 -1.00 0.00 0.00 174.74 173.61 1f1x n ASP 201 N -0.22 1.94 -3.86 7.38 8.00 -0.03 -4.55 116.55 125.21 1f1x n ASP 201 Ca -0.14 0.00 -0.10 0.00 0.71 0.00 0.00 54.79 55.26 1f1x n ASP 201 Cb 0.63 0.84 -0.06 0.00 -0.02 0.00 0.00 41.12 42.52 1f1x n ASP 201 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1f1x s THR 202 N -2.33 0.06 0.02 -3.53 -1.32 -0.95 -1.44 115.64 106.15 1f1x s THR 202 Ca -0.06 -1.14 -0.04 0.00 -1.21 0.00 0.00 61.69 59.24 1f1x s THR 202 Cb 0.04 -1.67 -0.01 0.00 -1.51 0.00 0.00 72.50 69.35 1f1x s THR 202 CO 0.51 -0.29 0.06 0.00 -2.21 0.00 0.00 174.62 172.69 1f1x s ALA 203 N -3.92 -0.07 -0.14 11.08 0.00 -1.05 -1.39 121.76 126.27 1f1x s ALA 203 Ca 0.13 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 51.66 1f1x s ALA 203 Cb 0.02 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 23.29 1f1x s ALA 203 CO -0.03 -0.22 -0.15 -0.51 0.00 0.00 0.00 175.76 174.86 1f1x s LEU 204 N -1.61 2.53 0.20 0.00 1.43 0.07 -0.87 118.68 120.43 1f1x s LEU 204 Ca -0.13 -0.43 0.10 0.00 -1.03 0.00 0.00 54.13 52.65 1f1x s LEU 204 Cb -0.07 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 1f1x s LEU 204 CO -0.01 0.12 -0.21 0.42 0.23 0.00 0.00 176.35 176.90 1f1x s THR 205 N 0.62 2.13 0.01 5.49 -4.23 -0.03 -1.08 115.64 118.55 1f1x s THR 205 Ca -0.08 -2.05 -0.25 0.00 -1.18 0.00 0.00 61.69 58.13 1f1x s THR 205 Cb -0.16 -2.03 -0.05 0.00 1.34 0.00 0.00 72.50 71.60 1f1x s THR 205 CO 0.03 -0.26 0.76 -0.83 -0.54 0.00 0.00 174.62 173.77 1f1x s GLY 206 N -2.82 2.74 0.00 3.99 0.00 -1.23 -1.47 107.32 108.53 1f1x s GLY 206 Ca 0.20 0.25 0.00 0.00 0.00 0.00 0.00 44.72 45.17 1f1x s GLY 206 CO 0.09 1.15 0.00 0.61 0.00 0.00 0.00 173.10 174.95 1f1x n GLY 207 N 2.64 -0.91 3.77 0.20 0.00 -0.68 -4.82 105.19 105.40 1f1x n GLY 207 Ca -0.02 -1.16 -0.41 0.00 0.00 0.00 0.00 46.02 44.43 1f1x n GLY 207 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1f1x s ASN 208 N 0.00 6.35 0.31 1.61 0.01 -1.26 -1.75 114.94 120.21 1f1x s ASN 208 Ca 0.00 3.02 -0.11 0.00 -0.71 0.00 0.00 52.86 55.06 1f1x s ASN 208 Cb 0.00 -2.66 0.04 0.00 0.41 0.00 0.00 41.25 39.05 1f1x s ASN 208 CO 0.00 -0.89 0.61 0.61 -1.51 0.00 0.00 177.10 175.92 1f1x n GLY 209 N 1.04 1.25 3.73 0.66 0.00 -1.08 -4.35 105.19 106.44 1f1x n GLY 209 Ca 0.03 -1.22 -0.41 0.00 0.00 0.00 0.00 46.02 44.42 1f1x n GLY 209 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1f1x s PRO 210 N -2.10 4.49 0.03 1.61 0.04 -1.26 0.19 135.00 137.99 1f1x s PRO 210 Ca 0.13 1.82 -0.01 0.00 0.04 0.00 0.00 61.00 62.97 1f1x s PRO 210 Cb -0.04 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.20 1f1x s PRO 210 CO 0.10 -0.12 -0.00 1.03 0.04 0.00 0.00 177.00 178.05 1f1x s ARG 211 N 0.18 0.45 -0.34 4.56 0.52 -1.06 -4.26 118.95 118.99 1f1x s ARG 211 Ca 0.54 -0.79 -0.14 0.00 -0.52 0.00 0.00 55.73 54.82 1f1x s ARG 211 Cb -0.31 0.16 -0.01 0.00 0.52 0.00 0.00 34.95 35.31 1f1x s ARG 211 CO 0.34 -0.08 0.32 -1.17 0.02 0.00 0.00 175.30 174.72 1f1x s LEU 212 N -1.97 4.49 -0.02 2.53 2.96 0.42 -0.43 118.68 126.67 1f1x s LEU 212 Ca -0.08 -0.32 -0.26 0.00 -0.22 0.00 0.00 54.13 53.25 1f1x s LEU 212 Cb -0.04 -2.26 -0.20 0.00 0.50 0.00 0.00 46.19 44.19 1f1x s LEU 212 CO -0.04 -0.31 1.25 -0.74 -1.32 0.00 0.00 176.35 175.19 1f1x h HIS 213 N 8.48 -0.02 -2.50 5.38 -0.00 -0.57 0.65 115.15 126.57 1f1x h HIS 213 Ca -0.30 -0.00 0.15 0.00 -0.00 0.00 0.00 60.37 60.22 1f1x h HIS 213 Cb 1.15 0.01 -0.07 0.00 -0.00 0.00 0.00 27.41 28.49 1f1x h HIS 213 CO 0.68 0.46 0.43 -3.38 -0.00 0.00 0.00 177.93 176.12 1f1x s HIS 214 N -4.24 -0.12 0.01 5.26 0.00 -1.10 -4.35 115.29 110.75 1f1x s HIS 214 Ca -0.16 -0.23 0.08 0.00 -3.00 0.00 0.00 55.06 51.75 1f1x s HIS 214 Cb 0.02 0.66 -0.03 0.00 -4.00 0.00 0.00 32.58 29.23 1f1x s HIS 214 CO 0.66 -0.94 -0.23 0.08 -1.00 0.00 0.00 174.74 173.31 1f1x s VAL 215 N -3.33 2.36 -0.04 -5.38 1.01 -1.13 -1.61 120.40 112.29 1f1x s VAL 215 Ca 0.13 -1.17 0.05 0.00 0.00 0.00 0.00 61.98 60.99 1f1x s VAL 215 Cb -0.02 -1.90 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 1f1x s VAL 215 CO 0.04 0.46 -0.20 0.00 0.00 0.00 0.00 175.10 175.40 1f1x s ALA 216 N -0.75 1.72 0.19 5.51 0.00 -0.16 -1.01 121.76 127.26 1f1x s ALA 216 Ca 0.12 -0.83 0.11 0.00 0.00 0.00 0.00 51.96 51.36 1f1x s ALA 216 Cb -0.10 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.46 1f1x s ALA 216 CO 0.01 0.35 -0.19 -0.06 0.00 0.00 0.00 175.76 175.88 1f1x s PHE 217 N -0.17 2.42 0.27 0.00 0.40 -0.15 -0.72 117.98 120.02 1f1x s PHE 217 Ca -0.00 -0.31 0.08 0.00 -0.60 0.00 0.00 56.93 56.10 1f1x s PHE 217 Cb -0.11 -1.18 -0.04 0.00 0.51 0.00 0.00 43.02 42.20 1f1x s PHE 217 CO 0.02 0.52 0.10 -1.54 0.70 0.00 0.00 175.22 175.01 1f1x s SER 218 N -2.77 4.95 0.40 1.36 1.04 0.04 -1.19 113.70 117.53 1f1x s SER 218 Ca 0.23 -0.51 0.08 0.00 0.48 0.00 0.00 55.95 56.22 1f1x s SER 218 Cb -0.08 -1.03 -0.06 0.00 0.10 0.00 0.00 66.02 64.95 1f1x s SER 218 CO 0.12 -0.07 0.11 0.42 0.98 0.00 0.00 173.24 174.80 1f1x s THR 219 N -2.27 2.32 0.13 2.02 -4.23 -0.33 -0.56 115.64 112.72 1f1x s THR 219 Ca 0.33 -1.81 -0.12 0.00 -1.18 0.00 0.00 61.69 58.91 1f1x s THR 219 Cb -0.06 -2.96 -0.07 0.00 1.34 0.00 0.00 72.50 70.74 1f1x s THR 219 CO 0.22 -0.04 1.43 0.45 -0.54 0.00 0.00 174.62 176.14 1f1x h HIS 220 N 1.58 1.09 -4.35 3.99 3.86 -1.90 -3.43 115.15 115.98 1f1x h HIS 220 Ca -0.43 -0.36 -0.18 0.00 -1.16 0.00 0.00 60.37 58.24 1f1x h HIS 220 Cb 1.25 -0.22 -0.14 0.00 1.06 0.00 0.00 27.41 29.36 1f1x h HIS 220 CO 0.67 1.19 -0.58 -1.21 0.86 0.00 0.00 177.93 178.85 1f1x s GLU 221 N -4.25 1.02 0.26 2.45 2.02 -1.26 -4.87 118.70 114.08 1f1x s GLU 221 Ca -0.11 -1.42 -0.04 0.00 0.02 0.00 0.00 54.97 53.42 1f1x s GLU 221 Cb 0.10 0.27 0.33 0.00 0.10 0.00 0.00 34.13 34.93 1f1x s GLU 221 CO 0.88 -0.32 1.86 0.87 0.02 0.00 0.00 175.26 178.57 1f1x h LYS 222 N 2.76 1.05 -0.05 1.61 1.57 -1.96 -2.47 116.57 119.09 1f1x h LYS 222 Ca -0.34 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.30 1f1x h LYS 222 Cb 1.21 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 33.33 1f1x h LYS 222 CO 0.56 0.82 0.05 1.12 -0.57 0.00 0.00 179.45 181.43 1f1x h HIS 223 N 1.05 0.00 -0.62 -1.35 2.07 -1.97 -1.56 115.15 112.77 1f1x h HIS 223 Ca 0.25 0.00 -0.05 0.00 -2.85 0.00 0.00 60.37 57.72 1f1x h HIS 223 Cb 0.12 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 30.07 1f1x h HIS 223 CO 0.01 0.00 0.17 -0.91 -3.07 0.00 0.00 177.93 174.13 1f1x h ASN 224 N 0.00 0.89 -0.31 3.10 2.35 -1.63 -1.48 115.58 118.50 1f1x h ASN 224 Ca 0.02 -0.16 -0.18 0.00 -0.55 0.00 0.00 56.30 55.43 1f1x h ASN 224 Cb 0.12 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.26 1f1x h ASN 224 CO -0.00 0.85 -0.52 0.40 -1.65 0.00 0.00 177.43 176.51 1f1x h ILE 225 N 0.91 1.27 -0.79 2.81 2.04 -1.40 -2.36 117.51 120.00 1f1x h ILE 225 Ca 0.20 -1.70 -0.02 0.00 1.00 0.00 0.00 64.86 64.34 1f1x h ILE 225 Cb 0.30 1.58 -0.04 0.00 -0.74 0.00 0.00 36.82 37.92 1f1x h ILE 225 CO -0.00 0.56 0.40 0.40 0.00 0.00 0.00 178.15 179.51 1f1x h ILE 226 N 0.69 1.24 -0.59 -0.67 2.04 -1.26 -2.19 117.51 116.77 1f1x h ILE 226 Ca 0.02 -0.64 -0.06 0.00 1.00 0.00 0.00 64.86 65.19 1f1x h ILE 226 Cb 1.13 0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1f1x h ILE 226 CO 0.12 0.28 0.15 -0.61 0.00 0.00 0.00 178.15 178.08 1f1x h GLN 227 N 1.11 0.92 -0.51 2.37 5.75 -1.13 0.04 115.11 123.66 1f1x h GLN 227 Ca 0.28 -0.19 0.04 0.00 -0.15 0.00 0.00 58.65 58.62 1f1x h GLN 227 Cb 0.07 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 28.45 1f1x h GLN 227 CO -0.04 0.82 0.27 0.82 -2.65 0.00 0.00 178.83 178.05 1f1x h ILE 228 N 0.88 0.98 -0.62 2.39 2.04 -0.85 0.83 117.51 123.15 1f1x h ILE 228 Ca 0.19 -0.18 -0.02 0.00 1.00 0.00 0.00 64.86 65.85 1f1x h ILE 228 Cb 0.31 0.41 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 1f1x h ILE 228 CO -0.00 0.10 0.32 0.00 0.00 0.00 0.00 178.15 178.57 1f1x h ASP 230 N 0.85 0.94 -0.42 0.00 3.32 -0.41 -1.04 116.42 119.66 1f1x h ASP 230 Ca 0.22 -0.16 -0.09 0.00 0.02 0.00 0.00 57.03 57.02 1f1x h ASP 230 Cb 0.08 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 1f1x h ASP 230 CO -0.03 0.85 -0.07 0.50 -1.72 0.00 0.00 179.24 178.77 1f1x h LYS 231 N 0.98 0.79 -0.50 3.56 3.64 -0.67 -1.16 116.57 123.22 1f1x h LYS 231 Ca 0.23 -0.29 -0.05 0.00 -1.27 0.00 0.00 60.65 59.27 1f1x h LYS 231 Cb 0.19 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.94 1f1x h LYS 231 CO -0.02 0.90 0.10 0.52 -2.27 0.00 0.00 179.45 178.68 1f1x h MET 232 N 0.62 0.76 -0.61 1.90 2.86 -0.74 0.07 114.93 119.80 1f1x h MET 232 Ca 0.11 -0.16 -0.04 0.00 -2.06 0.00 0.00 59.70 57.55 1f1x h MET 232 Cb 0.59 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.11 1f1x h MET 232 CO 0.04 0.71 0.22 0.78 1.06 0.00 0.00 176.91 179.71 1f1x h GLY 233 N 0.94 0.99 1.85 8.32 0.00 -0.82 -0.21 103.07 114.14 1f1x h GLY 233 Ca 0.16 -0.56 -0.07 0.00 0.00 0.00 0.00 47.33 46.86 1f1x h GLY 233 CO 0.00 0.53 -0.27 0.00 0.00 0.00 0.00 176.54 176.80 1f1x h ALA 234 N 1.08 1.36 -0.08 3.60 0.00 -0.57 -1.87 119.26 122.79 1f1x h ALA 234 Ca 0.20 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1f1x h ALA 234 Cb 0.24 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1f1x h ALA 234 CO -0.01 0.45 0.00 1.28 0.00 0.00 0.00 179.25 180.96 1f1x n LEU 235 N -4.16 1.04 -2.92 0.00 4.77 -0.05 -4.92 117.00 110.77 1f1x n LEU 235 Ca -0.01 -0.41 -0.21 0.00 -0.03 0.00 0.00 56.01 55.34 1f1x n LEU 235 Cb 0.36 -0.05 0.04 0.00 -2.33 0.00 0.00 43.42 41.44 1f1x n LEU 235 CO 0.39 0.20 0.03 0.54 -1.33 0.00 0.00 177.39 177.23 1f1x n ARG 236 N -0.12 -5.00 -0.85 3.23 5.12 -0.70 -4.90 116.66 113.43 1f1x n ARG 236 Ca 0.17 0.85 0.04 0.00 -1.93 0.00 0.00 57.85 56.98 1f1x n ARG 236 Cb 0.24 -5.62 0.17 0.00 -1.16 0.00 0.00 32.46 26.09 1f1x n ARG 236 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1f1x n ILE 237 N -4.51 1.87 0.30 0.55 -5.35 -0.16 -4.75 119.36 107.31 1f1x n ILE 237 Ca -0.09 -2.95 0.18 0.00 -0.27 0.00 0.00 62.75 59.61 1f1x n ILE 237 Cb 0.61 -0.08 0.90 0.00 -1.74 0.00 0.00 39.64 39.32 1f1x n ILE 237 CO 0.00 0.00 0.00 0.77 -1.76 0.00 0.00 176.55 175.56 1f1x h SER 238 N 1.09 0.00 0.25 7.28 4.64 -1.84 -1.29 113.55 123.68 1f1x h SER 238 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1f1x h SER 238 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1f1x h SER 238 CO 0.06 0.04 0.00 -0.90 -0.87 0.00 0.00 176.83 175.16 1f1x n ASP 239 N -3.29 0.00 -0.49 4.97 5.75 -1.26 -1.54 116.55 120.69 1f1x n ASP 239 Ca -0.02 0.32 0.13 0.00 -0.01 0.00 0.00 54.79 55.21 1f1x n ASP 239 Cb 0.19 -0.39 0.35 0.00 -1.03 0.00 0.00 41.12 40.24 1f1x n ASP 239 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1f1x n ARG 240 N -1.39 1.48 -2.83 0.11 5.12 -0.49 -4.73 116.66 113.94 1f1x n ARG 240 Ca 0.03 -0.99 -0.43 0.00 -1.93 0.00 0.00 57.85 54.53 1f1x n ARG 240 Cb 0.09 -1.48 -0.04 0.00 -1.16 0.00 0.00 32.46 29.87 1f1x n ARG 240 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1f1x s ILE 241 N -2.20 4.55 -0.14 0.55 1.01 -0.59 -0.53 121.20 123.86 1f1x s ILE 241 Ca 0.30 0.97 -0.18 0.00 0.00 0.00 0.00 60.65 61.73 1f1x s ILE 241 Cb 0.20 -4.36 -0.25 0.00 0.01 0.00 0.00 42.46 38.06 1f1x s ILE 241 CO 0.41 -0.65 0.49 -0.08 0.00 0.00 0.00 174.94 175.10 1f1x h GLU 242 N 8.74 0.15 -2.86 2.79 4.81 -1.33 -3.49 114.58 123.40 1f1x h GLU 242 Ca -0.24 -0.26 -0.13 0.00 -0.13 0.00 0.00 59.36 58.60 1f1x h GLU 242 Cb 1.08 0.10 -0.24 0.00 0.63 0.00 0.00 28.75 30.32 1f1x h GLU 242 CO 0.99 1.13 -0.28 0.50 -0.73 0.00 0.00 179.01 180.62 1f1x s ARG 243 N -2.42 0.47 0.00 1.92 3.52 -1.04 -4.95 118.95 116.44 1f1x s ARG 243 Ca -0.22 0.42 0.00 0.00 -0.13 0.00 0.00 55.73 55.80 1f1x s ARG 243 Cb 0.04 0.23 0.00 0.00 -1.56 0.00 0.00 34.95 33.66 1f1x s ARG 243 CO 0.71 -0.07 0.00 0.41 -0.81 0.00 0.00 175.30 175.54 1f1x n GLY 244 N 2.65 -2.93 3.77 8.12 0.00 -1.26 -0.56 105.19 114.97 1f1x n GLY 244 Ca -0.14 -2.13 -0.35 0.00 0.00 0.00 0.00 46.02 43.39 1f1x n GLY 244 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1f1x s PRO 245 N -0.69 3.34 0.19 1.61 0.04 -1.26 -4.94 135.00 133.29 1f1x s PRO 245 Ca 0.00 1.68 -0.06 0.00 0.04 0.00 0.00 61.00 62.66 1f1x s PRO 245 Cb 0.00 -2.04 0.02 0.00 0.04 0.00 0.00 34.50 32.52 1f1x s PRO 245 CO 0.00 -0.88 0.35 0.41 0.04 0.00 0.00 177.00 176.92 1f1x n GLY 246 N 0.26 1.78 3.19 0.56 0.00 -0.80 -4.97 105.19 105.21 1f1x n GLY 246 Ca 0.11 -1.22 -0.33 0.00 0.00 0.00 0.00 46.02 44.58 1f1x n GLY 246 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1f1x s ARG 247 N -2.13 3.11 0.32 1.61 6.06 -1.26 -0.47 118.95 126.19 1f1x s ARG 247 Ca 0.09 -0.78 -0.27 0.00 -2.50 0.00 0.00 55.73 52.28 1f1x s ARG 247 Cb -0.02 -2.66 -0.10 0.00 0.06 0.00 0.00 34.95 32.24 1f1x s ARG 247 CO 0.07 -0.15 0.97 -1.01 -2.50 0.00 0.00 175.30 172.68 1f1x s HIS 248 N 1.21 3.66 -0.02 5.12 3.76 0.36 -0.25 115.29 129.13 1f1x s HIS 248 Ca 0.02 1.77 -0.08 0.00 -0.15 0.00 0.00 55.06 56.62 1f1x s HIS 248 Cb -0.14 -3.00 -0.05 0.00 1.11 0.00 0.00 32.58 30.51 1f1x s HIS 248 CO -0.08 0.04 0.56 0.78 -0.85 0.00 0.00 174.74 175.19 1f1x h GLY 249 N 3.26 -0.32 -5.08 -2.22 0.00 -1.30 -3.14 103.07 94.26 1f1x h GLY 249 Ca -0.47 0.12 -0.55 0.00 0.00 0.00 0.00 47.33 46.43 1f1x h GLY 249 CO 0.65 -0.12 1.06 -0.62 0.00 0.00 0.00 176.54 177.52 1f1x n VAL 250 N -3.64 0.33 0.00 4.60 0.31 -0.53 -1.67 118.33 117.73 1f1x n VAL 250 Ca -0.04 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.23 1f1x n VAL 250 Cb 0.12 -2.01 0.00 0.00 -0.91 0.00 0.00 33.84 31.04 1f1x n VAL 250 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1f1x n SER 251 N 5.39 0.00 -1.93 4.52 3.41 -1.26 -4.44 113.62 119.31 1f1x n SER 251 Ca 0.18 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.59 1f1x n SER 251 Cb 0.35 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.25 1f1x n SER 251 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1f1x n ASN 252 N 0.00 -5.48 -4.80 4.04 5.15 -0.67 -4.83 115.26 108.66 1f1x n ASN 252 Ca 0.00 0.29 -0.37 0.00 -0.60 0.00 0.00 54.58 53.90 1f1x n ASN 252 Cb 0.00 -4.73 -0.06 0.00 -0.53 0.00 0.00 39.78 34.46 1f1x n ASN 252 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1f1x s ALA 253 N -2.83 3.41 -0.27 5.20 0.00 -1.25 -4.77 121.76 121.25 1f1x s ALA 253 Ca 0.00 0.22 -0.22 0.00 0.00 0.00 0.00 51.96 51.97 1f1x s ALA 253 Cb 0.00 -2.86 -0.01 0.00 0.00 0.00 0.00 23.12 20.24 1f1x s ALA 253 CO 0.00 0.31 0.69 0.12 0.00 0.00 0.00 175.76 176.88 1f1x s PHE 254 N -1.43 3.26 0.30 0.00 5.36 -0.53 -0.49 117.98 124.45 1f1x s PHE 254 Ca 0.41 0.82 0.06 0.00 -0.96 0.00 0.00 56.93 57.26 1f1x s PHE 254 Cb -0.18 -2.97 -0.06 0.00 -0.34 0.00 0.00 43.02 39.47 1f1x s PHE 254 CO 0.22 -0.41 -0.02 1.52 -1.46 0.00 0.00 175.22 175.07 1f1x s TYR 255 N 2.66 2.02 -0.17 10.12 -0.85 0.38 -1.13 117.35 130.38 1f1x s TYR 255 Ca 0.28 -0.76 -0.12 0.00 -0.52 0.00 0.00 57.07 55.96 1f1x s TYR 255 Cb -0.15 -1.23 0.05 0.00 0.38 0.00 0.00 41.96 41.02 1f1x s TYR 255 CO 0.10 0.23 0.43 -1.17 -1.52 0.00 0.00 175.55 173.62 1f1x s LEU 256 N -3.48 0.04 -0.11 -3.49 2.96 0.11 -1.91 118.68 112.80 1f1x s LEU 256 Ca 0.32 0.91 0.03 0.00 -0.22 0.00 0.00 54.13 55.17 1f1x s LEU 256 Cb 0.06 1.44 -0.01 0.00 0.50 0.00 0.00 46.19 48.18 1f1x s LEU 256 CO 0.13 -0.18 -0.20 -0.31 -1.32 0.00 0.00 176.35 174.47 1f1x s TYR 257 N 0.97 2.64 0.20 5.38 1.51 0.27 -0.65 117.35 127.67 1f1x s TYR 257 Ca -0.06 -0.89 0.06 0.00 -1.01 0.00 0.00 57.07 55.17 1f1x s TYR 257 Cb -0.06 -1.74 -0.05 0.00 -0.11 0.00 0.00 41.96 39.99 1f1x s TYR 257 CO -0.08 -0.33 -0.09 0.96 -1.11 0.00 0.00 175.55 174.90 1f1x s ILE 258 N 0.30 1.38 -0.13 2.71 -4.36 -0.22 -0.94 121.20 119.93 1f1x s ILE 258 Ca -0.15 -2.11 0.01 0.00 -0.26 0.00 0.00 60.65 58.13 1f1x s ILE 258 Cb -0.17 -2.11 -0.01 0.00 1.25 0.00 0.00 42.46 41.42 1f1x s ILE 258 CO 0.08 -0.54 -0.15 -0.76 0.24 0.00 0.00 174.94 173.80 1f1x s LEU 259 N -3.28 2.57 1.04 0.37 1.43 0.31 -0.69 118.68 120.42 1f1x s LEU 259 Ca 0.23 -0.40 -0.17 0.00 -1.03 0.00 0.00 54.13 52.76 1f1x s LEU 259 Cb 0.02 -1.57 0.23 0.00 0.03 0.00 0.00 46.19 44.90 1f1x s LEU 259 CO 0.06 0.14 1.25 1.51 0.23 0.00 0.00 176.35 179.54 1f1x s ASP 260 N 0.46 2.42 0.65 2.29 -4.77 -0.07 -4.84 116.67 112.82 1f1x s ASP 260 Ca -0.11 0.40 0.40 0.00 -3.30 0.00 0.00 52.55 49.95 1f1x s ASP 260 Cb -0.16 -0.52 2.23 0.00 -1.09 0.00 0.00 42.92 43.38 1f1x s ASP 260 CO 0.05 -3.18 2.30 -0.65 0.70 0.00 0.00 175.17 174.40 1f1x h PRO 261 N -1.94 0.00 -0.61 2.11 0.11 -1.89 -0.04 132.00 129.74 1f1x h PRO 261 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1f1x h PRO 261 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1f1x h PRO 261 CO 0.37 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.91 1f1x n ASP 262 N -3.22 4.30 -0.06 -2.05 8.00 -1.26 -4.95 116.55 117.30 1f1x n ASP 262 Ca -0.03 -2.31 -0.01 0.00 0.71 0.00 0.00 54.79 53.15 1f1x n ASP 262 Cb 0.11 -0.51 -0.00 0.00 -0.02 0.00 0.00 41.12 40.70 1f1x n ASP 262 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1f1x n ASN 263 N 1.09 -3.85 -4.73 -2.24 3.02 -0.03 -4.99 115.26 103.54 1f1x n ASN 263 Ca 0.24 0.02 -0.42 0.00 -0.03 0.00 0.00 54.58 54.39 1f1x n ASN 263 Cb 0.77 -1.42 -0.03 0.00 -0.61 0.00 0.00 39.78 38.48 1f1x n ASN 263 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1f1x s HIS 264 N -1.78 3.24 -0.08 3.10 3.76 -1.26 -4.68 115.29 117.58 1f1x s HIS 264 Ca 0.00 1.08 -0.20 0.00 -0.15 0.00 0.00 55.06 55.79 1f1x s HIS 264 Cb 0.00 -3.65 -0.04 0.00 1.11 0.00 0.00 32.58 29.99 1f1x s HIS 264 CO 0.00 -2.17 0.56 0.50 -0.85 0.00 0.00 174.74 172.78 1f1x s ARG 265 N 0.45 4.36 -0.12 1.40 3.52 -1.26 -0.89 118.95 126.40 1f1x s ARG 265 Ca 0.61 0.62 0.02 0.00 -0.13 0.00 0.00 55.73 56.85 1f1x s ARG 265 Cb -0.37 -3.42 -0.00 0.00 -1.56 0.00 0.00 34.95 29.59 1f1x s ARG 265 CO 0.35 0.17 -0.19 0.42 -0.81 0.00 0.00 175.30 175.24 1f1x s ILE 266 N 0.54 2.49 -0.07 4.11 -1.09 0.13 -2.83 121.20 124.47 1f1x s ILE 266 Ca 0.30 -0.85 -0.11 0.00 -2.23 0.00 0.00 60.65 57.76 1f1x s ILE 266 Cb -0.16 -2.01 -0.05 0.00 -1.58 0.00 0.00 42.46 38.66 1f1x s ILE 266 CO 0.14 0.54 0.26 -0.70 -1.23 0.00 0.00 174.94 173.94 1f1x s GLU 267 N 0.49 3.68 -0.11 2.79 2.12 -0.18 -1.06 118.70 126.44 1f1x s GLU 267 Ca -0.12 0.10 0.03 0.00 0.36 0.00 0.00 54.97 55.34 1f1x s GLU 267 Cb -0.17 -3.22 0.00 0.00 0.26 0.00 0.00 34.13 31.01 1f1x s GLU 267 CO 0.05 0.71 -0.22 0.42 -0.54 0.00 0.00 175.26 175.68 1f1x s ILE 268 N -0.97 1.96 0.21 -3.70 1.09 0.18 -0.98 121.20 118.99 1f1x s ILE 268 Ca 0.19 -0.95 -0.05 0.00 -1.10 0.00 0.00 60.65 58.74 1f1x s ILE 268 Cb -0.14 -1.71 -0.03 0.00 -1.06 0.00 0.00 42.46 39.52 1f1x s ILE 268 CO 0.08 0.54 0.24 -0.72 -0.10 0.00 0.00 174.94 174.97 1f1x s TYR 269 N 0.51 0.86 0.07 3.97 1.13 -0.33 -0.71 117.35 122.84 1f1x s TYR 269 Ca -0.15 -1.14 -0.02 0.00 -1.41 0.00 0.00 57.07 54.35 1f1x s TYR 269 Cb -0.17 -0.30 -0.03 0.00 -1.10 0.00 0.00 41.96 40.35 1f1x s TYR 269 CO 0.05 -0.74 0.02 -0.08 -2.51 0.00 0.00 175.55 172.29 1f1x s THR 270 N -4.10 0.19 0.00 -3.49 -1.32 -0.28 -1.19 115.64 105.45 1f1x s THR 270 Ca 0.32 -1.72 0.00 0.00 -1.21 0.00 0.00 61.69 59.08 1f1x s THR 270 Cb 0.05 -1.56 0.00 0.00 -1.51 0.00 0.00 72.50 69.47 1f1x s THR 270 CO 0.10 -0.87 0.00 1.67 -2.21 0.00 0.00 174.62 173.31 1f1x n GLN 271 N 0.05 0.00 -4.55 7.08 7.27 -1.26 -1.45 117.38 124.52 1f1x n GLN 271 Ca -0.13 0.27 -0.26 0.00 0.07 0.00 0.00 57.00 56.95 1f1x n GLN 271 Cb 0.62 -0.24 -0.09 0.00 2.41 0.00 0.00 30.24 32.94 1f1x n GLN 271 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 1f1x s ASP 272 N 0.00 2.96 0.08 1.69 -1.08 -1.26 -4.50 116.67 114.56 1f1x s ASP 272 Ca 0.00 -1.59 -0.03 0.00 -0.52 0.00 0.00 52.55 50.42 1f1x s ASP 272 Cb 0.00 0.33 -0.03 0.00 -1.46 0.00 0.00 42.92 41.76 1f1x s ASP 272 CO 0.00 -0.82 0.04 -0.72 0.52 0.00 0.00 175.17 174.19 1f1x s TYR 273 N -3.16 0.53 -0.06 -5.34 -0.85 -1.26 -5.06 117.35 102.15 1f1x s TYR 273 Ca 0.24 -1.01 -0.30 0.00 -0.52 0.00 0.00 57.07 55.48 1f1x s TYR 273 Cb 0.04 -0.34 -0.02 0.00 0.38 0.00 0.00 41.96 42.02 1f1x s TYR 273 CO 0.13 -0.45 1.00 -0.47 -1.52 0.00 0.00 175.55 174.23 1f1x s TYR 274 N -3.94 3.58 0.00 -3.49 5.04 -1.26 -3.98 117.35 113.29 1f1x s TYR 274 Ca 0.11 1.64 0.00 0.00 -2.44 0.00 0.00 57.07 56.38 1f1x s TYR 274 Cb 0.07 -3.16 0.00 0.00 0.35 0.00 0.00 41.96 39.22 1f1x s TYR 274 CO -0.07 -0.13 0.94 0.25 -1.34 0.00 0.00 175.55 175.20 1f1x n THR 275 N 4.27 0.89 0.37 4.34 -2.24 -0.32 -4.83 114.28 116.76 1f1x n THR 275 Ca 0.08 -0.90 0.09 0.00 -2.27 0.00 0.00 64.05 61.04 1f1x n THR 275 Cb 0.50 0.56 0.38 0.00 -2.10 0.00 0.00 70.33 69.67 1f1x n THR 275 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1f1x n GLY 276 N -0.45 -1.05 3.78 3.38 0.00 -1.25 -4.70 105.19 104.90 1f1x n GLY 276 Ca 0.00 0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1f1x n GLY 276 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1f1x s ASP 277 N -3.62 6.87 0.55 1.61 1.11 -1.26 -4.91 116.67 117.01 1f1x s ASP 277 Ca 0.04 2.04 0.29 0.00 0.18 0.00 0.00 52.55 55.10 1f1x s ASP 277 Cb 0.08 -2.59 1.58 0.00 1.07 0.00 0.00 42.92 43.07 1f1x s ASP 277 CO 0.28 -0.41 2.12 1.55 1.18 0.00 0.00 175.17 179.89 1f1x h PRO 278 N 2.68 0.00 -0.59 8.23 0.13 -2.04 -1.18 132.00 139.24 1f1x h PRO 278 Ca -0.48 0.00 -0.20 0.00 -0.87 0.00 0.00 66.00 64.45 1f1x h PRO 278 Cb 1.21 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.22 1f1x h PRO 278 CO 0.63 0.08 0.19 -0.40 -0.23 0.00 0.00 178.00 178.27 1f1x n ASP 279 N -3.62 3.98 -4.55 1.44 5.75 -1.26 -5.02 116.55 113.27 1f1x n ASP 279 Ca -0.02 -3.36 -0.52 0.00 -0.01 0.00 0.00 54.79 50.89 1f1x n ASP 279 Cb 0.20 -0.69 -0.05 0.00 -1.03 0.00 0.00 41.12 39.54 1f1x n ASP 279 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1f1x n ASN 280 N -0.57 0.97 -4.66 -1.12 5.15 -0.45 -4.79 115.26 109.80 1f1x n ASN 280 Ca 0.38 1.14 -0.43 0.00 -0.60 0.00 0.00 54.58 55.07 1f1x n ASN 280 Cb 1.25 -1.13 -0.02 0.00 -0.53 0.00 0.00 39.78 39.34 1f1x n ASN 280 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 1f1x s PRO 281 N -0.12 4.14 0.20 1.20 0.02 -1.26 -4.95 135.00 134.23 1f1x s PRO 281 Ca 0.79 1.94 -0.30 0.00 0.02 0.00 0.00 61.00 63.45 1f1x s PRO 281 Cb -0.96 -3.92 -0.08 0.00 0.02 0.00 0.00 34.50 29.55 1f1x s PRO 281 CO 0.52 -0.87 1.18 0.99 -0.33 0.00 0.00 177.00 178.49 1f1x s THR 282 N 4.03 3.56 -0.29 0.99 2.01 -1.26 -4.91 115.64 119.76 1f1x s THR 282 Ca 0.67 1.35 -0.11 0.00 0.31 0.00 0.00 61.69 63.92 1f1x s THR 282 Cb -0.28 -3.86 -0.04 0.00 0.01 0.00 0.00 72.50 68.33 1f1x s THR 282 CO 0.25 0.24 0.19 -0.63 -0.69 0.00 0.00 174.62 173.97 1f1x s ILE 283 N -0.26 5.15 -0.23 1.82 1.01 -0.52 -4.97 121.20 123.20 1f1x s ILE 283 Ca 0.51 -0.01 -0.08 0.00 0.00 0.00 0.00 60.65 61.08 1f1x s ILE 283 Cb -0.32 -3.51 -0.03 0.00 0.01 0.00 0.00 42.46 38.60 1f1x s ILE 283 CO 0.38 0.18 0.08 -0.89 0.00 0.00 0.00 174.94 174.68 1f1x s THR 284 N 1.72 4.54 -0.11 2.92 2.01 -1.26 -0.98 115.64 124.49 1f1x s THR 284 Ca 0.07 -0.10 -0.05 0.00 0.31 0.00 0.00 61.69 61.92 1f1x s THR 284 Cb -0.16 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.21 1f1x s THR 284 CO 0.10 0.37 0.07 0.26 -0.69 0.00 0.00 174.62 174.73 1f1x s TRP 285 N 1.22 3.38 0.31 4.92 0.52 -0.36 -4.97 118.94 123.95 1f1x s TRP 285 Ca 0.05 0.35 -0.27 0.00 0.02 0.00 0.00 56.10 56.25 1f1x s TRP 285 Cb -0.14 -1.88 -0.10 0.00 -1.15 0.00 0.00 33.47 30.21 1f1x s TRP 285 CO 0.04 0.59 0.97 1.21 0.02 0.00 0.00 176.95 179.78 1f1x s ASN 286 N -0.90 7.33 0.63 2.95 2.47 -1.26 -1.14 114.94 125.02 1f1x s ASN 286 Ca 0.14 1.94 0.31 0.00 0.42 0.00 0.00 52.86 55.66 1f1x s ASN 286 Cb -0.12 -2.59 1.68 0.00 -1.45 0.00 0.00 41.25 38.77 1f1x s ASN 286 CO 0.03 -0.08 2.00 -0.37 -3.72 0.00 0.00 177.10 174.96 1f1x h VAL 287 N 2.73 0.21 -0.47 -5.21 -1.51 -1.52 -0.66 116.25 109.82 1f1x h VAL 287 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.00 1f1x h VAL 287 Cb 1.20 0.73 0.00 0.00 -2.13 0.00 0.00 31.29 31.09 1f1x h VAL 287 CO 0.66 0.00 0.00 1.41 -1.23 0.00 0.00 177.57 178.41 1f1x n HIS 288 N -3.34 0.61 -2.95 5.19 8.25 -1.26 -4.84 115.22 116.88 1f1x n HIS 288 Ca 0.01 -0.31 -0.43 0.00 -0.26 0.00 0.00 57.72 56.74 1f1x n HIS 288 Cb 0.41 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.46 1f1x n HIS 288 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1f1x s ASP 289 N -1.34 6.36 0.48 0.41 -1.08 -0.26 -4.91 116.67 116.34 1f1x s ASP 289 Ca 0.41 -0.30 0.24 0.00 -0.52 0.00 0.00 52.55 52.38 1f1x s ASP 289 Cb 0.23 -2.39 1.24 0.00 -1.46 0.00 0.00 42.92 40.54 1f1x s ASP 289 CO 0.31 -1.01 2.00 -0.55 0.52 0.00 0.00 175.17 176.44 1f1x h ASN 290 N 9.09 0.00 0.37 -0.34 -1.07 -1.88 -1.91 115.58 119.83 1f1x h ASN 290 Ca -0.26 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.11 1f1x h ASN 290 Cb 1.08 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.33 1f1x h ASN 290 CO 1.00 0.17 0.00 0.00 0.07 0.00 0.00 177.43 178.67 1f1x n GLN 291 N -3.71 0.00 0.19 4.14 6.02 -1.26 -1.86 117.38 120.91 1f1x n GLN 291 Ca -0.02 0.31 0.03 0.00 -0.01 0.00 0.00 57.00 57.31 1f1x n GLN 291 Cb 0.29 -1.50 0.39 0.00 1.02 0.00 0.00 30.24 30.44 1f1x n GLN 291 CO 0.00 0.00 0.00 0.07 -1.01 0.00 0.00 177.06 176.12 1f1x h ARG 292 N 0.00 0.01 0.00 -1.09 0.11 -1.70 -2.92 114.38 108.79 1f1x h ARG 292 Ca 0.00 -0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.93 1f1x h ARG 292 Cb 0.19 -0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.24 1f1x h ARG 292 CO 0.00 0.33 -0.93 0.00 0.10 0.00 0.00 179.97 179.47 1f1x h ARG 293 N 0.01 0.00 -3.52 0.08 3.08 -1.58 -1.34 114.38 111.11 1f1x h ARG 293 Ca -0.00 0.00 -0.48 0.00 0.07 0.00 0.00 59.98 59.57 1f1x h ARG 293 Cb 0.57 0.00 -0.39 0.00 0.08 0.00 0.00 29.97 30.23 1f1x h ARG 293 CO 0.04 0.67 -0.76 -0.51 -1.07 0.00 0.00 179.97 178.34 1f1x s ASP 294 N -6.44 2.31 0.51 7.04 1.01 -1.11 -3.95 116.67 116.04 1f1x s ASP 294 Ca -0.23 -0.51 0.15 0.00 0.71 0.00 0.00 52.55 52.67 1f1x s ASP 294 Cb 0.04 -0.47 1.22 0.00 1.01 0.00 0.00 42.92 44.71 1f1x s ASP 294 CO 0.47 -0.27 2.13 -0.25 0.21 0.00 0.00 175.17 177.45 1f1x h TRP 295 N 8.31 0.03 -0.01 4.23 2.91 -0.64 -2.47 115.95 128.30 1f1x h TRP 295 Ca -0.17 0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.85 1f1x h TRP 295 Cb 1.13 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.77 1f1x h TRP 295 CO 0.34 0.04 -0.34 0.91 -1.03 0.00 0.00 178.44 178.35 1f1x n TRP 296 N -4.51 0.00 -0.79 2.65 8.01 -1.26 -4.95 117.44 116.59 1f1x n TRP 296 Ca -0.03 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.16 1f1x n TRP 296 Cb 0.11 -0.04 0.00 0.00 -2.01 0.00 0.00 31.31 29.37 1f1x n TRP 296 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1f1x n GLY 297 N 1.38 0.58 3.47 6.99 0.00 -0.93 -5.03 105.19 111.66 1f1x n GLY 297 Ca 0.11 -0.25 -0.44 0.00 0.00 0.00 0.00 46.02 45.45 1f1x n GLY 297 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1f1x n ASN 298 N 0.45 -0.42 -4.76 1.61 4.13 -1.26 -4.86 115.26 110.15 1f1x n ASN 298 Ca 0.00 1.03 -0.38 0.00 1.68 0.00 0.00 54.58 56.91 1f1x n ASN 298 Cb 0.00 -1.12 0.02 0.00 -1.54 0.00 0.00 39.78 37.14 1f1x n ASN 298 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1f1x s PRO 299 N -1.42 3.43 0.29 3.52 0.04 -1.26 -4.90 135.00 134.71 1f1x s PRO 299 Ca 0.62 2.15 -0.29 0.00 0.04 0.00 0.00 61.00 63.52 1f1x s PRO 299 Cb -0.71 -2.40 -0.11 0.00 0.04 0.00 0.00 34.50 31.33 1f1x s PRO 299 CO 0.58 -0.93 1.46 0.08 0.04 0.00 0.00 177.00 178.24 1f1x s VAL 300 N -1.34 2.43 -0.39 -0.36 1.01 -1.26 -5.00 120.40 115.49 1f1x s VAL 300 Ca 0.67 0.39 -0.08 0.00 0.00 0.00 0.00 61.98 62.95 1f1x s VAL 300 Cb -0.38 -3.25 0.07 0.00 0.00 0.00 0.00 36.38 32.82 1f1x s VAL 300 CO 0.46 0.07 0.21 -0.69 0.00 0.00 0.00 175.10 175.15 1f1x s VAL 301 N -0.37 4.08 0.43 2.92 1.01 -1.26 -5.01 120.40 122.20 1f1x s VAL 301 Ca 0.57 -1.32 0.16 0.00 0.00 0.00 0.00 61.98 61.40 1f1x s VAL 301 Cb -0.44 -3.44 0.36 0.00 0.00 0.00 0.00 36.38 32.86 1f1x s VAL 301 CO 0.49 -0.40 1.93 -0.65 0.00 0.00 0.00 175.10 176.46 1f1x h PRO 302 N 8.34 0.38 0.00 2.72 0.11 -1.97 -2.07 132.00 139.50 1f1x h PRO 302 Ca -0.23 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.84 1f1x h PRO 302 Cb 1.08 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 1f1x h PRO 302 CO 0.70 0.25 -0.11 0.66 -0.21 0.00 0.00 178.00 179.29 1f1x h SER 303 N 0.39 0.00 0.65 -2.05 4.64 -1.97 -0.22 113.55 114.99 1f1x h SER 303 Ca 0.36 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.66 1f1x h SER 303 Cb 0.85 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.94 1f1x h SER 303 CO -0.11 0.11 -0.08 -0.25 -0.87 0.00 0.00 176.83 175.63 1f1x h TRP 304 N 0.00 0.00 -0.01 4.77 7.01 -1.69 0.05 115.95 126.09 1f1x h TRP 304 Ca -0.00 0.00 0.00 0.00 2.11 0.00 0.00 58.89 61.00 1f1x h TRP 304 Cb 0.29 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.35 1f1x h TRP 304 CO 0.00 0.08 -0.73 0.66 -2.79 0.00 0.00 178.44 175.66 1f1x n TYR 305 N -3.31 0.00 -0.04 2.65 4.02 -0.13 -4.58 117.16 115.78 1f1x n TYR 305 Ca -0.01 0.00 -0.04 0.00 -0.01 0.00 0.00 57.90 57.84 1f1x n TYR 305 Cb 0.27 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.53 1f1x n TYR 305 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1f1x n THR 306 N -0.83 0.52 -3.75 -0.72 -2.24 -0.96 -5.03 114.28 101.26 1f1x n THR 306 Ca 0.06 -0.31 -0.36 0.00 -2.27 0.00 0.00 64.05 61.17 1f1x n THR 306 Cb 0.38 -0.80 -0.07 0.00 -2.10 0.00 0.00 70.33 67.73 1f1x n THR 306 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1f1x s GLU 307 N -2.18 3.84 0.06 -0.78 0.41 -0.04 -5.08 118.70 114.93 1f1x s GLU 307 Ca -0.05 -0.08 -0.25 0.00 -0.41 0.00 0.00 54.97 54.18 1f1x s GLU 307 Cb 0.02 -3.30 0.06 0.00 -1.78 0.00 0.00 34.13 29.14 1f1x s GLU 307 CO 0.30 0.54 0.59 0.00 -0.49 0.00 0.00 175.26 176.21 1f1x s ALA 308 N -0.37 -1.55 0.39 5.21 0.00 -1.26 -4.82 121.76 119.35 1f1x s ALA 308 Ca 0.14 0.77 -0.24 0.00 0.00 0.00 0.00 51.96 52.62 1f1x s ALA 308 Cb -0.12 0.45 -0.09 0.00 0.00 0.00 0.00 23.12 23.36 1f1x s ALA 308 CO 0.03 -0.56 1.05 -1.12 0.00 0.00 0.00 175.76 175.16 1f1x s SER 309 N -2.02 6.81 0.86 0.00 0.01 0.22 -4.78 113.70 114.79 1f1x s SER 309 Ca -0.05 2.04 -0.11 0.00 1.31 0.00 0.00 55.95 59.14 1f1x s SER 309 Cb -0.01 -2.59 0.11 0.00 0.21 0.00 0.00 66.02 63.74 1f1x s SER 309 CO -0.02 -0.46 1.09 -0.54 0.41 0.00 0.00 173.24 173.72 1f1x s LYS 310 N -2.42 1.57 0.10 12.44 1.02 -1.26 -0.43 119.74 130.76 1f1x s LYS 310 Ca 0.57 0.93 0.05 0.00 0.02 0.00 0.00 55.97 57.54 1f1x s LYS 310 Cb -0.22 -1.84 -0.03 0.00 -0.52 0.00 0.00 37.83 35.21 1f1x s LYS 310 CO 0.28 -2.05 -0.13 0.14 -0.92 0.00 0.00 175.35 172.67 1f1x s VAL 311 N -2.93 1.19 0.15 3.17 -7.23 -1.26 -0.71 120.40 112.79 1f1x s VAL 311 Ca 0.63 -1.60 0.01 0.00 -1.81 0.00 0.00 61.98 59.21 1f1x s VAL 311 Cb -0.18 -1.38 -0.04 0.00 0.56 0.00 0.00 36.38 35.35 1f1x s VAL 311 CO 0.57 -0.40 0.31 -0.76 -0.31 0.00 0.00 175.10 174.51 1f1x s LEU 312 N -2.27 4.31 0.00 1.32 1.43 0.02 -0.49 118.68 123.00 1f1x s LEU 312 Ca 0.05 0.25 -0.02 0.00 -1.03 0.00 0.00 54.13 53.38 1f1x s LEU 312 Cb -0.06 -2.99 0.12 0.00 0.03 0.00 0.00 46.19 43.29 1f1x s LEU 312 CO 0.02 0.04 0.80 -0.90 0.23 0.00 0.00 176.35 176.54 1f1x n ASP 313 N -0.48 0.86 0.00 2.29 5.68 0.41 -4.37 116.55 120.94 1f1x n ASP 313 Ca -0.06 -1.77 0.07 0.00 -0.50 0.00 0.00 54.79 52.52 1f1x n ASP 313 Cb 0.54 -0.54 0.29 0.00 -1.14 0.00 0.00 41.12 40.27 1f1x n ASP 313 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1f1x n LEU 314 N 0.00 0.00 -0.29 -2.12 4.77 -1.26 -1.62 117.00 116.48 1f1x n LEU 314 Ca 0.12 0.49 0.12 0.00 -0.03 0.00 0.00 56.01 56.72 1f1x n LEU 314 Cb 0.44 -0.49 0.22 0.00 -2.33 0.00 0.00 43.42 41.26 1f1x n LEU 314 CO 0.30 -0.26 0.49 0.47 -1.33 0.00 0.00 177.39 177.06 1f1x n ASP 315 N -1.49 1.29 0.00 -1.43 8.00 -1.26 -4.95 116.55 116.71 1f1x n ASP 315 Ca 0.03 -1.04 0.00 0.00 0.71 0.00 0.00 54.79 54.50 1f1x n ASP 315 Cb 0.16 0.30 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 1f1x n ASP 315 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f1x n GLY 316 N 1.39 0.72 3.85 0.44 0.00 -0.64 -5.07 105.19 105.88 1f1x n GLY 316 Ca 0.10 -0.12 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 1f1x n GLY 316 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1f1x s ASN 317 N -2.11 6.03 0.19 1.61 0.01 -1.26 -4.82 114.94 114.59 1f1x s ASN 317 Ca 0.00 0.22 -0.32 0.00 -0.71 0.00 0.00 52.86 52.06 1f1x s ASN 317 Cb 0.00 -1.81 -0.11 0.00 0.41 0.00 0.00 41.25 39.74 1f1x s ASN 317 CO 0.00 0.24 1.73 -0.69 -1.51 0.00 0.00 177.10 176.87 1f1x s VAL 318 N -1.31 2.18 0.22 1.60 1.01 -1.26 -0.45 120.40 122.39 1f1x s VAL 318 Ca 0.27 0.07 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 1f1x s VAL 318 Cb -0.12 -3.04 -0.10 0.00 0.00 0.00 0.00 36.38 33.12 1f1x s VAL 318 CO 0.19 0.00 1.42 -1.10 0.00 0.00 0.00 175.10 175.61 1f1x s GLN 319 N 1.45 4.30 0.16 2.72 -1.52 0.35 -4.80 119.66 122.31 1f1x s GLN 319 Ca 0.75 2.23 -0.34 0.00 -1.95 0.00 0.00 55.36 56.06 1f1x s GLN 319 Cb -0.48 -3.14 -0.14 0.00 -0.22 0.00 0.00 33.01 29.02 1f1x s GLN 319 CO 0.33 -0.39 1.53 -1.91 -0.25 0.00 0.00 175.29 174.59 1f1x n GLU 320 N 2.61 2.01 -3.21 2.91 2.13 -1.26 -4.79 120.64 121.04 1f1x n GLU 320 Ca 0.07 0.72 -0.40 0.00 0.66 0.00 0.00 57.16 58.21 1f1x n GLU 320 Cb 0.41 -2.46 -0.07 0.00 0.27 0.00 0.00 31.44 29.58 1f1x n GLU 320 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1f1x s ILE 321 N 0.75 5.04 -2.51 6.31 1.01 -1.26 -4.33 121.20 126.21 1f1x s ILE 321 Ca 0.78 0.85 0.28 0.00 0.00 0.00 0.00 60.65 62.56 1f1x s ILE 321 Cb -0.71 -3.87 0.55 0.00 0.01 0.00 0.00 42.46 38.43 1f1x s ILE 321 CO 0.40 0.02 1.74 -0.38 0.00 0.00 0.00 174.94 176.72