#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gff s TYR 11 N 0.00 2.17 -0.07 -1.84 -0.85 -1.26 -4.30 117.35 111.20 3gff s TYR 11 Ca 0.00 -0.86 -0.01 0.00 -0.52 0.00 0.00 57.07 55.68 3gff s TYR 11 Cb 0.00 -1.48 -0.03 0.00 0.38 0.00 0.00 41.96 40.83 3gff s TYR 11 CO 0.00 0.17 -0.01 -0.65 -1.52 0.00 0.00 175.55 173.55 3gff s GLN 12 N -3.82 2.92 -0.30 -3.49 -0.21 0.01 -4.95 119.66 109.83 3gff s GLN 12 Ca 0.34 -0.46 -0.08 0.00 0.02 0.00 0.00 55.36 55.19 3gff s GLN 12 Cb 0.09 -2.75 -0.01 0.00 1.00 0.00 0.00 33.01 31.34 3gff s GLN 12 CO 0.16 0.69 0.12 0.45 -2.12 0.00 0.00 175.29 174.58 3gff s SER 13 N -0.98 5.35 0.25 5.90 0.15 -1.26 -1.45 113.70 121.65 3gff s SER 13 Ca 0.14 -0.53 0.07 0.00 0.70 0.00 0.00 55.95 56.34 3gff s SER 13 Cb -0.11 -1.95 -0.05 0.00 -1.71 0.00 0.00 66.02 62.19 3gff s SER 13 CO 0.03 -0.17 -0.10 -0.54 1.20 0.00 0.00 173.24 173.67 3gff s LYS 14 N 1.58 1.46 0.03 5.44 1.02 0.15 -5.00 119.74 124.41 3gff s LYS 14 Ca 0.04 -1.70 0.03 0.00 0.02 0.00 0.00 55.97 54.36 3gff s LYS 14 Cb -0.17 -1.14 -0.02 0.00 -0.52 0.00 0.00 37.83 35.99 3gff s LYS 14 CO 0.05 0.10 -0.10 1.03 -0.92 0.00 0.00 175.35 175.51 3gff s ARG 15 N -3.69 0.67 -0.04 1.68 0.52 -1.26 -0.40 118.95 116.43 3gff s ARG 15 Ca 0.27 -0.60 -0.01 0.00 -0.52 0.00 0.00 55.73 54.87 3gff s ARG 15 Cb 0.02 -0.59 0.03 0.00 0.52 0.00 0.00 34.95 34.93 3gff s ARG 15 CO 0.10 0.14 0.07 -1.17 0.02 0.00 0.00 175.30 174.46 3gff s LEU 16 N -0.99 0.82 -0.38 2.53 0.20 0.17 -4.98 118.68 116.04 3gff s LEU 16 Ca -0.02 0.13 -0.26 0.00 0.69 0.00 0.00 54.13 54.67 3gff s LEU 16 Cb -0.07 0.06 0.02 0.00 -0.43 0.00 0.00 46.19 45.77 3gff s LEU 16 CO 0.01 -0.15 0.95 -0.70 -0.29 0.00 0.00 176.35 176.16 3gff s GLU 17 N 1.28 3.81 -0.36 1.98 2.56 -1.26 0.18 118.70 126.89 3gff s GLU 17 Ca -0.07 0.56 -0.25 0.00 0.00 0.00 0.00 54.97 55.22 3gff s GLU 17 Cb -0.12 -3.82 0.01 0.00 2.00 0.00 0.00 34.13 32.20 3gff s GLU 17 CO -0.04 -1.00 0.86 0.45 -0.56 0.00 0.00 175.26 174.97 3gff s SER 18 N 1.94 6.63 0.21 -1.70 0.15 -0.08 -4.90 113.70 115.95 3gff s SER 18 Ca 0.39 0.50 0.00 0.00 0.70 0.00 0.00 55.95 57.54 3gff s SER 18 Cb -0.11 -2.43 0.16 0.00 -1.71 0.00 0.00 66.02 61.92 3gff s SER 18 CO 0.20 -0.79 1.52 0.03 1.20 0.00 0.00 173.24 175.40 3gff h ARG 19 N 8.45 0.41 0.03 5.44 3.08 -1.94 -0.64 114.38 129.21 3gff h ARG 19 Ca -0.24 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.53 3gff h ARG 19 Cb 1.09 0.04 0.00 0.00 0.08 0.00 0.00 29.97 31.18 3gff h ARG 19 CO 0.95 0.89 -0.01 -0.07 -1.07 0.00 0.00 179.97 180.65 3gff h LEU 20 N 0.31 -0.03 -0.20 3.04 3.38 -1.95 -3.24 115.31 116.60 3gff h LEU 20 Ca -0.00 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3gff h LEU 20 Cb 1.13 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.89 3gff h LEU 20 CO 0.10 0.31 -0.30 0.18 0.09 0.00 0.00 178.44 178.83 3gff n LEU 21 N -4.95 0.61 -3.24 1.67 4.77 -1.25 -4.97 117.00 109.65 3gff n LEU 21 Ca -0.08 -0.03 -0.18 0.00 -0.03 0.00 0.00 56.01 55.69 3gff n LEU 21 Cb 0.19 -0.22 0.08 0.00 -2.33 0.00 0.00 43.42 41.14 3gff n LEU 21 CO 0.33 0.13 0.15 0.29 -1.33 0.00 0.00 177.39 176.95 3gff n LYS 22 N -1.12 -6.47 -3.63 3.23 4.76 -0.28 -4.99 118.16 109.66 3gff n LYS 22 Ca 0.10 0.77 -0.04 0.00 -2.87 0.00 0.00 58.31 56.26 3gff n LYS 22 Cb 0.33 -5.57 -0.01 0.00 -1.84 0.00 0.00 35.03 27.94 3gff n LYS 22 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 3gff s GLU 23 N -5.58 0.82 0.16 1.97 -1.05 -1.00 -5.01 118.70 109.01 3gff s GLU 23 Ca 0.19 -0.40 -0.30 0.00 -0.15 0.00 0.00 54.97 54.32 3gff s GLU 23 Cb -0.08 0.31 -0.07 0.00 -0.44 0.00 0.00 34.13 33.85 3gff s GLU 23 CO 0.66 -0.37 1.03 0.99 0.95 0.00 0.00 175.26 178.52 3gff s THR 24 N -2.96 4.13 -0.14 1.83 2.01 -1.26 -0.91 115.64 118.34 3gff s THR 24 Ca 0.10 1.84 0.01 0.00 0.31 0.00 0.00 61.69 63.95 3gff s THR 24 Cb -0.00 -4.17 -0.00 0.00 0.01 0.00 0.00 72.50 68.33 3gff s THR 24 CO -0.03 0.32 -0.18 -0.13 -0.69 0.00 0.00 174.62 173.91 3gff s ARG 25 N -0.33 3.19 0.03 4.92 1.81 0.13 -4.91 118.95 123.78 3gff s ARG 25 Ca 0.47 -0.78 0.01 0.00 -1.72 0.00 0.00 55.73 53.72 3gff s ARG 25 Cb -0.27 -2.53 -0.04 0.00 -0.45 0.00 0.00 34.95 31.66 3gff s ARG 25 CO 0.33 0.09 0.08 -1.21 -0.68 0.00 0.00 175.30 173.91 3gff s GLU 26 N 0.63 3.01 0.21 3.54 2.02 -1.26 0.42 118.70 127.26 3gff s GLU 26 Ca -0.09 -0.56 -0.15 0.00 0.02 0.00 0.00 54.97 54.18 3gff s GLU 26 Cb -0.16 -2.81 0.01 0.00 0.10 0.00 0.00 34.13 31.27 3gff s GLU 26 CO 0.03 0.62 0.49 1.52 0.02 0.00 0.00 175.26 177.93 3gff s TYR 27 N -1.27 0.10 -0.03 1.61 1.13 0.46 -2.28 117.35 117.06 3gff s TYR 27 Ca 0.26 -0.46 0.05 0.00 -1.41 0.00 0.00 57.07 55.50 3gff s TYR 27 Cb -0.12 0.29 -0.01 0.00 -1.10 0.00 0.00 41.96 41.02 3gff s TYR 27 CO 0.17 -0.94 -0.17 0.14 -2.51 0.00 0.00 175.55 172.24 3gff s VAL 28 N -3.93 1.40 -0.13 -3.49 -7.23 -0.45 0.30 120.40 106.86 3gff s VAL 28 Ca 0.14 -0.72 0.02 0.00 -1.81 0.00 0.00 61.98 59.61 3gff s VAL 28 Cb -0.01 -1.19 0.00 0.00 0.56 0.00 0.00 36.38 35.74 3gff s VAL 28 CO 0.02 0.40 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.39 3gff s ILE 29 N -0.14 2.36 -0.26 -0.62 1.01 -0.53 0.18 121.20 123.20 3gff s ILE 29 Ca 0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 60.65 59.71 3gff s ILE 29 Cb -0.10 -1.96 -0.00 0.00 0.01 0.00 0.00 42.46 40.42 3gff s ILE 29 CO 0.01 0.54 0.02 0.00 0.00 0.00 0.00 174.94 175.51 3gff s ALA 30 N 0.62 2.96 0.18 9.38 0.00 0.10 -0.81 121.76 134.20 3gff s ALA 30 Ca -0.10 -1.31 -0.18 0.00 0.00 0.00 0.00 51.96 50.37 3gff s ALA 30 Cb -0.16 -1.95 -0.08 0.00 0.00 0.00 0.00 23.12 20.93 3gff s ALA 30 CO 0.03 -0.68 0.66 -0.51 0.00 0.00 0.00 175.76 175.25 3gff s LEU 31 N 1.49 4.36 0.51 0.00 1.43 -1.26 -0.53 118.68 124.69 3gff s LEU 31 Ca 0.04 1.30 -0.21 0.00 -1.03 0.00 0.00 54.13 54.23 3gff s LEU 31 Cb -0.16 -3.42 -0.06 0.00 0.03 0.00 0.00 46.19 42.58 3gff s LEU 31 CO 0.00 0.08 1.14 -2.16 0.23 0.00 0.00 176.35 175.64 3gff s PRO 32 N -1.88 3.50 0.49 1.29 0.04 -1.21 -4.95 135.00 132.28 3gff s PRO 32 Ca 0.40 1.66 -0.24 0.00 0.04 0.00 0.00 61.00 62.87 3gff s PRO 32 Cb -0.16 -2.15 -0.07 0.00 0.04 0.00 0.00 34.50 32.16 3gff s PRO 32 CO 0.20 -0.74 1.39 -1.83 0.04 0.00 0.00 177.00 176.06 3gff s GLU 33 N -3.08 3.49 0.00 4.56 -1.05 -1.26 -1.78 118.70 119.58 3gff s GLU 33 Ca 0.69 2.32 0.00 0.00 -0.15 0.00 0.00 54.97 57.83 3gff s GLU 33 Cb -0.25 -2.50 0.00 0.00 -0.44 0.00 0.00 34.13 30.94 3gff s GLU 33 CO 0.29 -0.94 0.00 0.41 0.95 0.00 0.00 175.26 175.97 3gff n GLY 34 N 0.64 1.37 0.32 -3.83 0.00 -1.26 -4.96 105.19 97.47 3gff n GLY 34 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 3gff n GLY 34 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3gff h TYR 35 N 0.00 -0.81 0.00 1.61 3.20 -1.72 -0.72 116.97 118.53 3gff h TYR 35 Ca 0.00 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.93 3gff h TYR 35 Cb 0.00 0.42 0.00 0.00 1.54 0.00 0.00 36.73 38.69 3gff h TYR 35 CO 0.00 -0.36 0.00 0.00 -1.64 0.00 0.00 178.16 176.16 3gff n ALA 36 N -2.99 1.57 0.86 1.82 0.00 -1.26 -3.58 120.51 116.92 3gff n ALA 36 Ca 0.02 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.52 3gff n ALA 36 Cb 0.33 -1.19 0.30 0.00 0.00 0.00 0.00 19.45 18.90 3gff n ALA 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3gff n GLN 37 N -1.45 2.04 -2.64 0.00 6.02 -0.28 -4.98 117.38 116.09 3gff n GLN 37 Ca 0.03 -1.56 -0.03 0.00 -0.01 0.00 0.00 57.00 55.43 3gff n GLN 37 Cb 0.12 -1.43 0.01 0.00 1.02 0.00 0.00 30.24 29.96 3gff n GLN 37 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 3gff n SER 38 N 0.79 -1.07 -1.16 1.08 3.41 -1.24 -5.03 113.62 110.40 3gff n SER 38 Ca 0.17 -1.65 0.08 0.00 -0.26 0.00 0.00 58.87 57.21 3gff n SER 38 Cb 0.44 1.76 0.28 0.00 -0.26 0.00 0.00 64.21 66.43 3gff n SER 38 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3gff n LEU 39 N 0.00 4.04 -4.66 1.04 4.77 -1.26 -5.01 117.00 115.92 3gff n LEU 39 Ca -0.03 -2.44 -0.46 0.00 -0.03 0.00 0.00 56.01 53.05 3gff n LEU 39 Cb 0.32 -0.47 -0.04 0.00 -2.33 0.00 0.00 43.42 40.90 3gff n LEU 39 CO 0.13 0.76 1.07 1.21 -1.33 0.00 0.00 177.39 179.23 3gff n GLU 40 N 0.59 1.99 -3.84 3.23 2.13 -1.26 -4.98 120.64 118.49 3gff n GLU 40 Ca 0.21 0.71 -0.32 0.00 0.66 0.00 0.00 57.16 58.42 3gff n GLU 40 Cb 0.76 -2.41 -0.05 0.00 0.27 0.00 0.00 31.44 30.01 3gff n GLU 40 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3gff s ALA 41 N 0.38 3.93 0.23 4.31 0.00 -1.26 -4.86 121.76 124.49 3gff s ALA 41 Ca 0.74 -0.72 0.09 0.00 0.00 0.00 0.00 51.96 52.08 3gff s ALA 41 Cb -0.69 -1.94 -0.05 0.00 0.00 0.00 0.00 23.12 20.44 3gff s ALA 41 CO 0.45 0.74 -0.17 0.71 0.00 0.00 0.00 175.76 177.49 3gff s TYR 42 N -1.44 1.94 0.79 0.00 2.02 -0.66 -4.60 117.35 115.39 3gff s TYR 42 Ca 0.32 -0.47 -0.11 0.00 -0.37 0.00 0.00 57.07 56.44 3gff s TYR 42 Cb -0.13 -0.88 0.07 0.00 -0.40 0.00 0.00 41.96 40.62 3gff s TYR 42 CO 0.22 0.49 1.09 -1.25 -1.57 0.00 0.00 175.55 174.54 3gff s PRO 43 N -3.51 2.12 -0.12 -1.71 0.05 -1.26 -0.59 135.00 129.99 3gff s PRO 43 Ca 0.25 0.76 0.02 0.00 0.05 0.00 0.00 61.00 62.08 3gff s PRO 43 Cb -0.03 -1.91 0.01 0.00 0.05 0.00 0.00 34.50 32.62 3gff s PRO 43 CO 0.10 -1.62 -0.18 0.08 0.05 0.00 0.00 177.00 175.42 3gff s VAL 44 N -3.09 1.73 -0.40 -0.36 1.01 -0.63 -0.80 120.40 117.86 3gff s VAL 44 Ca 0.61 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.69 3gff s VAL 44 Cb -0.15 -1.55 0.05 0.00 0.00 0.00 0.00 36.38 34.73 3gff s VAL 44 CO 0.55 0.49 0.24 -0.69 0.00 0.00 0.00 175.10 175.69 3gff s VAL 45 N 0.88 4.48 -0.18 2.92 1.01 -0.20 -0.73 120.40 128.57 3gff s VAL 45 Ca -0.08 -1.10 -0.26 0.00 0.00 0.00 0.00 61.98 60.54 3gff s VAL 45 Cb -0.15 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 3gff s VAL 45 CO -0.01 -0.38 0.87 -0.31 0.00 0.00 0.00 175.10 175.27 3gff s TYR 46 N 1.51 3.40 -0.23 5.22 1.51 0.54 -1.51 117.35 127.79 3gff s TYR 46 Ca 0.02 1.28 -0.06 0.00 -1.01 0.00 0.00 57.07 57.30 3gff s TYR 46 Cb -0.21 -3.06 -0.02 0.00 -0.11 0.00 0.00 41.96 38.55 3gff s TYR 46 CO 0.05 -0.29 0.03 -0.51 -1.11 0.00 0.00 175.55 173.72 3gff s LEU 47 N 2.37 3.32 0.72 -1.29 1.43 0.11 -0.83 118.68 124.50 3gff s LEU 47 Ca 0.39 -0.22 -0.09 0.00 -1.03 0.00 0.00 54.13 53.18 3gff s LEU 47 Cb -0.16 -1.87 0.05 0.00 0.03 0.00 0.00 46.19 44.24 3gff s LEU 47 CO 0.11 0.01 1.06 -0.76 0.23 0.00 0.00 176.35 177.01 3gff s LEU 48 N 1.33 2.79 -1.46 1.79 1.43 -0.57 -0.96 118.68 123.02 3gff s LEU 48 Ca 0.05 0.70 -0.09 0.00 -1.03 0.00 0.00 54.13 53.76 3gff s LEU 48 Cb -0.15 -3.35 0.06 0.00 0.03 0.00 0.00 46.19 42.78 3gff s LEU 48 CO 0.02 -1.58 0.87 0.47 0.23 0.00 0.00 176.35 176.36 3gff n ASP 49 N -3.01 -3.51 -0.21 2.29 8.00 -1.23 -4.71 116.55 114.17 3gff n ASP 49 Ca 0.07 -0.80 -0.00 0.00 0.71 0.00 0.00 54.79 54.77 3gff n ASP 49 Cb 0.60 -3.89 0.08 0.00 -0.02 0.00 0.00 41.12 37.89 3gff n ASP 49 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3gff h GLY 50 N -2.01 0.52 0.22 0.44 0.00 -1.39 0.29 103.07 101.14 3gff h GLY 50 Ca -0.59 0.17 0.15 0.00 0.00 0.00 0.00 47.33 47.06 3gff h GLY 50 CO 0.64 -0.23 0.49 1.05 0.00 0.00 0.00 176.54 178.48 3gff h GLU 51 N 0.03 0.66 0.08 4.80 9.09 -1.89 -1.20 114.58 126.14 3gff h GLU 51 Ca 0.31 -0.04 -0.28 0.00 0.05 0.00 0.00 59.36 59.40 3gff h GLU 51 Cb 0.49 -0.15 -0.02 0.00 -1.65 0.00 0.00 28.75 27.42 3gff h GLU 51 CO -0.61 0.44 -1.50 -0.44 0.05 0.00 0.00 179.01 176.95 3gff h ASP 52 N 0.68 0.26 0.00 3.06 3.32 -1.70 -3.43 116.42 118.60 3gff h ASP 52 Ca 0.49 -0.77 0.00 0.00 0.02 0.00 0.00 57.03 56.77 3gff h ASP 52 Cb 0.69 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.16 3gff h ASP 52 CO -0.36 1.63 -1.03 0.00 -1.72 0.00 0.00 179.24 177.76 3gff n GLN 53 N -3.98 0.59 -0.15 3.56 1.13 0.93 -4.67 117.38 114.78 3gff n GLN 53 Ca -0.29 -0.02 -0.10 0.00 -1.94 0.00 0.00 57.00 54.65 3gff n GLN 53 Cb 0.86 -1.42 -0.01 0.00 0.11 0.00 0.00 30.24 29.78 3gff n GLN 53 CO 0.00 0.00 0.00 0.35 -1.44 0.00 0.00 177.06 175.97 3gff h PHE 54 N 0.00 0.79 0.22 1.08 3.57 -1.38 -3.30 116.94 117.92 3gff h PHE 54 Ca 0.00 -0.12 -0.00 0.00 3.53 0.00 0.00 57.97 61.38 3gff h PHE 54 Cb 0.51 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.03 3gff h PHE 54 CO 0.00 0.77 -0.16 -0.44 -2.23 0.00 0.00 178.31 176.25 3gff h ASP 55 N 0.58 -0.41 0.00 0.41 5.19 -1.83 0.34 116.42 120.71 3gff h ASP 55 Ca 0.13 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.57 3gff h ASP 55 Cb 0.42 0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.07 3gff h ASP 55 CO 0.01 -0.25 0.00 0.00 -3.12 0.00 0.00 179.24 175.88 3gff n HIS 56 N -5.28 0.00 0.00 4.55 1.44 -1.24 -1.64 115.22 113.05 3gff n HIS 56 Ca -0.09 -0.09 0.00 0.00 -2.01 0.00 0.00 57.72 55.54 3gff n HIS 56 Cb 0.20 -0.10 0.00 0.00 0.12 0.00 0.00 29.99 30.21 3gff n HIS 56 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 3gff n ALA 58 N 0.33 0.00 -0.19 1.59 0.00 0.12 -1.71 120.51 120.65 3gff n ALA 58 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3gff n ALA 58 Cb 0.20 0.00 0.25 0.00 0.00 0.00 0.00 19.45 19.90 3gff n ALA 58 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3gff h SER 59 N 0.00 0.82 -0.05 0.00 0.87 -1.49 -0.95 113.55 112.75 3gff h SER 59 Ca 0.00 -0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.48 3gff h SER 59 Cb 0.00 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 61.75 3gff h SER 59 CO 0.00 0.62 -0.11 0.25 -0.53 0.00 0.00 176.83 177.06 3gff h LEU 60 N 0.95 0.19 -0.83 2.23 5.85 -1.58 -2.15 115.31 119.96 3gff h LEU 60 Ca 0.25 -0.57 0.10 0.00 0.84 0.00 0.00 57.88 58.49 3gff h LEU 60 Cb -0.05 -0.05 -0.08 0.00 0.37 0.00 0.00 40.66 40.85 3gff h LEU 60 CO -0.05 0.73 0.47 -0.07 -0.34 0.00 0.00 178.44 179.19 3gff h LEU 61 N -0.34 0.67 -0.38 2.25 3.38 -1.77 -0.04 115.31 119.07 3gff h LEU 61 Ca 0.00 0.05 -0.17 0.00 0.09 0.00 0.00 57.88 57.85 3gff h LEU 61 Cb 0.70 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 3gff h LEU 61 CO 0.02 0.38 -0.50 1.56 0.09 0.00 0.00 178.44 179.99 3gff h GLN 62 N 0.78 0.82 -0.71 1.13 4.20 -1.19 -2.91 115.11 117.23 3gff h GLN 62 Ca 0.41 -0.49 0.01 0.00 0.06 0.00 0.00 58.65 58.63 3gff h GLN 62 Cb 0.39 0.05 -0.04 0.00 0.30 0.00 0.00 27.48 28.18 3gff h GLN 62 CO -0.26 1.12 0.47 0.35 -0.67 0.00 0.00 178.83 179.85 3gff h PHE 63 N 0.64 0.90 0.00 2.96 3.57 -0.75 -2.54 116.94 121.72 3gff h PHE 63 Ca 0.03 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 3gff h PHE 63 Cb 1.09 -0.30 -0.00 0.00 2.79 0.00 0.00 35.95 39.52 3gff h PHE 63 CO 0.06 0.57 -0.16 -0.07 -2.23 0.00 0.00 178.31 176.48 3gff h LEU 64 N 0.97 0.00 -1.96 0.59 3.38 -0.98 -3.09 115.31 114.21 3gff h LEU 64 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3gff h LEU 64 Cb -0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.64 3gff h LEU 64 CO -0.06 0.16 0.00 -1.54 0.09 0.00 0.00 178.44 177.09 3gff n SER 65 N -3.51 2.97 -4.99 -0.43 3.41 -1.00 -0.51 113.62 109.55 3gff n SER 65 Ca -0.01 -1.94 -0.19 0.00 -0.26 0.00 0.00 58.87 56.47 3gff n SER 65 Cb 0.31 -0.05 0.01 0.00 -0.26 0.00 0.00 64.21 64.22 3gff n SER 65 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gff s GLN 66 N -1.77 2.95 0.17 4.33 -2.07 -0.99 -4.69 119.66 117.60 3gff s GLN 66 Ca 0.28 -1.04 0.00 0.00 -1.82 0.00 0.00 55.36 52.78 3gff s GLN 66 Cb 0.19 -2.75 0.00 0.00 -1.09 0.00 0.00 33.01 29.36 3gff s GLN 66 CO 0.28 -0.16 0.00 0.41 -1.32 0.00 0.00 175.29 174.50 3gff n GLY 67 N -1.82 -2.31 1.42 2.60 0.00 -1.26 -4.13 105.19 99.68 3gff n GLY 67 Ca 0.04 -1.93 -0.07 0.00 0.00 0.00 0.00 46.02 44.05 3gff n GLY 67 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3gff n THR 68 N -0.06 1.77 -3.61 2.61 -2.24 -1.26 -5.08 114.28 106.41 3gff n THR 68 Ca 0.00 -0.66 -0.09 0.00 -2.27 0.00 0.00 64.05 61.03 3gff n THR 68 Cb 0.00 -0.93 -0.06 0.00 -2.10 0.00 0.00 70.33 67.23 3gff n THR 68 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3gff s PRO 70 N -0.98 0.51 0.09 -0.78 0.04 -1.26 -4.92 135.00 127.70 3gff s PRO 70 Ca 0.17 0.37 0.21 0.00 0.04 0.00 0.00 61.00 61.80 3gff s PRO 70 Cb 0.14 0.24 -0.14 0.00 0.04 0.00 0.00 34.50 34.79 3gff s PRO 70 CO 0.03 -0.11 0.80 1.04 0.04 0.00 0.00 177.00 178.80 3gff n GLN 71 N 1.54 0.63 -4.13 4.56 1.13 0.34 -4.88 117.38 116.57 3gff n GLN 71 Ca -0.11 0.03 -0.09 0.00 -1.94 0.00 0.00 57.00 54.89 3gff n GLN 71 Cb 0.57 -1.72 -0.10 0.00 0.11 0.00 0.00 30.24 29.10 3gff n GLN 71 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 3gff s ILE 72 N -3.32 0.31 0.93 5.09 -4.36 -1.10 -4.78 121.20 113.96 3gff s ILE 72 Ca -0.04 -1.87 -0.12 0.00 -0.26 0.00 0.00 60.65 58.36 3gff s ILE 72 Cb 0.11 -1.74 0.15 0.00 1.25 0.00 0.00 42.46 42.23 3gff s ILE 72 CO 0.83 -0.79 1.11 -2.16 0.24 0.00 0.00 174.94 174.17 3gff s PRO 73 N -3.94 1.02 0.30 0.37 0.04 -1.26 -4.30 135.00 127.24 3gff s PRO 73 Ca 0.14 0.46 -0.29 0.00 0.04 0.00 0.00 61.00 61.35 3gff s PRO 73 Cb 0.07 -1.81 -0.10 0.00 0.04 0.00 0.00 34.50 32.70 3gff s PRO 73 CO -0.05 -2.32 1.42 0.15 0.04 0.00 0.00 177.00 176.24 3gff s LYS 74 N -5.12 4.26 0.07 4.56 -0.14 -1.26 -4.75 119.74 117.35 3gff s LYS 74 Ca 0.64 2.34 0.00 0.00 -1.36 0.00 0.00 55.97 57.59 3gff s LYS 74 Cb -0.16 -3.07 -0.04 0.00 -1.68 0.00 0.00 37.83 32.88 3gff s LYS 74 CO 0.55 -0.38 -0.04 0.14 -0.76 0.00 0.00 175.35 174.86 3gff s VAL 75 N -0.54 0.39 -0.07 3.17 -7.23 -1.26 -4.40 120.40 110.45 3gff s VAL 75 Ca 0.55 -1.79 -0.15 0.00 -1.81 0.00 0.00 61.98 58.78 3gff s VAL 75 Cb -0.42 -1.49 -0.05 0.00 0.56 0.00 0.00 36.38 34.98 3gff s VAL 75 CO 0.50 -0.91 0.38 -0.63 -0.31 0.00 0.00 175.10 174.13 3gff s ILE 76 N -3.62 5.16 -0.14 -0.62 1.01 0.02 -3.32 121.20 119.67 3gff s ILE 76 Ca 0.07 0.76 -0.01 0.00 0.00 0.00 0.00 60.65 61.48 3gff s ILE 76 Cb 0.06 -3.70 -0.01 0.00 0.01 0.00 0.00 42.46 38.81 3gff s ILE 76 CO -0.07 0.47 -0.12 -0.63 0.00 0.00 0.00 174.94 174.59 3gff s ILE 77 N -0.28 3.13 -0.18 2.92 1.01 0.31 -1.04 121.20 127.08 3gff s ILE 77 Ca 0.22 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 60.25 3gff s ILE 77 Cb -0.15 -2.33 0.01 0.00 0.01 0.00 0.00 42.46 40.00 3gff s ILE 77 CO 0.10 0.51 -0.18 -0.69 0.00 0.00 0.00 174.94 174.68 3gff s VAL 78 N 0.49 2.26 -0.23 2.92 1.01 -0.57 0.03 120.40 126.31 3gff s VAL 78 Ca -0.08 -0.88 -0.09 0.00 0.00 0.00 0.00 61.98 60.93 3gff s VAL 78 Cb -0.16 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 3gff s VAL 78 CO 0.04 0.53 0.11 -0.83 0.00 0.00 0.00 175.10 174.95 3gff s GLY 79 N 1.21 1.89 -0.32 4.51 0.00 0.13 0.04 107.32 114.78 3gff s GLY 79 Ca 0.03 -0.94 -0.13 0.00 0.00 0.00 0.00 44.72 43.68 3gff s GLY 79 CO -0.09 0.37 0.26 -0.42 0.00 0.00 0.00 173.10 173.22 3gff s ILE 80 N 1.11 5.26 0.33 0.90 1.01 -0.13 -1.34 121.20 128.33 3gff s ILE 80 Ca 0.06 0.00 -0.24 0.00 0.00 0.00 0.00 60.65 60.47 3gff s ILE 80 Cb -0.14 -3.68 -0.10 0.00 0.01 0.00 0.00 42.46 38.55 3gff s ILE 80 CO 0.04 0.06 0.91 -1.00 0.00 0.00 0.00 174.94 174.95 3gff s HIS 81 N 1.82 3.62 0.30 3.97 3.76 -0.97 -1.44 115.29 126.35 3gff s HIS 81 Ca 0.08 1.69 -0.13 0.00 -0.15 0.00 0.00 55.06 56.55 3gff s HIS 81 Cb -0.17 -2.86 -0.08 0.00 1.11 0.00 0.00 32.58 30.58 3gff s HIS 81 CO 0.11 0.18 0.68 -0.80 -0.85 0.00 0.00 174.74 174.05 3gff s ASN 82 N -1.72 6.72 0.00 1.40 0.01 -1.26 -4.69 114.94 115.39 3gff s ASN 82 Ca 0.51 1.16 0.00 0.00 -0.71 0.00 0.00 52.86 53.83 3gff s ASN 82 Cb -0.17 -2.33 0.00 0.00 0.41 0.00 0.00 41.25 39.17 3gff s ASN 82 CO 0.22 -0.17 0.00 0.35 -1.51 0.00 0.00 177.10 175.98 3gff n THR 83 N -0.33 0.00 -3.77 1.60 -2.24 -1.26 -4.98 114.28 103.30 3gff n THR 83 Ca 0.03 0.01 -0.35 0.00 -2.27 0.00 0.00 64.05 61.47 3gff n THR 83 Cb 0.53 -0.67 -0.11 0.00 -2.10 0.00 0.00 70.33 67.98 3gff n THR 83 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3gff s ASN 84 N -0.17 5.06 0.00 3.42 3.84 -1.26 -5.10 114.94 120.73 3gff s ASN 84 Ca 0.00 -2.79 0.00 0.00 0.21 0.00 0.00 52.86 50.28 3gff s ASN 84 Cb 0.00 -1.81 0.00 0.00 -0.55 0.00 0.00 41.25 38.89 3gff s ASN 84 CO 0.00 -0.36 0.50 -1.14 -2.79 0.00 0.00 177.10 173.31 3gff n ARG 85 N 3.54 0.42 0.00 0.43 0.63 -1.26 -1.66 116.66 118.75 3gff n ARG 85 Ca 0.06 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.99 3gff n ARG 85 Cb 0.37 -1.29 0.00 0.00 0.45 0.00 0.00 32.46 31.99 3gff n ARG 85 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 3gff n ARG 87 N 1.00 0.00 0.19 -0.14 0.63 -1.25 -0.38 116.66 116.71 3gff n ARG 87 Ca 0.00 0.00 0.06 0.00 -0.92 0.00 0.00 57.85 56.99 3gff n ARG 87 Cb 0.21 0.00 0.33 0.00 0.45 0.00 0.00 32.46 33.45 3gff n ARG 87 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 3gff h ASP 88 N 0.00 0.00 -0.02 6.15 3.32 -1.56 0.52 116.42 124.83 3gff h ASP 88 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3gff h ASP 88 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3gff h ASP 88 CO 0.00 0.36 -0.17 -1.22 -1.72 0.00 0.00 179.24 176.49 3gff n TYR 89 N -3.48 0.00 -4.56 4.55 4.02 0.49 -3.57 117.16 114.60 3gff n TYR 89 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.56 3gff n TYR 89 Cb 0.51 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.70 3gff n TYR 89 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 176.86 176.80 3gff s THR 90 N -2.05 3.56 -0.63 -0.72 -4.23 -1.24 -4.17 115.64 106.16 3gff s THR 90 Ca 0.23 -0.48 0.25 0.00 -1.18 0.00 0.00 61.69 60.50 3gff s THR 90 Cb 0.18 -2.53 0.17 0.00 1.34 0.00 0.00 72.50 71.66 3gff s THR 90 CO 0.38 0.51 1.52 1.55 -0.54 0.00 0.00 174.62 178.04 3gff h PRO 91 N 6.59 0.00 -4.86 3.99 0.13 -1.88 -1.01 132.00 134.96 3gff h PRO 91 Ca -0.30 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.52 3gff h PRO 91 Cb 1.20 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 3gff h PRO 91 CO 0.59 0.00 -0.67 0.95 -0.23 0.00 0.00 178.00 178.65 3gff s THR 92 N -3.16 0.77 -0.22 1.56 -4.23 -1.26 -4.70 115.64 104.40 3gff s THR 92 Ca 0.08 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.47 3gff s THR 92 Cb 0.12 -2.13 -0.05 0.00 1.34 0.00 0.00 72.50 71.78 3gff s THR 92 CO 0.67 -0.47 0.23 -2.28 -0.54 0.00 0.00 174.62 172.22 3gff s HIS 93 N -3.60 3.34 -0.01 3.99 2.46 -1.26 -2.21 115.29 118.01 3gff s HIS 93 Ca 0.24 0.35 -0.17 0.00 0.47 0.00 0.00 55.06 55.95 3gff s HIS 93 Cb 0.06 -2.33 0.03 0.00 -0.13 0.00 0.00 32.58 30.21 3gff s HIS 93 CO 0.04 0.07 0.37 -0.08 -2.47 0.00 0.00 174.74 172.67 3gff s THR 94 N 1.05 0.05 -1.77 0.89 -1.32 -1.26 -4.99 115.64 108.28 3gff s THR 94 Ca 0.11 -0.43 0.21 0.00 -1.21 0.00 0.00 61.69 60.37 3gff s THR 94 Cb -0.14 -0.72 -0.03 0.00 -1.51 0.00 0.00 72.50 70.10 3gff s THR 94 CO 0.05 -0.23 1.00 0.18 -2.21 0.00 0.00 174.62 173.40 3gff n LEU 95 N 1.11 1.81 -4.42 9.08 4.77 -1.26 -4.61 117.00 123.47 3gff n LEU 95 Ca -0.21 -0.73 -0.23 0.00 -0.03 0.00 0.00 56.01 54.81 3gff n LEU 95 Cb 0.57 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.55 3gff n LEU 95 CO 0.22 0.35 -0.48 0.68 -1.33 0.00 0.00 177.39 176.83 3gff s VAL 96 N -2.37 2.23 0.62 4.08 -7.23 -1.26 0.31 120.40 116.76 3gff s VAL 96 Ca 0.16 -2.28 -0.05 0.00 -1.81 0.00 0.00 61.98 58.00 3gff s VAL 96 Cb 0.16 -2.18 0.03 0.00 0.56 0.00 0.00 36.38 34.96 3gff s VAL 96 CO 0.56 -0.41 0.91 -0.76 -0.31 0.00 0.00 175.10 175.09 3gff s LEU 97 N -3.29 3.12 0.59 1.32 1.43 0.88 -4.67 118.68 118.05 3gff s LEU 97 Ca 0.26 0.51 0.28 0.00 -1.03 0.00 0.00 54.13 54.15 3gff s LEU 97 Cb -0.04 -3.29 1.64 0.00 0.03 0.00 0.00 46.19 44.53 3gff s LEU 97 CO 0.12 -1.24 2.09 -0.65 0.23 0.00 0.00 176.35 176.90 3gff h PRO 98 N -0.26 0.00 0.00 1.29 0.11 -1.82 0.10 132.00 131.42 3gff h PRO 98 Ca -0.45 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.66 3gff h PRO 98 Cb 1.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 3gff h PRO 98 CO 0.59 0.00 -0.00 0.66 -0.21 0.00 0.00 178.00 179.04 3gff h SER 99 N 0.00 0.00 0.00 -2.05 4.64 -1.88 -3.46 113.55 110.80 3gff h SER 99 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 3gff h SER 99 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 3gff h SER 99 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3gff n GLY 100 N -0.57 0.44 3.82 -0.77 0.00 0.36 -5.06 105.19 103.41 3gff n GLY 100 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 3gff n GLY 100 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gff s ASN 101 N -2.19 6.96 0.27 1.61 0.01 -1.26 -4.74 114.94 115.61 3gff s ASN 101 Ca 0.00 1.62 -0.30 0.00 -0.71 0.00 0.00 52.86 53.47 3gff s ASN 101 Cb 0.00 -2.51 -0.11 0.00 0.41 0.00 0.00 41.25 39.04 3gff s ASN 101 CO 0.00 -0.28 1.52 -0.54 -1.51 0.00 0.00 177.10 176.29 3gff s LYS 102 N -2.95 4.20 0.93 -0.60 -0.14 -1.26 -0.09 119.74 119.83 3gff s LYS 102 Ca 0.58 2.43 -0.14 0.00 -1.36 0.00 0.00 55.97 57.48 3gff s LYS 102 Cb -0.11 -3.07 0.16 0.00 -1.68 0.00 0.00 37.83 33.13 3gff s LYS 102 CO 0.16 -0.53 1.20 0.20 -0.76 0.00 0.00 175.35 175.62 3gff s GLY 103 N 0.46 1.64 1.17 -3.33 0.00 0.15 -4.68 107.32 102.73 3gff s GLY 103 Ca 0.62 -0.82 -0.13 0.00 0.00 0.00 0.00 44.72 44.39 3gff s GLY 103 CO 0.45 -0.17 0.90 1.16 0.00 0.00 0.00 173.10 175.43 3gff n ASN 104 N -3.76 -1.79 0.29 1.64 0.23 -1.26 -4.79 115.26 105.82 3gff n ASN 104 Ca 0.10 -0.15 0.20 0.00 -0.53 0.00 0.00 54.58 54.20 3gff n ASN 104 Cb 0.60 -1.23 1.05 0.00 -2.08 0.00 0.00 39.78 38.12 3gff n ASN 104 CO 0.00 0.00 0.00 -0.65 -0.93 0.00 0.00 177.26 175.68 3gff h PRO 105 N -2.62 0.00 0.00 -0.53 0.11 -1.96 -1.26 132.00 125.74 3gff h PRO 105 Ca -0.61 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.50 3gff h PRO 105 Cb 1.34 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.45 3gff h PRO 105 CO 0.48 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.31 3gff n GLN 106 N -2.88 0.32 0.27 1.05 3.00 -1.26 -2.88 117.38 115.00 3gff n GLN 106 Ca -0.02 0.07 0.14 0.00 -0.01 0.00 0.00 57.00 57.18 3gff n GLN 106 Cb 0.07 -1.50 0.77 0.00 0.00 0.00 0.00 30.24 29.58 3gff n GLN 106 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.06 178.94 3gff h TYR 107 N 0.00 0.00 -0.37 1.08 -1.99 -1.53 -2.65 116.97 111.51 3gff h TYR 107 Ca 0.00 0.00 0.11 0.00 2.00 0.00 0.00 58.73 60.84 3gff h TYR 107 Cb 0.22 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.93 3gff h TYR 107 CO 0.00 0.09 0.33 -0.56 -0.00 0.00 0.00 178.16 178.03 3gff h GLN 108 N 0.00 0.00 -0.01 4.88 3.07 -1.76 -1.97 115.11 119.33 3gff h GLN 108 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 3gff h GLN 108 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.90 3gff h GLN 108 CO 0.01 0.00 -0.19 0.72 0.09 0.00 0.00 178.83 179.46 3gff n HIS 109 N -4.02 0.00 -1.25 0.06 8.25 -1.00 -5.00 115.22 112.26 3gff n HIS 109 Ca 0.06 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.19 3gff n HIS 109 Cb 0.51 -0.10 0.11 0.00 1.12 0.00 0.00 29.99 31.63 3gff n HIS 109 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 3gff s THR 110 N -2.38 2.47 0.00 1.59 -4.23 -0.74 -3.82 115.64 108.53 3gff s THR 110 Ca 0.28 0.20 0.00 0.00 -1.18 0.00 0.00 61.69 60.99 3gff s THR 110 Cb 0.20 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 71.43 3gff s THR 110 CO 0.47 -0.16 0.00 0.61 -0.54 0.00 0.00 174.62 175.01 3gff n GLY 111 N 0.04 1.14 1.34 3.99 0.00 -0.94 -4.26 105.19 106.49 3gff n GLY 111 Ca 0.12 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.22 3gff n GLY 111 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gff n GLY 112 N -1.62 3.12 0.33 -0.02 0.00 0.16 -4.55 105.19 102.62 3gff n GLY 112 Ca 0.00 -0.85 0.06 0.00 0.00 0.00 0.00 46.02 45.24 3gff n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gff h ALA 113 N 3.22 1.76 -0.32 4.61 0.00 -1.09 -0.16 119.26 127.29 3gff h ALA 113 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 3gff h ALA 113 Cb 1.44 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 3gff h ALA 113 CO 0.24 0.17 0.17 0.78 0.00 0.00 0.00 179.25 180.60 3gff h GLY 114 N 0.62 0.48 1.14 0.00 0.00 -1.84 0.12 103.07 103.58 3gff h GLY 114 Ca 0.24 -0.22 -0.14 0.00 0.00 0.00 0.00 47.33 47.21 3gff h GLY 114 CO -0.07 0.21 -0.27 3.21 0.00 0.00 0.00 176.54 179.63 3gff h ARG 115 N 0.39 0.97 -0.48 4.80 2.47 -1.77 -1.85 114.38 118.91 3gff h ARG 115 Ca 0.11 -0.44 -0.02 0.00 -1.26 0.00 0.00 59.98 58.37 3gff h ARG 115 Cb 0.08 -0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.36 3gff h ARG 115 CO -0.02 1.11 0.23 0.35 0.56 0.00 0.00 179.97 182.20 3gff h PHE 116 N 0.82 0.69 -0.75 3.04 3.57 -0.71 -1.97 116.94 121.63 3gff h PHE 116 Ca 0.09 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.56 3gff h PHE 116 Cb 0.85 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 39.34 3gff h PHE 116 CO 0.06 0.55 0.47 -0.07 -2.23 0.00 0.00 178.31 177.09 3gff h LEU 117 N 0.63 0.88 -0.97 0.59 3.38 -0.64 -1.46 115.31 117.72 3gff h LEU 117 Ca 0.16 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 3gff h LEU 117 Cb 0.12 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 3gff h LEU 117 CO -0.02 0.66 0.25 0.44 0.09 0.00 0.00 178.44 179.87 3gff h ASP 118 N 1.03 0.92 -0.56 -0.43 3.32 -1.04 0.40 116.42 120.05 3gff h ASP 118 Ca 0.27 -0.14 0.02 0.00 0.02 0.00 0.00 57.03 57.21 3gff h ASP 118 Cb -0.08 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.20 3gff h ASP 118 CO -0.05 0.83 0.34 0.15 -1.72 0.00 0.00 179.24 178.79 3gff h PHE 119 N 0.98 0.65 -0.09 4.55 3.57 -0.53 0.27 116.94 126.33 3gff h PHE 119 Ca 0.23 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 3gff h PHE 119 Cb 0.21 -0.21 -0.00 0.00 2.79 0.00 0.00 35.95 38.74 3gff h PHE 119 CO 0.02 0.37 0.02 0.82 -2.23 0.00 0.00 178.31 177.31 3gff h ILE 120 N 0.69 1.19 -0.01 1.41 2.04 -0.40 -0.92 117.51 121.51 3gff h ILE 120 Ca 0.22 -0.60 -0.17 0.00 1.00 0.00 0.00 64.86 65.32 3gff h ILE 120 Cb 0.01 1.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 3gff h ILE 120 CO -0.09 0.17 -0.76 -0.33 0.00 0.00 0.00 178.15 177.14 3gff h GLU 121 N -0.06 0.12 0.00 2.37 5.08 -0.92 0.13 114.58 121.29 3gff h GLU 121 Ca 0.03 -0.11 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3gff h GLU 121 Cb 0.25 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3gff h GLU 121 CO 0.00 0.82 -1.57 1.63 -1.00 0.00 0.00 179.01 178.89 3gff n LYS 122 N -3.71 0.66 0.06 2.33 5.02 0.08 -4.42 118.16 118.18 3gff n LYS 122 Ca -0.02 -0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 3gff n LYS 122 Cb 0.73 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 34.30 3gff n LYS 122 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3gff n GLU 123 N -1.94 0.00 0.33 1.97 1.02 -0.72 -4.75 120.64 116.55 3gff n GLU 123 Ca -0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.00 3gff n GLU 123 Cb 0.44 -0.43 -0.06 0.00 -0.02 0.00 0.00 31.44 31.36 3gff n GLU 123 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3gff h LEU 124 N 0.00 -0.72 -0.38 -4.62 5.85 -1.18 -2.87 115.31 111.39 3gff h LEU 124 Ca 0.00 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.83 3gff h LEU 124 Cb 0.04 0.19 -0.08 0.00 0.37 0.00 0.00 40.66 41.17 3gff h LEU 124 CO 0.00 -0.43 -0.20 0.00 -0.34 0.00 0.00 178.44 177.46 3gff h ALA 125 N -1.45 0.06 -0.94 1.25 0.00 -0.98 -0.72 119.26 116.48 3gff h ALA 125 Ca -0.09 0.13 0.15 0.00 0.00 0.00 0.00 54.91 55.10 3gff h ALA 125 Cb 0.65 0.48 -0.08 0.00 0.00 0.00 0.00 17.79 18.84 3gff h ALA 125 CO 0.14 -0.58 0.60 -1.35 0.00 0.00 0.00 179.25 178.06 3gff h PRO 126 N -0.14 0.74 -0.27 0.00 0.11 -1.77 -0.04 132.00 130.63 3gff h PRO 126 Ca 0.19 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.17 3gff h PRO 126 Cb 0.43 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.36 3gff h PRO 126 CO -0.46 0.49 -0.14 1.03 -0.21 0.00 0.00 178.00 178.71 3gff h SER 127 N 0.77 0.59 -0.37 -2.05 0.87 -0.94 -1.63 113.55 110.78 3gff h SER 127 Ca 0.48 -0.41 0.00 0.00 -1.23 0.00 0.00 61.79 60.63 3gff h SER 127 Cb 0.71 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.49 3gff h SER 127 CO -0.25 0.87 0.24 0.40 -0.53 0.00 0.00 176.83 177.57 3gff h ILE 128 N 0.30 1.10 0.00 2.23 1.08 -0.68 -1.83 117.51 119.72 3gff h ILE 128 Ca 0.06 -0.18 -0.07 0.00 -0.39 0.00 0.00 64.86 64.28 3gff h ILE 128 Cb 0.65 0.56 -0.01 0.00 -3.07 0.00 0.00 36.82 34.95 3gff h ILE 128 CO 0.04 0.10 -0.31 -0.33 -0.69 0.00 0.00 178.15 176.95 3gff h GLU 129 N 0.50 0.00 0.01 2.37 5.08 -1.04 -0.26 114.58 121.25 3gff h GLU 129 Ca 0.14 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.25 3gff h GLU 129 Cb -0.05 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.21 3gff h GLU 129 CO -0.03 0.31 -1.00 0.66 -1.00 0.00 0.00 179.01 177.95 3gff h SER 130 N 0.00 0.65 0.50 1.42 4.64 -1.00 -3.36 113.55 116.40 3gff h SER 130 Ca -0.00 -0.53 -0.28 0.00 -0.47 0.00 0.00 61.79 60.50 3gff h SER 130 Cb 0.88 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 62.78 3gff h SER 130 CO 0.04 1.34 -1.24 1.56 -0.87 0.00 0.00 176.83 177.66 3gff h GLN 131 N 0.27 0.36 -6.06 4.77 4.20 -0.94 -3.47 115.11 114.23 3gff h GLN 131 Ca -0.10 -0.56 -0.57 0.00 0.06 0.00 0.00 58.65 57.48 3gff h GLN 131 Cb 1.65 0.20 -0.14 0.00 0.30 0.00 0.00 27.48 29.49 3gff h GLN 131 CO 0.18 1.25 -0.76 -0.51 -0.67 0.00 0.00 178.83 178.33 3gff s LEU 132 N -7.34 2.57 -0.56 1.46 1.43 -0.14 -5.10 118.68 111.00 3gff s LEU 132 Ca -0.05 -1.02 -0.25 0.00 -1.03 0.00 0.00 54.13 51.78 3gff s LEU 132 Cb 0.07 -0.99 0.04 0.00 0.03 0.00 0.00 46.19 45.33 3gff s LEU 132 CO 0.90 -0.01 1.00 -0.13 0.23 0.00 0.00 176.35 178.34 3gff s ARG 133 N -3.50 3.37 0.07 1.70 0.52 -1.26 -4.52 118.95 115.33 3gff s ARG 133 Ca 0.27 -0.15 0.04 0.00 -0.52 0.00 0.00 55.73 55.37 3gff s ARG 133 Cb -0.04 -4.05 -0.04 0.00 0.52 0.00 0.00 34.95 31.34 3gff s ARG 133 CO 0.13 -1.54 -0.01 0.95 0.02 0.00 0.00 175.30 174.84 3gff s THR 134 N 4.19 3.95 -2.45 0.02 -4.23 -1.26 -1.66 115.64 114.20 3gff s THR 134 Ca 0.33 -0.92 0.23 0.00 -1.18 0.00 0.00 61.69 60.15 3gff s THR 134 Cb -0.11 -2.84 0.39 0.00 1.34 0.00 0.00 72.50 71.27 3gff s THR 134 CO 0.20 0.19 1.37 -0.46 -0.54 0.00 0.00 174.62 175.38 3gff n ASN 135 N 0.82 3.38 0.00 3.99 0.23 0.24 -4.62 115.26 119.31 3gff n ASN 135 Ca -0.12 -1.98 0.00 0.00 -0.53 0.00 0.00 54.58 51.95 3gff n ASN 135 Cb 0.52 -0.22 0.00 0.00 -2.08 0.00 0.00 39.78 38.00 3gff n ASN 135 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3gff n GLY 136 N 1.44 0.90 3.56 4.83 0.00 -1.26 -4.92 105.19 109.73 3gff n GLY 136 Ca 0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.79 3gff n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gff s ILE 137 N -2.47 5.09 -0.08 -0.61 -1.09 -1.26 -4.91 121.20 115.86 3gff s ILE 137 Ca 0.00 0.27 0.04 0.00 -2.23 0.00 0.00 60.65 58.73 3gff s ILE 137 Cb 0.00 -3.88 0.00 0.00 -1.58 0.00 0.00 42.46 37.00 3gff s ILE 137 CO 0.00 -0.12 -0.20 0.20 -1.23 0.00 0.00 174.94 173.59 3gff s ASN 138 N 1.73 2.64 0.02 3.58 0.01 -1.26 -1.61 114.94 120.04 3gff s ASN 138 Ca 0.16 -0.46 0.06 0.00 -0.71 0.00 0.00 52.86 51.90 3gff s ASN 138 Cb -0.16 -1.09 -0.03 0.00 0.41 0.00 0.00 41.25 40.38 3gff s ASN 138 CO 0.12 0.14 -0.16 -0.69 -1.51 0.00 0.00 177.10 175.00 3gff s VAL 139 N 0.32 2.95 -0.12 1.60 1.01 0.09 -1.61 120.40 124.64 3gff s VAL 139 Ca -0.14 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 60.84 3gff s VAL 139 Cb -0.16 -2.22 0.00 0.00 0.00 0.00 0.00 36.38 34.00 3gff s VAL 139 CO 0.06 0.40 -0.22 -0.22 0.00 0.00 0.00 175.10 175.12 3gff s LEU 140 N -1.27 2.14 -0.22 3.92 2.96 -0.61 -0.34 118.68 125.26 3gff s LEU 140 Ca 0.14 -0.56 0.01 0.00 -0.22 0.00 0.00 54.13 53.50 3gff s LEU 140 Cb -0.11 -1.44 0.03 0.00 0.50 0.00 0.00 46.19 45.18 3gff s LEU 140 CO 0.05 0.13 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.39 3gff s VAL 141 N 0.51 2.39 -0.05 1.68 1.01 -0.01 -0.81 120.40 125.10 3gff s VAL 141 Ca -0.14 -1.13 0.03 0.00 0.00 0.00 0.00 61.98 60.73 3gff s VAL 141 Cb -0.17 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 34.04 3gff s VAL 141 CO 0.05 0.28 -0.13 -0.83 0.00 0.00 0.00 175.10 174.48 3gff s GLY 142 N 1.26 0.77 -0.00 4.51 0.00 -0.48 -1.52 107.32 111.86 3gff s GLY 142 Ca -0.00 -0.45 0.06 0.00 0.00 0.00 0.00 44.72 44.33 3gff s GLY 142 CO -0.08 0.00 -0.17 -1.58 0.00 0.00 0.00 173.10 171.27 3gff s HIS 143 N 0.47 2.60 0.00 1.90 5.65 -1.26 0.00 115.29 124.66 3gff s HIS 143 Ca -0.11 -0.23 0.00 0.00 0.25 0.00 0.00 55.06 54.97 3gff s HIS 143 Cb -0.14 -1.54 0.00 0.00 -1.18 0.00 0.00 32.58 29.73 3gff s HIS 143 CO 0.03 0.20 0.00 0.45 -0.65 0.00 0.00 174.74 174.77 3gff n SER 144 N 1.92 0.00 0.25 9.88 2.88 -0.34 -0.79 113.62 127.42 3gff n SER 144 Ca -0.16 0.00 0.09 0.00 -1.33 0.00 0.00 58.87 57.47 3gff n SER 144 Cb 0.52 0.00 0.65 0.00 -0.75 0.00 0.00 64.21 64.63 3gff n SER 144 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 3gff h PHE 145 N 0.00 0.00 0.00 0.66 -1.00 -1.92 0.36 116.94 115.04 3gff h PHE 145 Ca 0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 3gff h PHE 145 Cb 0.00 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.56 3gff h PHE 145 CO 0.00 0.09 -0.09 0.78 -1.61 0.00 0.00 178.31 177.49 3gff h GLY 146 N 0.35 0.00 1.48 -1.45 0.00 -1.26 -1.11 103.07 101.09 3gff h GLY 146 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3gff h GLY 146 CO 0.01 0.00 0.22 -1.33 0.00 0.00 0.00 176.54 175.44 3gff h GLY 147 N 0.27 0.72 2.00 4.60 0.00 -0.95 -1.81 103.07 107.91 3gff h GLY 147 Ca -0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 3gff h GLY 147 CO 0.01 0.32 -0.18 1.41 0.00 0.00 0.00 176.54 178.10 3gff h LEU 148 N 0.68 0.00 -0.22 3.11 3.38 -1.23 -2.48 115.31 118.55 3gff h LEU 148 Ca 0.17 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.07 3gff h LEU 148 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 3gff h LEU 148 CO -0.02 0.18 -0.13 0.58 0.09 0.00 0.00 178.44 179.14 3gff h VAL 149 N 0.00 1.31 0.00 1.22 2.07 -1.31 -0.22 116.25 119.32 3gff h VAL 149 Ca -0.00 -1.22 0.00 0.00 0.82 0.00 0.00 66.70 66.30 3gff h VAL 149 Cb 0.42 1.63 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 3gff h VAL 149 CO 0.02 0.37 0.00 0.00 0.02 0.00 0.00 177.57 177.99 3gff n ALA 150 N -2.42 0.93 0.00 1.67 0.00 -0.93 -1.23 120.51 118.52 3gff n ALA 150 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3gff n ALA 150 Cb 0.35 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.91 3gff n ALA 150 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3gff n GLU 152 N 0.37 0.00 -0.14 0.00 4.07 -0.10 -2.09 120.64 122.76 3gff n GLU 152 Ca 0.00 0.00 -0.12 0.00 -0.06 0.00 0.00 57.16 56.98 3gff n GLU 152 Cb 0.00 0.00 -0.01 0.00 -0.06 0.00 0.00 31.44 31.37 3gff n GLU 152 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3gff h ALA 153 N 0.00 0.61 -0.12 4.31 0.00 -1.42 0.01 119.26 122.64 3gff h ALA 153 Ca 0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.45 3gff h ALA 153 Cb 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 3gff h ALA 153 CO 0.00 0.65 -0.08 1.25 0.00 0.00 0.00 179.25 181.07 3gff h LEU 154 N 0.78 0.28 -1.54 0.00 5.85 -1.69 -0.85 115.31 118.14 3gff h LEU 154 Ca 0.08 -0.44 0.08 0.00 0.84 0.00 0.00 57.88 58.44 3gff h LEU 154 Cb 0.88 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 3gff h LEU 154 CO 0.08 0.67 0.42 -0.09 -0.34 0.00 0.00 178.44 179.17 3gff h ARG 155 N -0.09 0.52 -0.58 1.25 2.43 -1.78 -2.10 114.38 114.02 3gff h ARG 155 Ca 0.02 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3gff h ARG 155 Cb 0.57 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 3gff h ARG 155 CO 0.02 0.34 0.00 0.25 -1.51 0.00 0.00 179.97 179.08 3gff n THR 156 N -4.48 2.24 -3.83 0.20 -2.24 -0.03 -4.96 114.28 101.19 3gff n THR 156 Ca 0.10 -1.34 -0.29 0.00 -2.27 0.00 0.00 64.05 60.24 3gff n THR 156 Cb 0.30 -0.06 0.02 0.00 -2.10 0.00 0.00 70.33 68.49 3gff n THR 156 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3gff n ASP 157 N 0.78 -4.79 -4.68 3.42 8.00 -0.79 -4.89 116.55 113.60 3gff n ASP 157 Ca 0.26 -0.72 -0.43 0.00 0.71 0.00 0.00 54.79 54.61 3gff n ASP 157 Cb 1.01 -3.83 -0.03 0.00 -0.02 0.00 0.00 41.12 38.24 3gff n ASP 157 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3gff n ARG 158 N -4.56 2.79 0.22 -1.24 5.12 -0.36 -4.91 116.66 113.72 3gff n ARG 158 Ca 0.03 1.02 0.08 0.00 -1.93 0.00 0.00 57.85 57.05 3gff n ARG 158 Cb 0.53 -2.93 0.50 0.00 -1.16 0.00 0.00 32.46 29.41 3gff n ARG 158 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 3gff h PRO 159 N 9.10 0.00 -0.47 5.56 0.11 -1.90 -3.33 132.00 141.07 3gff h PRO 159 Ca -0.47 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.66 3gff h PRO 159 Cb 1.23 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.31 3gff h PRO 159 CO 0.95 0.25 0.28 1.25 -0.21 0.00 0.00 178.00 180.52 3gff h LEU 160 N 0.00 0.45 -9.51 2.35 5.85 -1.98 -3.44 115.31 109.03 3gff h LEU 160 Ca -0.00 0.00 -0.63 0.00 0.84 0.00 0.00 57.88 58.10 3gff h LEU 160 Cb 0.61 -0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.47 3gff h LEU 160 CO 0.03 0.32 -0.37 -0.36 -0.34 0.00 0.00 178.44 177.72 3gff s PHE 161 N -6.15 3.57 -0.12 1.25 0.08 -1.25 -4.28 117.98 111.08 3gff s PHE 161 Ca -0.13 0.64 0.11 0.00 0.12 0.00 0.00 56.93 57.67 3gff s PHE 161 Cb 0.12 -2.16 -0.24 0.00 -0.57 0.00 0.00 43.02 40.18 3gff s PHE 161 CO 0.73 0.53 0.37 0.43 -0.10 0.00 0.00 175.22 177.18 3gff n SER 162 N 2.55 0.86 -3.91 1.36 7.64 -0.63 -4.95 113.62 116.54 3gff n SER 162 Ca -0.16 0.22 -0.11 0.00 1.01 0.00 0.00 58.87 59.83 3gff n SER 162 Cb 0.53 0.13 -0.13 0.00 -1.01 0.00 0.00 64.21 63.73 3gff n SER 162 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3gff s ALA 163 N -2.55 0.03 -0.04 -0.43 0.00 -1.22 -0.45 121.76 117.10 3gff s ALA 163 Ca -0.11 -0.22 0.03 0.00 0.00 0.00 0.00 51.96 51.66 3gff s ALA 163 Cb 0.07 0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.25 3gff s ALA 163 CO 0.80 -0.07 -0.12 0.71 0.00 0.00 0.00 175.76 177.08 3gff s TYR 164 N -0.59 1.32 -0.25 0.00 2.02 -0.40 -1.57 117.35 117.87 3gff s TYR 164 Ca -0.06 -0.38 -0.01 0.00 -0.37 0.00 0.00 57.07 56.25 3gff s TYR 164 Cb -0.04 -0.92 0.03 0.00 -0.40 0.00 0.00 41.96 40.63 3gff s TYR 164 CO -0.00 -0.16 -0.07 -0.51 -1.57 0.00 0.00 175.55 173.24 3gff s LEU 165 N 0.24 3.27 -0.45 -1.29 1.02 0.01 -1.09 118.68 120.40 3gff s LEU 165 Ca -0.06 -1.01 -0.08 0.00 0.02 0.00 0.00 54.13 53.01 3gff s LEU 165 Cb -0.11 -1.64 0.11 0.00 0.02 0.00 0.00 46.19 44.57 3gff s LEU 165 CO 0.02 -0.15 0.30 0.00 0.02 0.00 0.00 176.35 176.53 3gff s ALA 166 N 1.27 3.32 -0.39 4.21 0.00 -0.05 -1.38 121.76 128.74 3gff s ALA 166 Ca -0.02 -2.44 -0.17 0.00 0.00 0.00 0.00 51.96 49.33 3gff s ALA 166 Cb -0.17 -2.70 0.01 0.00 0.00 0.00 0.00 23.12 20.25 3gff s ALA 166 CO -0.05 -1.82 0.45 -0.51 0.00 0.00 0.00 175.76 173.84 3gff s LEU 167 N 1.34 4.62 -1.04 0.00 1.43 0.10 -2.44 118.68 122.68 3gff s LEU 167 Ca 0.05 -0.41 -0.19 0.00 -1.03 0.00 0.00 54.13 52.55 3gff s LEU 167 Cb -0.25 -2.44 0.02 0.00 0.03 0.00 0.00 46.19 43.55 3gff s LEU 167 CO -0.01 -0.52 0.66 -0.67 0.23 0.00 0.00 176.35 176.05 3gff n ASP 168 N 5.63 -4.62 -4.77 2.29 2.03 0.06 -1.20 116.55 115.97 3gff n ASP 168 Ca -0.07 -1.12 -0.41 0.00 0.52 0.00 0.00 54.79 53.72 3gff n ASP 168 Cb 0.48 -1.91 -0.01 0.00 -0.72 0.00 0.00 41.12 38.97 3gff n ASP 168 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 3gff s THR 169 N -3.30 2.12 -1.47 5.18 2.01 -1.26 -2.75 115.64 116.17 3gff s THR 169 Ca 0.29 0.11 -0.08 0.00 0.31 0.00 0.00 61.69 62.31 3gff s THR 169 Cb -0.15 -3.07 0.02 0.00 0.01 0.00 0.00 72.50 69.31 3gff s THR 169 CO 0.93 0.02 2.61 -1.20 -0.69 0.00 0.00 174.62 176.29 3gff n SER 170 N 1.13 7.85 0.13 3.53 7.64 -0.93 -4.72 113.62 128.25 3gff n SER 170 Ca 0.04 -2.85 0.10 0.00 1.01 0.00 0.00 58.87 57.17 3gff n SER 170 Cb 0.39 -1.48 0.48 0.00 -1.01 0.00 0.00 64.21 62.59 3gff n SER 170 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3gff n LEU 171 N 3.08 0.53 0.27 -3.43 4.77 -1.26 -1.76 117.00 119.20 3gff n LEU 171 Ca 0.68 0.68 0.15 0.00 -0.03 0.00 0.00 56.01 57.49 3gff n LEU 171 Cb 0.26 -0.67 0.74 0.00 -2.33 0.00 0.00 43.42 41.41 3gff n LEU 171 CO 0.79 -0.70 0.98 4.11 -1.33 0.00 0.00 177.39 181.24 3gff h TRP 172 N 0.00 0.00 -2.68 -1.77 5.08 -1.89 -3.41 115.95 111.29 3gff h TRP 172 Ca 0.00 0.00 -0.53 0.00 1.08 0.00 0.00 58.89 59.44 3gff h TRP 172 Cb 0.18 0.00 0.02 0.00 -3.00 0.00 0.00 29.16 26.36 3gff h TRP 172 CO 0.00 0.08 1.00 0.12 -1.28 0.00 0.00 178.44 178.36 3gff s PHE 173 N -3.89 2.43 -1.57 0.12 5.36 -0.73 -2.00 117.98 117.70 3gff s PHE 173 Ca -0.01 0.31 -0.15 0.00 -0.96 0.00 0.00 56.93 56.11 3gff s PHE 173 Cb 0.11 -3.98 0.11 0.00 -0.34 0.00 0.00 43.02 38.92 3gff s PHE 173 CO 0.55 -3.92 0.91 -3.47 -1.46 0.00 0.00 175.22 167.83 3gff n ASP 174 N 5.54 -4.40 -4.83 6.13 2.03 -1.26 -4.58 116.55 115.18 3gff n ASP 174 Ca 0.16 -0.82 -0.36 0.00 0.52 0.00 0.00 54.79 54.29 3gff n ASP 174 Cb 0.40 -3.54 -0.06 0.00 -0.72 0.00 0.00 41.12 37.21 3gff n ASP 174 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 3gff s SER 175 N -3.26 6.92 0.00 1.67 1.04 -0.85 -0.68 113.70 118.55 3gff s SER 175 Ca 0.68 1.17 0.29 0.00 0.48 0.00 0.00 55.95 58.57 3gff s SER 175 Cb -0.35 -2.32 1.28 0.00 0.10 0.00 0.00 66.02 64.72 3gff s SER 175 CO 0.84 0.14 1.93 -0.81 0.98 0.00 0.00 173.24 176.32 3gff n PRO 176 N 1.03 0.14 0.08 4.02 -0.04 -1.26 -4.77 135.00 134.20 3gff n PRO 176 Ca -0.06 -0.01 -0.13 0.00 -0.04 0.00 0.00 63.50 63.26 3gff n PRO 176 Cb 0.51 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.41 3gff n PRO 176 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 3gff h HIS 177 N 0.02 -1.01 -0.36 0.54 2.76 -1.67 -0.76 115.15 114.68 3gff h HIS 177 Ca 0.00 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.16 3gff h HIS 177 Cb 0.44 0.44 -0.01 0.00 1.55 0.00 0.00 27.41 29.82 3gff h HIS 177 CO 0.00 -0.46 0.06 -0.92 -1.30 0.00 0.00 177.93 175.31 3gff h TYR 178 N -0.55 0.64 -0.83 5.26 3.20 -1.14 -2.76 116.97 120.79 3gff h TYR 178 Ca 0.04 -0.09 0.07 0.00 3.14 0.00 0.00 58.73 61.90 3gff h TYR 178 Cb 0.61 -0.18 -0.05 0.00 1.54 0.00 0.00 36.73 38.65 3gff h TYR 178 CO -0.35 0.65 0.54 1.25 -1.64 0.00 0.00 178.16 178.61 3gff h LEU 179 N 0.44 0.79 -0.39 2.82 5.85 -1.73 -1.06 115.31 122.02 3gff h LEU 179 Ca 0.11 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 3gff h LEU 179 Cb 0.36 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.21 3gff h LEU 179 CO 0.01 0.50 0.21 0.74 -0.34 0.00 0.00 178.44 179.56 3gff h THR 180 N 0.89 1.15 -0.68 1.05 2.02 -0.95 -0.44 112.91 115.95 3gff h THR 180 Ca 0.36 -0.40 0.03 0.00 0.77 0.00 0.00 66.41 67.18 3gff h THR 180 Cb 0.26 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.33 3gff h THR 180 CO -0.13 0.16 0.43 -0.07 0.37 0.00 0.00 175.52 176.27 3gff h LEU 181 N 0.50 0.70 0.01 2.58 4.07 -1.01 -1.20 115.31 120.96 3gff h LEU 181 Ca 0.14 0.00 0.01 0.00 0.08 0.00 0.00 57.88 58.11 3gff h LEU 181 Cb 0.06 -0.15 -0.02 0.00 1.08 0.00 0.00 40.66 41.64 3gff h LEU 181 CO -0.02 0.48 -0.07 -0.07 -1.08 0.00 0.00 178.44 177.68 3gff h LEU 182 N 0.83 -0.21 -0.68 1.67 3.38 -0.80 -2.16 115.31 117.34 3gff h LEU 182 Ca 0.27 0.03 0.07 0.00 0.09 0.00 0.00 57.88 58.35 3gff h LEU 182 Cb 0.02 0.09 -0.06 0.00 0.09 0.00 0.00 40.66 40.80 3gff h LEU 182 CO -0.11 -0.11 0.36 -0.33 0.09 0.00 0.00 178.44 178.34 3gff h GLU 183 N -0.13 0.63 -0.16 1.13 5.08 -0.91 -1.86 114.58 118.36 3gff h GLU 183 Ca 0.03 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 58.32 3gff h GLU 183 Cb 0.17 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 3gff h GLU 183 CO -0.07 0.42 -0.03 0.93 -1.00 0.00 0.00 179.01 179.26 3gff h GLU 184 N 0.65 0.23 -0.25 2.33 5.08 -0.91 -0.23 114.58 121.49 3gff h GLU 184 Ca 0.32 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.54 3gff h GLU 184 Cb 0.25 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 3gff h GLU 184 CO -0.21 0.29 -0.23 -0.09 -1.00 0.00 0.00 179.01 177.76 3gff h ARG 185 N 0.23 0.59 -0.47 2.33 9.65 -0.72 -2.23 114.38 123.76 3gff h ARG 185 Ca 0.05 -0.31 0.04 0.00 -1.10 0.00 0.00 59.98 58.67 3gff h ARG 185 Cb 0.21 0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.76 3gff h ARG 185 CO 0.01 0.90 0.23 0.28 2.80 0.00 0.00 179.97 184.18 3gff h VAL 186 N 0.30 0.95 -0.45 0.20 2.07 -0.66 0.47 116.25 119.12 3gff h VAL 186 Ca 0.04 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 3gff h VAL 186 Cb 0.78 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 3gff h VAL 186 CO 0.06 0.08 0.26 0.58 0.02 0.00 0.00 177.57 178.57 3gff h VAL 187 N 0.45 1.15 -0.95 2.57 2.07 -1.04 -1.99 116.25 118.51 3gff h VAL 187 Ca 0.21 -0.36 0.06 0.00 0.82 0.00 0.00 66.70 67.43 3gff h VAL 187 Cb 0.13 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.41 3gff h VAL 187 CO -0.16 0.15 0.61 0.50 0.02 0.00 0.00 177.57 178.70 3gff h LYS 188 N 0.59 1.09 0.00 1.57 3.64 -0.98 -3.47 116.57 119.01 3gff h LYS 188 Ca 0.16 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 3gff h LYS 188 Cb 0.02 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.59 3gff h LYS 188 CO -0.03 0.72 0.00 0.41 -2.27 0.00 0.00 179.45 178.28 3gff n GLY 189 N -1.35 1.71 3.68 5.01 0.00 0.12 -4.94 105.19 109.41 3gff n GLY 189 Ca 0.14 -0.51 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 3gff n GLY 189 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3gff n ASP 190 N -1.66 -5.20 -4.83 1.61 8.00 -1.17 -4.94 116.55 108.36 3gff n ASP 190 Ca 0.00 -1.01 -0.32 0.00 0.71 0.00 0.00 54.79 54.17 3gff n ASP 190 Cb 0.00 -3.41 -0.03 0.00 -0.02 0.00 0.00 41.12 37.66 3gff n ASP 190 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3gff s PHE 191 N -3.47 3.30 -1.37 1.24 0.08 -0.59 -4.96 117.98 112.21 3gff s PHE 191 Ca 0.46 1.50 -0.09 0.00 0.12 0.00 0.00 56.93 58.93 3gff s PHE 191 Cb -0.16 -2.86 0.10 0.00 -0.57 0.00 0.00 43.02 39.52 3gff s PHE 191 CO 0.86 -0.53 2.26 1.17 -0.10 0.00 0.00 175.22 178.87 3gff n LYS 192 N -1.53 3.87 -3.61 0.44 4.81 -1.26 -4.24 118.16 116.63 3gff n LYS 192 Ca 0.07 -3.18 -0.19 0.00 -0.87 0.00 0.00 58.31 54.14 3gff n LYS 192 Cb 0.54 -2.85 0.00 0.00 0.02 0.00 0.00 35.03 32.73 3gff n LYS 192 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 3gff n GLN 193 N 3.38 -1.43 -4.20 1.64 1.13 -1.12 -4.86 117.38 111.93 3gff n GLN 193 Ca 0.55 0.92 -0.24 0.00 -1.94 0.00 0.00 57.00 56.29 3gff n GLN 193 Cb 0.31 -3.29 -0.07 0.00 0.11 0.00 0.00 30.24 27.30 3gff n GLN 193 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 3gff s LYS 194 N -4.57 2.26 0.00 -1.09 -0.14 -0.36 -4.26 119.74 111.58 3gff s LYS 194 Ca 0.04 -1.60 0.03 0.00 -1.36 0.00 0.00 55.97 53.08 3gff s LYS 194 Cb -0.02 -2.09 -0.01 0.00 -1.68 0.00 0.00 37.83 34.04 3gff s LYS 194 CO 0.86 0.15 -0.10 -0.65 -0.76 0.00 0.00 175.35 174.85 3gff s GLN 195 N -3.78 0.75 -0.04 1.68 -0.21 0.41 -0.93 119.66 117.54 3gff s GLN 195 Ca 0.36 -0.40 0.03 0.00 0.02 0.00 0.00 55.36 55.36 3gff s GLN 195 Cb -0.02 -0.72 0.01 0.00 1.00 0.00 0.00 33.01 33.28 3gff s GLN 195 CO 0.21 0.19 -0.11 -1.17 -2.12 0.00 0.00 175.29 172.29 3gff s LEU 196 N -0.40 1.75 0.00 2.90 2.96 0.16 -1.28 118.68 124.77 3gff s LEU 196 Ca 0.02 -0.24 0.02 0.00 -0.22 0.00 0.00 54.13 53.71 3gff s LEU 196 Cb -0.04 -0.69 -0.01 0.00 0.50 0.00 0.00 46.19 45.95 3gff s LEU 196 CO -0.00 0.07 0.06 0.33 -1.32 0.00 0.00 176.35 175.49 3gff n PHE 197 N 3.42 0.38 -3.64 5.38 7.35 -0.25 -4.16 117.46 125.94 3gff n PHE 197 Ca -0.20 -1.73 -0.08 0.00 -0.76 0.00 0.00 57.45 54.68 3gff n PHE 197 Cb 0.53 -0.10 -0.07 0.00 0.35 0.00 0.00 39.48 40.20 3gff n PHE 197 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3gff s ALA 199 N -2.68 -1.93 -0.13 3.13 0.00 -1.02 -0.87 121.76 118.25 3gff s ALA 199 Ca 0.08 2.23 0.02 0.00 0.00 0.00 0.00 51.96 54.28 3gff s ALA 199 Cb 0.00 -1.41 0.01 0.00 0.00 0.00 0.00 23.12 21.73 3gff s ALA 199 CO 0.06 -0.35 -0.18 0.42 0.00 0.00 0.00 175.76 175.71 3gff s ILE 200 N 1.10 1.75 0.51 0.00 1.01 0.53 -0.76 121.20 125.34 3gff s ILE 200 Ca -0.06 -0.78 0.08 0.00 0.00 0.00 0.00 60.65 59.89 3gff s ILE 200 Cb -0.05 -1.58 0.04 0.00 0.01 0.00 0.00 42.46 40.88 3gff s ILE 200 CO -0.12 0.49 0.61 0.00 0.00 0.00 0.00 174.94 175.92 3gff s ALA 201 N 1.02 4.52 -0.67 9.38 0.00 -1.26 -0.08 121.76 134.67 3gff s ALA 201 Ca -0.04 -1.84 0.03 0.00 0.00 0.00 0.00 51.96 50.10 3gff s ALA 201 Cb -0.15 -1.30 0.36 0.00 0.00 0.00 0.00 23.12 22.04 3gff s ALA 201 CO -0.04 -0.55 1.36 -1.71 0.00 0.00 0.00 175.76 174.82 3gff n ASN 202 N -1.96 5.66 -4.73 0.00 5.15 -0.63 -4.82 115.26 113.93 3gff n ASN 202 Ca 0.09 -3.73 -0.42 0.00 -0.60 0.00 0.00 54.58 49.93 3gff n ASN 202 Cb 0.61 -0.74 -0.03 0.00 -0.53 0.00 0.00 39.78 39.10 3gff n ASN 202 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 3gff s ASN 203 N -2.65 6.80 0.22 1.20 2.47 -1.26 -4.77 114.94 116.95 3gff s ASN 203 Ca 0.47 2.46 0.26 0.00 0.42 0.00 0.00 52.86 56.47 3gff s ASN 203 Cb 0.33 -2.61 0.85 0.00 -1.45 0.00 0.00 41.25 38.37 3gff s ASN 203 CO -0.20 -0.62 1.76 -0.81 -3.72 0.00 0.00 177.10 173.51 3gff n PRO 204 N 3.00 0.25 -4.21 0.43 -0.04 -1.26 -4.79 135.00 128.38 3gff n PRO 204 Ca 0.08 0.26 -0.24 0.00 -0.04 0.00 0.00 63.50 63.57 3gff n PRO 204 Cb 0.42 -1.82 -0.07 0.00 -0.04 0.00 0.00 33.50 31.99 3gff n PRO 204 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3gff s LEU 205 N -4.52 3.42 -0.05 1.53 1.43 -1.24 -1.20 118.68 118.04 3gff s LEU 205 Ca 0.09 -0.45 -0.02 0.00 -1.03 0.00 0.00 54.13 52.72 3gff s LEU 205 Cb 0.12 -1.98 0.04 0.00 0.03 0.00 0.00 46.19 44.39 3gff s LEU 205 CO 0.55 0.02 0.09 -0.44 0.23 0.00 0.00 176.35 176.80 3gff s SER 206 N -3.49 0.81 -0.04 2.29 0.01 -0.64 -4.76 113.70 107.88 3gff s SER 206 Ca 0.31 0.17 -0.39 0.00 1.31 0.00 0.00 55.95 57.35 3gff s SER 206 Cb -0.08 0.02 -0.18 0.00 0.21 0.00 0.00 66.02 66.00 3gff s SER 206 CO 0.21 -0.23 1.35 -2.65 0.41 0.00 0.00 173.24 172.34 3gff n PRO 207 N 5.10 0.77 0.00 12.44 -0.02 -1.26 -1.15 135.00 150.87 3gff n PRO 207 Ca -0.08 0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 3gff n PRO 207 Cb 0.50 -1.88 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 3gff n PRO 207 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3gff n GLY 208 N 2.64 3.05 0.00 -1.23 0.00 -1.26 -4.65 105.19 103.74 3gff n GLY 208 Ca 0.21 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.28 3gff n GLY 208 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3gff n PHE 209 N -0.64 0.00 -2.67 1.61 3.72 -0.30 -4.74 117.46 114.44 3gff n PHE 209 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3gff n PHE 209 Cb 0.00 -0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.46 3gff n PHE 209 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3gff n GLY 210 N 1.45 1.56 3.56 1.37 0.00 -1.01 -4.53 105.19 107.58 3gff n GLY 210 Ca 0.01 -0.60 -0.38 0.00 0.00 0.00 0.00 46.02 45.05 3gff n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gff s VAL 211 N 0.00 3.23 0.00 1.61 1.01 -1.26 -1.61 120.40 123.38 3gff s VAL 211 Ca 0.00 0.15 -0.28 0.00 0.00 0.00 0.00 61.98 61.85 3gff s VAL 211 Cb 0.00 -3.55 0.09 0.00 0.00 0.00 0.00 36.38 32.93 3gff s VAL 211 CO 0.00 -0.51 0.79 -0.94 0.00 0.00 0.00 175.10 174.44 3gff s SER 212 N 9.37 -0.47 -0.04 3.32 1.04 -0.34 -4.94 113.70 121.64 3gff s SER 212 Ca 0.80 0.19 0.18 0.00 0.48 0.00 0.00 55.95 57.61 3gff s SER 212 Cb -0.16 0.46 0.58 0.00 0.10 0.00 0.00 66.02 67.00 3gff s SER 212 CO 0.24 -0.67 1.49 -1.54 0.98 0.00 0.00 173.24 173.75 3gff n SER 213 N 0.09 3.94 -0.15 7.02 3.41 -1.26 -3.46 113.62 123.21 3gff n SER 213 Ca -0.13 -2.17 -0.03 0.00 -0.26 0.00 0.00 58.87 56.28 3gff n SER 213 Cb 0.61 -0.46 0.05 0.00 -0.26 0.00 0.00 64.21 64.15 3gff n SER 213 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 3gff h TYR 214 N 3.59 -0.06 -0.23 7.33 3.20 -1.94 0.15 116.97 129.01 3gff h TYR 214 Ca 0.00 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.94 3gff h TYR 214 Cb 1.08 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 39.42 3gff h TYR 214 CO 0.51 -0.12 0.02 1.25 -1.64 0.00 0.00 178.16 178.18 3gff h HIS 215 N 0.09 0.03 -0.08 -3.82 2.76 -1.87 -1.71 115.15 110.55 3gff h HIS 215 Ca 0.24 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.42 3gff h HIS 215 Cb 0.36 0.02 -0.00 0.00 1.55 0.00 0.00 27.41 29.33 3gff h HIS 215 CO -0.32 -0.01 0.05 -0.22 -1.30 0.00 0.00 177.93 176.13 3gff h LYS 216 N 0.10 0.11 -0.84 5.26 3.64 -1.75 -3.03 116.57 120.06 3gff h LYS 216 Ca 0.11 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.50 3gff h LYS 216 Cb 0.12 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.87 3gff h LYS 216 CO -0.16 0.14 0.55 -0.44 -2.27 0.00 0.00 179.45 177.27 3gff h ASP 217 N 0.05 0.92 -0.41 4.20 3.32 -0.59 -1.04 116.42 122.87 3gff h ASP 217 Ca 0.03 -0.02 0.03 0.00 0.02 0.00 0.00 57.03 57.09 3gff h ASP 217 Cb 0.06 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 3gff h ASP 217 CO -0.00 0.64 0.22 -0.07 -1.72 0.00 0.00 179.24 178.31 3gff h LEU 218 N 1.07 0.34 -0.30 1.55 4.07 -1.27 -0.38 115.31 120.39 3gff h LEU 218 Ca 0.32 0.01 -0.03 0.00 0.08 0.00 0.00 57.88 58.27 3gff h LEU 218 Cb -0.02 -0.05 -0.01 0.00 1.08 0.00 0.00 40.66 41.65 3gff h LEU 218 CO -0.09 0.24 0.07 0.78 -1.08 0.00 0.00 178.44 178.37 3gff h ASN 219 N 0.45 0.45 -0.61 -0.43 2.35 -1.19 -0.91 115.58 115.69 3gff h ASN 219 Ca 0.17 -0.23 -0.06 0.00 -0.55 0.00 0.00 56.30 55.63 3gff h ASN 219 Cb 0.05 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.28 3gff h ASN 219 CO -0.10 0.56 0.15 -0.07 -1.65 0.00 0.00 177.43 176.32 3gff h LEU 220 N 0.32 0.92 -0.64 1.61 3.38 -1.17 -0.78 115.31 118.95 3gff h LEU 220 Ca 0.09 -0.23 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 3gff h LEU 220 Cb 0.29 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3gff h LEU 220 CO 0.00 0.92 -0.08 0.00 0.09 0.00 0.00 178.44 179.37 3gff h ALA 221 N 1.04 0.84 -0.12 1.53 0.00 -1.00 -1.27 119.26 120.28 3gff h ALA 221 Ca 0.19 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 3gff h ALA 221 Cb 0.35 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3gff h ALA 221 CO 0.00 0.66 -0.10 0.35 0.00 0.00 0.00 179.25 180.16 3gff h PHE 222 N 0.89 0.33 -0.95 0.00 3.57 -1.04 -1.18 116.94 118.56 3gff h PHE 222 Ca 0.15 -0.10 0.06 0.00 3.53 0.00 0.00 57.97 61.61 3gff h PHE 222 Cb 0.63 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.23 3gff h PHE 222 CO 0.04 0.68 0.61 0.00 -2.23 0.00 0.00 178.31 177.41 3gff h ALA 223 N 0.60 1.30 -0.28 2.41 0.00 -1.12 -0.07 119.26 122.12 3gff h ALA 223 Ca 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 3gff h ALA 223 Cb 0.61 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3gff h ALA 223 CO 0.03 0.40 0.12 0.22 0.00 0.00 0.00 179.25 180.03 3gff h ASP 224 N 1.12 0.37 -0.59 0.00 3.58 -1.08 -1.67 116.42 118.15 3gff h ASP 224 Ca 0.40 -0.14 -0.00 0.00 0.42 0.00 0.00 57.03 57.71 3gff h ASP 224 Cb 0.14 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.06 3gff h ASP 224 CO -0.16 0.41 0.36 0.50 -2.88 0.00 0.00 179.24 177.46 3gff h LYS 225 N 0.31 0.80 -0.22 0.28 3.64 -0.67 0.12 116.57 120.84 3gff h LYS 225 Ca 0.09 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 3gff h LYS 225 Cb 0.14 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.77 3gff h LYS 225 CO -0.01 0.58 0.06 -0.07 -2.27 0.00 0.00 179.45 177.74 3gff h LEU 226 N 0.80 0.06 -0.52 5.20 3.38 -0.80 0.52 115.31 123.93 3gff h LEU 226 Ca 0.21 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.22 3gff h LEU 226 Cb -0.02 0.02 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 3gff h LEU 226 CO -0.04 0.06 0.34 0.74 0.09 0.00 0.00 178.44 179.63 3gff h THR 227 N 0.16 1.11 -0.43 0.22 2.02 -1.07 0.24 112.91 115.17 3gff h THR 227 Ca 0.09 -0.24 -0.12 0.00 0.77 0.00 0.00 66.41 66.92 3gff h THR 227 Cb 0.07 0.37 -0.01 0.00 -1.74 0.00 0.00 68.15 66.83 3gff h THR 227 CO -0.11 0.13 -0.20 0.50 0.37 0.00 0.00 175.52 176.21 3gff h LYS 228 N 0.69 0.84 0.00 6.66 3.64 -0.30 -3.07 116.57 125.04 3gff h LYS 228 Ca 0.20 -0.34 -0.08 0.00 -1.27 0.00 0.00 60.65 59.16 3gff h LYS 228 Cb -0.06 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 3gff h LYS 228 CO -0.06 0.97 -0.49 -0.07 -2.27 0.00 0.00 179.45 177.54 3gff h LEU 229 N 0.74 0.00 -3.69 5.20 4.07 -0.76 -3.49 115.31 117.38 3gff h LEU 229 Ca 0.10 0.00 -0.45 0.00 0.08 0.00 0.00 57.88 57.62 3gff h LEU 229 Cb 0.73 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.46 3gff h LEU 229 CO 0.06 0.38 -0.83 0.00 -1.08 0.00 0.00 178.44 176.96 3gff n ALA 230 N -2.21 -2.33 -1.68 1.53 0.00 0.84 -4.80 120.51 111.85 3gff n ALA 230 Ca 0.01 -0.38 -0.39 0.00 0.00 0.00 0.00 53.44 52.68 3gff n ALA 230 Cb 0.69 -1.44 0.04 0.00 0.00 0.00 0.00 19.45 18.73 3gff n ALA 230 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3gff n PRO 231 N -3.44 1.48 -2.02 0.00 -0.04 -1.26 -4.93 135.00 124.80 3gff n PRO 231 Ca -0.15 0.54 -0.39 0.00 -0.04 0.00 0.00 63.50 63.46 3gff n PRO 231 Cb 0.48 -2.36 0.00 0.00 -0.04 0.00 0.00 33.50 31.59 3gff n PRO 231 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3gff s LYS 232 N -2.60 3.77 0.00 0.54 2.20 -1.26 -3.41 119.74 118.97 3gff s LYS 232 Ca 0.70 2.13 0.00 0.00 -0.36 0.00 0.00 55.97 58.43 3gff s LYS 232 Cb -0.45 -2.60 0.00 0.00 -1.51 0.00 0.00 37.83 33.26 3gff s LYS 232 CO 0.51 -0.65 0.00 0.41 -0.36 0.00 0.00 175.35 175.26 3gff n GLY 233 N 0.63 0.65 3.10 5.54 0.00 -1.26 -1.54 105.19 112.31 3gff n GLY 233 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3gff n GLY 233 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gff s LEU 234 N 0.00 2.41 -0.21 0.99 2.96 -1.22 -1.23 118.68 122.38 3gff s LEU 234 Ca 0.00 -0.82 -0.26 0.00 -0.22 0.00 0.00 54.13 52.83 3gff s LEU 234 Cb 0.00 -1.48 -0.00 0.00 0.50 0.00 0.00 46.19 45.21 3gff s LEU 234 CO 0.00 -0.05 0.89 -0.83 -1.32 0.00 0.00 176.35 175.04 3gff s GLY 235 N 1.26 1.86 0.38 7.98 0.00 -0.10 -4.84 107.32 113.86 3gff s GLY 235 Ca 0.02 0.01 0.04 0.00 0.00 0.00 0.00 44.72 44.78 3gff s GLY 235 CO -0.11 1.87 0.06 -0.12 0.00 0.00 0.00 173.10 174.80 3gff s PHE 236 N 2.70 1.98 -0.22 1.90 5.36 -1.26 0.36 117.98 128.80 3gff s PHE 236 Ca 0.39 -1.01 -0.29 0.00 -0.96 0.00 0.00 56.93 55.06 3gff s PHE 236 Cb -0.16 -1.36 0.14 0.00 -0.34 0.00 0.00 43.02 41.31 3gff s PHE 236 CO 0.09 0.02 1.11 0.00 -1.46 0.00 0.00 175.22 174.98 3gff s ALA 238 N -3.14 -2.00 -0.04 11.12 0.00 -1.26 -4.99 121.76 121.45 3gff s ALA 238 Ca 0.29 1.71 0.01 0.00 0.00 0.00 0.00 51.96 53.97 3gff s ALA 238 Cb 0.06 -1.10 0.02 0.00 0.00 0.00 0.00 23.12 22.10 3gff s ALA 238 CO 0.14 -0.26 -0.05 0.21 0.00 0.00 0.00 175.76 175.80 3gff s LYS 239 N -0.74 0.81 -0.14 0.00 2.20 -1.26 -5.03 119.74 115.58 3gff s LYS 239 Ca 0.02 -0.11 -0.13 0.00 -0.36 0.00 0.00 55.97 55.39 3gff s LYS 239 Cb -0.02 -0.81 -0.05 0.00 -1.51 0.00 0.00 37.83 35.44 3gff s LYS 239 CO -0.03 -0.07 0.28 -0.47 -0.36 0.00 0.00 175.35 174.70 3gff s TYR 240 N 0.84 3.50 -0.46 4.03 5.04 -1.26 -0.35 117.35 128.70 3gff s TYR 240 Ca -0.11 0.62 0.01 0.00 -2.44 0.00 0.00 57.07 55.15 3gff s TYR 240 Cb -0.14 -2.29 0.12 0.00 0.35 0.00 0.00 41.96 40.01 3gff s TYR 240 CO 0.00 0.34 0.22 0.71 -1.34 0.00 0.00 175.55 175.48 3gff s TYR 241 N 0.14 3.49 -0.04 4.97 1.51 0.89 -4.96 117.35 123.35 3gff s TYR 241 Ca 0.17 -2.89 0.31 0.00 -1.01 0.00 0.00 57.07 53.64 3gff s TYR 241 Cb -0.13 -3.00 1.36 0.00 -0.11 0.00 0.00 41.96 40.07 3gff s TYR 241 CO 0.05 -0.87 1.92 -1.00 -1.11 0.00 0.00 175.55 174.54 3gff h PRO 242 N 7.24 0.00 -0.51 -1.71 0.13 -1.93 -2.90 132.00 132.33 3gff h PRO 242 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 3gff h PRO 242 Cb 0.97 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.10 3gff h PRO 242 CO 0.64 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.80 3gff n GLU 243 N -2.76 3.86 -4.41 0.86 -0.58 -1.26 -4.61 120.64 111.74 3gff n GLU 243 Ca 0.01 -2.91 -0.25 0.00 -0.42 0.00 0.00 57.16 53.59 3gff n GLU 243 Cb 0.24 -1.95 -0.10 0.00 -0.57 0.00 0.00 31.44 29.05 3gff n GLU 243 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 3gff s GLU 244 N -2.31 1.77 0.52 3.49 0.41 -1.10 -5.03 118.70 116.44 3gff s GLU 244 Ca 0.48 -1.59 0.06 0.00 -0.41 0.00 0.00 54.97 53.52 3gff s GLU 244 Cb 0.34 -1.90 0.03 0.00 -1.78 0.00 0.00 34.13 30.82 3gff s GLU 244 CO 0.17 0.37 0.43 0.95 -0.49 0.00 0.00 175.26 176.69 3gff s THR 245 N -2.14 1.94 0.17 3.63 -4.23 -1.26 -1.60 115.64 112.15 3gff s THR 245 Ca 0.27 -1.42 -0.16 0.00 -1.18 0.00 0.00 61.69 59.20 3gff s THR 245 Cb -0.06 -2.36 0.12 0.00 1.34 0.00 0.00 72.50 71.54 3gff s THR 245 CO 0.14 0.00 1.66 -0.74 -0.54 0.00 0.00 174.62 175.15 3gff h HIS 246 N 0.77 -0.21 0.22 3.99 -0.00 -1.93 -2.14 115.15 115.86 3gff h HIS 246 Ca -0.37 0.04 -0.29 0.00 -0.00 0.00 0.00 60.37 59.75 3gff h HIS 246 Cb 1.29 0.16 0.03 0.00 -0.00 0.00 0.00 27.41 28.90 3gff h HIS 246 CO 0.81 -0.18 -1.26 1.96 -0.00 0.00 0.00 177.93 179.26 3gff h GLN 247 N 0.01 0.47 0.00 5.26 1.08 -1.98 -3.32 115.11 116.63 3gff h GLN 247 Ca 0.22 -0.80 0.00 0.00 -1.45 0.00 0.00 58.65 56.62 3gff h GLN 247 Cb 0.33 0.30 0.00 0.00 -0.05 0.00 0.00 27.48 28.05 3gff h GLN 247 CO -0.45 1.38 0.00 0.66 -0.95 0.00 0.00 178.83 179.48 3gff h SER 248 N -0.02 0.00 1.31 1.46 4.64 -1.92 -3.13 113.55 115.89 3gff h SER 248 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 3gff h SER 248 Cb 2.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.09 3gff h SER 248 CO 0.24 0.00 0.00 0.55 -0.87 0.00 0.00 176.83 176.75 3gff n VAL 249 N -2.56 0.67 -0.26 0.95 3.14 -0.82 -3.66 118.33 115.78 3gff n VAL 249 Ca 0.00 -0.17 0.07 0.00 -2.96 0.00 0.00 64.34 61.29 3gff n VAL 249 Cb 0.18 -0.73 0.32 0.00 -1.06 0.00 0.00 33.84 32.55 3gff n VAL 249 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 3gff h SER 250 N 0.00 0.76 0.23 6.55 4.64 -1.77 0.26 113.55 124.22 3gff h SER 250 Ca 0.00 0.02 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 3gff h SER 250 Cb 0.66 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3gff h SER 250 CO 0.00 0.45 -0.11 -0.74 -0.87 0.00 0.00 176.83 175.57 3gff h HIS 251 N 0.84 -0.28 -0.43 4.77 2.76 -1.84 -2.61 115.15 118.36 3gff h HIS 251 Ca 0.39 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.52 3gff h HIS 251 Cb 0.39 0.09 -0.02 0.00 1.55 0.00 0.00 27.41 29.43 3gff h HIS 251 CO -0.00 -0.18 0.12 0.97 -1.30 0.00 0.00 177.93 177.54 3gff h ILE 252 N -0.94 1.19 -0.54 6.26 6.09 -1.73 -0.71 117.51 127.13 3gff h ILE 252 Ca -0.03 -0.64 -0.00 0.00 -1.37 0.00 0.00 64.86 62.81 3gff h ILE 252 Cb 0.23 0.73 -0.03 0.00 0.47 0.00 0.00 36.82 38.23 3gff h ILE 252 CO 0.05 0.24 0.32 1.23 -3.07 0.00 0.00 178.15 176.92 3gff h GLY 253 N 0.83 0.78 0.99 8.18 0.00 -0.61 -1.66 103.07 111.58 3gff h GLY 253 Ca 0.14 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.10 3gff h GLY 253 CO -0.01 0.32 0.18 -2.00 0.00 0.00 0.00 176.54 175.03 3gff h LEU 254 N 0.72 0.81 0.04 3.11 5.85 -1.07 -0.65 115.31 124.12 3gff h LEU 254 Ca 0.19 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.73 3gff h LEU 254 Cb -0.00 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 40.76 3gff h LEU 254 CO -0.04 0.80 -0.47 0.22 -0.34 0.00 0.00 178.44 178.62 3gff h TYR 255 N 0.78 -1.34 -0.38 1.25 5.03 -0.47 0.53 116.97 122.38 3gff h TYR 255 Ca 0.18 0.04 -0.15 0.00 2.58 0.00 0.00 58.73 61.38 3gff h TYR 255 Cb 0.28 0.58 -0.01 0.00 1.55 0.00 0.00 36.73 39.13 3gff h TYR 255 CO 0.02 -0.54 -0.35 -0.44 -1.32 0.00 0.00 178.16 175.53 3gff h ASP 256 N -0.65 0.92 -0.51 -2.11 3.32 -1.37 -2.20 116.42 113.83 3gff h ASP 256 Ca 0.03 -0.40 -0.10 0.00 0.02 0.00 0.00 57.03 56.58 3gff h ASP 256 Cb 0.70 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 3gff h ASP 256 CO -0.31 1.18 -0.07 1.23 -1.72 0.00 0.00 179.24 179.55 3gff h GLY 257 N 0.86 1.02 1.56 2.75 0.00 -0.82 -1.37 103.07 107.08 3gff h GLY 257 Ca 0.07 -0.80 -0.26 0.00 0.00 0.00 0.00 47.33 46.34 3gff h GLY 257 CO 0.09 0.74 -1.14 1.19 0.00 0.00 0.00 176.54 177.42 3gff h ILE 258 N 0.81 1.44 -0.63 2.60 6.09 -0.93 -1.07 117.51 125.82 3gff h ILE 258 Ca 0.14 -2.77 -0.08 0.00 -1.37 0.00 0.00 64.86 60.78 3gff h ILE 258 Cb 0.61 2.73 -0.02 0.00 0.47 0.00 0.00 36.82 40.61 3gff h ILE 258 CO 0.04 0.82 0.07 0.03 -3.07 0.00 0.00 178.15 176.04 3gff h ARG 259 N 0.15 1.07 0.24 2.19 3.08 -1.42 -2.44 114.38 117.24 3gff h ARG 259 Ca -0.12 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.61 3gff h ARG 259 Cb 1.82 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 31.76 3gff h ARG 259 CO 0.19 1.00 -0.12 1.25 -1.07 0.00 0.00 179.97 181.23 3gff h HIS 260 N 0.98 -0.30 -0.54 3.04 2.76 -1.23 -1.19 115.15 118.68 3gff h HIS 260 Ca 0.19 -0.01 0.11 0.00 -2.20 0.00 0.00 60.37 58.46 3gff h HIS 260 Cb 0.47 0.10 -0.10 0.00 1.55 0.00 0.00 27.41 29.43 3gff h HIS 260 CO 0.03 -0.07 -0.16 1.25 -1.30 0.00 0.00 177.93 177.68 3gff h LEU 261 N -0.49 -0.59 -3.58 0.26 5.85 -1.09 -2.24 115.31 113.44 3gff h LEU 261 Ca -0.03 0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.77 3gff h LEU 261 Cb 0.37 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.71 3gff h LEU 261 CO 0.05 -0.20 0.11 0.49 -0.34 0.00 0.00 178.44 178.55 3gff n PHE 262 N -5.40 2.21 0.14 1.25 3.72 -0.93 -4.62 117.46 113.83 3gff n PHE 262 Ca 0.05 -0.89 0.01 0.00 -0.05 0.00 0.00 57.45 56.57 3gff n PHE 262 Cb 0.30 -0.58 0.34 0.00 -0.94 0.00 0.00 39.48 38.60 3gff n PHE 262 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 3gff h LYS 263 N 3.43 0.14 -0.04 -1.08 2.10 -0.57 -2.90 116.57 117.65 3gff h LYS 263 Ca 0.10 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.70 3gff h LYS 263 Cb 2.10 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 33.42 3gff h LYS 263 CO 0.58 0.43 0.00 -0.25 -2.00 0.00 0.00 179.45 178.21 3gff n ASP 264 N -4.15 1.09 0.19 7.07 8.00 -1.26 -3.64 116.55 123.85 3gff n ASP 264 Ca -0.01 -1.44 0.12 0.00 0.71 0.00 0.00 54.79 54.17 3gff n ASP 264 Cb 0.37 -0.02 0.16 0.00 -0.02 0.00 0.00 41.12 41.61 3gff n ASP 264 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 3gff h PHE 265 N 1.63 0.00 -3.95 1.24 -1.00 -1.86 -3.46 116.94 109.53 3gff h PHE 265 Ca 0.00 0.00 -0.53 0.00 2.81 0.00 0.00 57.97 60.25 3gff h PHE 265 Cb 0.35 0.00 0.09 0.00 3.61 0.00 0.00 35.95 40.00 3gff h PHE 265 CO 0.02 0.00 0.67 0.00 -1.61 0.00 0.00 178.31 177.39 3gff s ALA 266 N -3.22 3.34 -0.29 2.45 0.00 -1.24 -5.01 121.76 117.79 3gff s ALA 266 Ca 0.06 1.36 -0.00 0.00 0.00 0.00 0.00 51.96 53.38 3gff s ALA 266 Cb 0.06 -3.54 0.06 0.00 0.00 0.00 0.00 23.12 19.70 3gff s ALA 266 CO 0.68 -0.95 -0.03 0.42 0.00 0.00 0.00 175.76 175.89 3gff s ILE 267 N -1.21 2.72 -0.57 0.00 1.01 -1.26 -5.08 121.20 116.80 3gff s ILE 267 Ca 0.56 -1.51 -0.24 0.00 0.00 0.00 0.00 60.65 59.47 3gff s ILE 267 Cb -0.41 -2.59 0.05 0.00 0.01 0.00 0.00 42.46 39.51 3gff s ILE 267 CO 0.54 -0.11 0.93 -0.62 0.00 0.00 0.00 174.94 175.68 3gff s ASP 268 N 1.21 6.30 0.00 3.58 2.15 -1.26 -4.92 116.67 123.73 3gff s ASP 268 Ca -0.06 -0.51 0.01 0.00 0.43 0.00 0.00 52.55 52.41 3gff s ASP 268 Cb -0.20 -2.43 0.03 0.00 -0.30 0.00 0.00 42.92 40.03 3gff s ASP 268 CO -0.03 -1.26 0.42 -0.38 -0.17 0.00 0.00 175.17 173.76 3gff n ILE 269 N 6.11 0.00 -3.10 4.11 -0.00 -1.26 -4.79 119.36 120.43 3gff n ILE 269 Ca 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 62.75 62.49 3gff n ILE 269 Cb 0.47 -0.87 -0.05 0.00 -0.00 0.00 0.00 39.64 39.18 3gff n ILE 269 CO 0.00 0.00 0.00 -1.22 -0.00 0.00 0.00 176.55 175.33 3gff n TYR 270 N -0.89 3.51 0.00 1.39 4.01 -1.26 -5.09 117.16 118.84 3gff n TYR 270 Ca 0.00 -4.01 0.00 0.00 -0.16 0.00 0.00 57.90 53.73 3gff n TYR 270 Cb 0.00 -0.50 0.00 0.00 -0.31 0.00 0.00 39.34 38.53 3gff n TYR 270 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3gff n PHE 274 N 0.14 0.00 -3.82 -0.72 7.35 -1.26 -5.27 117.46 113.87 3gff n PHE 274 Ca 0.30 0.00 -0.06 0.00 -0.76 0.00 0.00 57.45 56.93 3gff n PHE 274 Cb 0.42 0.00 -0.01 0.00 0.35 0.00 0.00 39.48 40.24 3gff n PHE 274 CO 0.00 0.00 0.00 -1.54 -0.76 0.00 0.00 176.76 174.46 3gff s SER 275 N 0.00 -0.17 0.04 -2.13 1.04 -1.26 -5.01 113.70 106.20 3gff s SER 275 Ca 0.00 -0.63 -0.27 0.00 0.48 0.00 0.00 55.95 55.53 3gff s SER 275 Cb 0.00 0.65 -0.17 0.00 0.10 0.00 0.00 66.02 66.60 3gff s SER 275 CO 0.00 -1.23 1.46 0.50 0.98 0.00 0.00 173.24 174.94 3gff h LYS 276 N 2.00 -0.47 -0.83 4.02 3.64 -2.00 -3.11 116.57 119.82 3gff h LYS 276 Ca -0.23 0.03 0.09 0.00 -1.27 0.00 0.00 60.65 59.27 3gff h LYS 276 Cb 1.24 0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 33.11 3gff h LYS 276 CO 0.27 -0.22 0.54 0.37 -2.27 0.00 0.00 179.45 178.14 3gff h GLN 277 N -0.66 0.77 -0.94 1.90 5.75 -1.99 -1.16 115.11 118.77 3gff h GLN 277 Ca -0.05 -0.05 0.09 0.00 -0.15 0.00 0.00 58.65 58.49 3gff h GLN 277 Cb 0.47 -0.17 -0.07 0.00 1.07 0.00 0.00 27.48 28.78 3gff h GLN 277 CO 0.08 0.51 0.60 0.37 -2.65 0.00 0.00 178.83 177.74 3gff h GLN 278 N 0.79 0.96 -0.13 1.69 4.15 -1.94 -0.61 115.11 120.03 3gff h GLN 278 Ca 0.38 -0.06 -0.06 0.00 0.77 0.00 0.00 58.65 59.68 3gff h GLN 278 Cb 0.42 -0.22 -0.00 0.00 0.21 0.00 0.00 27.48 27.89 3gff h GLN 278 CO -0.15 0.64 -0.16 0.28 -1.93 0.00 0.00 178.83 177.51 3gff h VAL 279 N 0.99 1.36 -0.10 2.39 2.07 -1.18 -0.47 116.25 121.31 3gff h VAL 279 Ca 0.43 -1.35 0.03 0.00 0.82 0.00 0.00 66.70 66.63 3gff h VAL 279 Cb 0.34 1.95 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 3gff h VAL 279 CO -0.19 0.39 -0.08 0.40 0.02 0.00 0.00 177.57 178.12 3gff h ILE 280 N -0.06 0.78 -0.79 4.57 2.04 -1.12 -1.16 117.51 121.75 3gff h ILE 280 Ca 0.02 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.88 3gff h ILE 280 Cb 0.70 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.52 3gff h ILE 280 CO 0.04 0.00 0.50 0.44 0.00 0.00 0.00 178.15 179.13 3gff h ASP 281 N -0.09 0.93 -0.50 1.72 3.32 -1.15 -1.34 116.42 119.32 3gff h ASP 281 Ca 0.06 -0.05 0.09 0.00 0.02 0.00 0.00 57.03 57.16 3gff h ASP 281 Cb 0.18 -0.23 -0.07 0.00 0.22 0.00 0.00 39.33 39.42 3gff h ASP 281 CO -0.15 0.70 0.08 -0.61 -1.72 0.00 0.00 179.24 177.54 3gff h GLN 282 N 1.08 0.21 0.00 3.56 4.15 -0.57 -1.67 115.11 121.87 3gff h GLN 282 Ca 0.29 -0.01 -0.06 0.00 0.77 0.00 0.00 58.65 59.63 3gff h GLN 282 Cb -0.08 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.55 3gff h GLN 282 CO -0.06 0.14 -0.30 1.88 -1.93 0.00 0.00 178.83 178.56 3gff h TYR 283 N 0.22 0.00 -0.43 3.99 -1.99 -0.95 -2.63 116.97 115.17 3gff h TYR 283 Ca 0.25 0.00 -0.05 0.00 2.00 0.00 0.00 58.73 60.93 3gff h TYR 283 Cb 0.35 0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.07 3gff h TYR 283 CO -0.24 0.30 0.07 0.78 -0.00 0.00 0.00 178.16 179.07 3gff h GLY 284 N 3.03 0.77 1.00 3.88 0.00 -0.68 0.56 103.07 111.63 3gff h GLY 284 Ca -0.00 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 46.78 3gff h GLY 284 CO 0.04 0.48 0.25 -2.08 0.00 0.00 0.00 176.54 175.22 3gff h VAL 285 N 0.57 1.23 -0.68 4.60 2.07 -1.21 -2.06 116.25 120.76 3gff h VAL 285 Ca 0.13 -0.70 -0.07 0.00 0.82 0.00 0.00 66.70 66.87 3gff h VAL 285 Cb 0.38 0.56 -0.03 0.00 -1.52 0.00 0.00 31.29 30.68 3gff h VAL 285 CO 0.01 0.28 0.14 -0.07 0.02 0.00 0.00 177.57 177.94 3gff h LEU 286 N 0.84 1.06 -1.02 2.57 3.38 -1.33 -1.65 115.31 119.16 3gff h LEU 286 Ca 0.20 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 3gff h LEU 286 Cb 0.19 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3gff h LEU 286 CO -0.02 1.04 0.55 0.28 0.09 0.00 0.00 178.44 180.38 3gff h SER 287 N 1.04 1.08 0.81 -0.43 0.02 -0.59 -0.94 113.55 114.53 3gff h SER 287 Ca 0.21 -0.06 -0.14 0.00 -0.84 0.00 0.00 61.79 60.96 3gff h SER 287 Cb 0.41 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 3gff h SER 287 CO 0.01 0.82 -0.68 -0.33 -1.14 0.00 0.00 176.83 175.51 3gff h GLU 288 N 1.24 0.00 -0.13 3.45 5.08 -1.07 -1.36 114.58 121.79 3gff h GLU 288 Ca 0.33 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.47 3gff h GLU 288 Cb -0.07 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.20 3gff h GLU 288 CO -0.06 0.68 -0.77 -0.09 -1.00 0.00 0.00 179.01 177.76 3gff h ARG 289 N 0.00 0.76 0.00 2.33 2.43 -0.86 -3.18 114.38 115.86 3gff h ARG 289 Ca -0.01 -0.64 0.00 0.00 -0.81 0.00 0.00 59.98 58.52 3gff h ARG 289 Cb 1.26 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 3gff h ARG 289 CO 0.09 1.24 -0.32 0.74 -1.51 0.00 0.00 179.97 180.21 3gff h PHE 290 N 0.48 0.00 -0.22 2.20 -1.00 -1.22 -3.40 116.94 113.78 3gff h PHE 290 Ca -0.06 0.00 -0.10 0.00 2.81 0.00 0.00 57.97 60.63 3gff h PHE 290 Cb 1.41 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.93 3gff h PHE 290 CO 0.09 0.00 -0.09 0.41 -1.61 0.00 0.00 178.31 177.12 3gff n GLY 291 N 1.26 0.72 3.26 -1.45 0.00 -0.56 -4.84 105.19 103.58 3gff n GLY 291 Ca 0.04 -0.47 -0.14 0.00 0.00 0.00 0.00 46.02 45.45 3gff n GLY 291 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3gff s HIS 292 N -2.06 -0.22 0.26 1.61 5.65 -0.89 -5.02 115.29 114.63 3gff s HIS 292 Ca 0.00 0.34 -0.30 0.00 0.25 0.00 0.00 55.06 55.35 3gff s HIS 292 Cb 0.00 0.12 -0.14 0.00 -1.18 0.00 0.00 32.58 31.38 3gff s HIS 292 CO 0.00 -0.40 1.20 1.17 -0.65 0.00 0.00 174.74 176.06 3gff n LYS 293 N 1.27 1.65 -3.91 2.88 3.00 -1.26 -4.30 118.16 117.49 3gff n LYS 293 Ca -0.21 0.58 -0.22 0.00 -0.00 0.00 0.00 58.31 58.46 3gff n LYS 293 Cb 0.56 -2.10 -0.17 0.00 0.00 0.00 0.00 35.03 33.32 3gff n LYS 293 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 3gff s VAL 294 N -0.61 0.46 0.10 3.15 1.01 -1.26 -4.93 120.40 118.33 3gff s VAL 294 Ca 0.64 0.02 0.07 0.00 0.00 0.00 0.00 61.98 62.71 3gff s VAL 294 Cb -0.69 -0.57 -0.03 0.00 0.00 0.00 0.00 36.38 35.09 3gff s VAL 294 CO 0.56 0.25 -0.19 0.42 0.00 0.00 0.00 175.10 176.14 3gff s THR 295 N 1.58 1.56 0.28 3.92 -4.23 -1.26 -4.66 115.64 112.84 3gff s THR 295 Ca -0.01 -1.53 -0.30 0.00 -1.18 0.00 0.00 61.69 58.67 3gff s THR 295 Cb -0.13 -1.47 -0.11 0.00 1.34 0.00 0.00 72.50 72.13 3gff s THR 295 CO -0.04 -0.14 1.53 -2.84 -0.54 0.00 0.00 174.62 172.59 3gff s PRO 296 N -1.99 4.18 0.08 3.99 0.02 -1.26 -4.89 135.00 135.13 3gff s PRO 296 Ca 0.05 2.47 -0.37 0.00 0.02 0.00 0.00 61.00 63.18 3gff s PRO 296 Cb -0.09 -3.05 -0.18 0.00 0.02 0.00 0.00 34.50 31.20 3gff s PRO 296 CO 0.04 -0.54 1.18 0.45 -0.33 0.00 0.00 177.00 177.80 3gff n SER 297 N 2.10 0.88 -0.33 2.53 2.88 -1.26 -4.90 113.62 115.52 3gff n SER 297 Ca 0.07 1.14 -0.03 0.00 -1.33 0.00 0.00 58.87 58.72 3gff n SER 297 Cb 0.39 -1.09 0.12 0.00 -0.75 0.00 0.00 64.21 62.87 3gff n SER 297 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 3gff h GLN 298 N 3.64 1.23 0.04 -1.46 -0.00 -1.95 -2.67 115.11 113.95 3gff h GLN 298 Ca -0.47 -0.12 -0.00 0.00 -0.00 0.00 0.00 58.65 58.06 3gff h GLN 298 Cb 1.37 -0.25 0.00 0.00 -0.00 0.00 0.00 27.48 28.60 3gff h GLN 298 CO 0.71 0.87 -0.02 1.96 -0.00 0.00 0.00 178.83 182.35 3gff h GLN 299 N 1.25 -0.06 -0.33 0.06 4.20 -2.00 -2.28 115.11 115.95 3gff h GLN 299 Ca 0.32 0.00 0.07 0.00 0.06 0.00 0.00 58.65 59.11 3gff h GLN 299 Cb -0.03 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.69 3gff h GLN 299 CO -0.06 -0.01 -0.11 -0.92 -0.67 0.00 0.00 178.83 177.06 3gff h TYR 300 N -0.08 -0.25 -0.07 2.96 3.20 -1.93 -0.56 116.97 120.23 3gff h TYR 300 Ca -0.01 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.88 3gff h TYR 300 Cb 0.07 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.50 3gff h TYR 300 CO -0.07 -0.18 -0.02 -0.07 -1.64 0.00 0.00 178.16 176.19 3gff h LEU 301 N -0.04 0.09 -0.51 2.82 3.38 -1.34 -1.78 115.31 117.93 3gff h LEU 301 Ca 0.16 -0.01 -0.16 0.00 0.09 0.00 0.00 57.88 57.97 3gff h LEU 301 Cb 0.29 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3gff h LEU 301 CO -0.36 0.13 -0.49 -0.33 0.09 0.00 0.00 178.44 177.47 3gff h GLU 302 N 0.10 0.66 0.45 1.13 4.39 -0.55 -1.93 114.58 118.83 3gff h GLU 302 Ca 0.02 -0.39 -0.02 0.00 0.34 0.00 0.00 59.36 59.32 3gff h GLU 302 Cb 0.10 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.79 3gff h GLU 302 CO 0.00 1.00 -0.22 1.96 -1.16 0.00 0.00 179.01 180.59 3gff h GLN 303 N 0.52 -0.59 -0.76 2.33 4.20 -0.91 -1.51 115.11 118.39 3gff h GLN 303 Ca 0.02 0.04 0.17 0.00 0.06 0.00 0.00 58.65 58.95 3gff h GLN 303 Cb 1.04 0.13 -0.12 0.00 0.30 0.00 0.00 27.48 28.83 3gff h GLN 303 CO 0.10 -0.29 0.11 -0.07 -0.67 0.00 0.00 178.83 178.01 3gff h LEU 304 N -0.84 -0.15 -1.73 1.46 3.38 -1.36 0.68 115.31 116.76 3gff h LEU 304 Ca -0.06 0.17 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3gff h LEU 304 Cb 0.57 0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 3gff h LEU 304 CO 0.10 -0.12 -0.17 0.40 0.09 0.00 0.00 178.44 178.74 3gff h ILE 305 N 0.18 0.89 0.17 1.22 2.04 -1.28 0.12 117.51 120.86 3gff h ILE 305 Ca 0.43 -0.65 -0.23 0.00 1.00 0.00 0.00 64.86 65.41 3gff h ILE 305 Cb 0.77 1.37 0.03 0.00 -0.74 0.00 0.00 36.82 38.24 3gff h ILE 305 CO -0.59 0.17 -1.02 -0.61 0.00 0.00 0.00 178.15 176.10 3gff h GLN 306 N 0.00 0.36 -0.08 2.37 4.15 0.97 0.55 115.11 123.43 3gff h GLN 306 Ca -0.00 -0.62 -0.02 0.00 0.77 0.00 0.00 58.65 58.77 3gff h GLN 306 Cb 0.36 0.23 -0.01 0.00 0.21 0.00 0.00 27.48 28.27 3gff h GLN 306 CO 0.02 1.30 -0.06 1.88 -1.93 0.00 0.00 178.83 180.04 3gff h TYR 307 N -0.23 0.12 0.00 3.99 0.99 0.42 0.55 116.97 122.80 3gff h TYR 307 Ca -0.18 -0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.54 3gff h TYR 307 Cb 1.79 -0.04 0.00 0.00 1.00 0.00 0.00 36.73 39.48 3gff h TYR 307 CO 0.18 0.19 -0.00 0.77 -0.00 0.00 0.00 178.16 179.29 3gff h SER 308 N 0.12 -0.00 -0.13 3.88 0.02 -0.76 -2.95 113.55 113.72 3gff h SER 308 Ca 0.03 -0.42 0.05 0.00 -0.84 0.00 0.00 61.79 60.60 3gff h SER 308 Cb 0.19 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.67 3gff h SER 308 CO 0.01 0.71 -0.33 -2.24 -1.14 0.00 0.00 176.83 173.84 3gff h ASP 309 N -1.00 -1.02 -0.04 3.07 3.04 0.22 0.98 116.42 121.66 3gff h ASP 309 Ca -0.00 0.15 -0.03 0.00 -3.24 0.00 0.00 57.03 53.90 3gff h ASP 309 Cb 0.42 0.43 -0.01 0.00 -1.04 0.00 0.00 39.33 39.13 3gff h ASP 309 CO 0.00 -0.36 -0.05 0.08 -2.04 0.00 0.00 179.24 176.87 3gff h ARG 310 N -0.40 0.24 -0.51 4.15 0.11 -0.07 -2.88 114.38 115.01 3gff h ARG 310 Ca 0.09 -0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.13 3gff h ARG 310 Cb 0.55 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.59 3gff h ARG 310 CO -0.36 0.31 0.00 1.04 0.10 0.00 0.00 179.97 181.07 3gff n GLN 311 N -4.35 4.48 -1.21 0.08 1.13 -0.72 -4.95 117.38 111.86 3gff n GLN 311 Ca -0.01 -3.10 -0.08 0.00 -1.94 0.00 0.00 57.00 51.88 3gff n GLN 311 Cb 0.21 -2.17 -0.03 0.00 0.11 0.00 0.00 30.24 28.35 3gff n GLN 311 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3gff n GLN 312 N 0.41 -1.20 -1.74 -1.09 1.13 0.23 -4.80 117.38 110.32 3gff n GLN 312 Ca 0.27 0.46 -0.34 0.00 -1.94 0.00 0.00 57.00 55.45 3gff n GLN 312 Cb 1.13 -4.58 -0.04 0.00 0.11 0.00 0.00 30.24 26.86 3gff n GLN 312 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 3gff s LEU 313 N -2.96 3.30 0.00 1.08 2.01 -0.55 -4.92 118.68 116.63 3gff s LEU 313 Ca 0.00 0.63 0.00 0.00 0.01 0.00 0.00 54.13 54.77 3gff s LEU 313 Cb 0.00 -2.52 0.00 0.00 0.01 0.00 0.00 46.19 43.68 3gff s LEU 313 CO 0.00 -2.83 0.00 1.07 1.01 0.00 0.00 176.35 175.60 3gff n THR 314 N 7.83 0.00 0.30 5.49 5.66 -1.26 -2.22 114.28 130.08 3gff n THR 314 Ca 0.33 0.00 0.17 0.00 -3.05 0.00 0.00 64.05 61.50 3gff n THR 314 Cb 0.52 0.00 0.82 0.00 -1.55 0.00 0.00 70.33 70.13 3gff n THR 314 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 3gff h GLU 315 N 0.00 0.00 -0.82 1.09 -0.00 -2.00 -3.11 114.58 109.74 3gff h GLU 315 Ca 0.00 0.00 0.20 0.00 -0.00 0.00 0.00 59.36 59.56 3gff h GLU 315 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 28.75 28.61 3gff h GLU 315 CO 0.00 0.00 0.08 0.00 -0.00 0.00 0.00 179.01 179.09 3gff h ARG 316 N 0.00 0.13 -0.32 1.06 3.08 -1.98 0.29 114.38 116.63 3gff h ARG 316 Ca 0.00 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.11 3gff h ARG 316 Cb 0.23 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 30.19 3gff h ARG 316 CO 0.00 0.09 -0.11 0.87 -1.07 0.00 0.00 179.97 179.75 3gff h LYS 317 N 0.13 -0.04 -1.70 0.04 1.79 -1.37 0.32 116.57 115.74 3gff h LYS 317 Ca 0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.94 3gff h LYS 317 Cb 0.88 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 3gff h LYS 317 CO -0.68 -0.03 0.00 0.00 -1.08 0.00 0.00 179.45 177.66 3gff n GLN 318 N -5.29 0.42 0.00 3.15 0.00 0.10 -1.53 117.38 114.23 3gff n GLN 318 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.01 3gff n GLN 318 Cb 0.21 -1.29 0.00 0.00 0.00 0.00 0.00 30.24 29.16 3gff n GLN 318 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 3gff n LEU 320 N 1.07 0.00 0.15 2.61 4.77 0.10 -1.88 117.00 123.82 3gff n LEU 320 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 3gff n LEU 320 Cb 0.21 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.22 3gff n LEU 320 CO 0.00 0.00 0.72 -0.33 -1.33 0.00 0.00 177.39 176.45 3gff h GLU 321 N 0.00 -0.32 -0.84 3.23 3.07 -1.52 0.33 114.58 118.53 3gff h GLU 321 Ca 0.00 0.02 0.01 0.00 -0.50 0.00 0.00 59.36 58.89 3gff h GLU 321 Cb 0.00 0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 27.94 3gff h GLU 321 CO 0.00 -0.13 0.56 0.78 -1.40 0.00 0.00 179.01 178.82 3gff h GLY 322 N -0.45 1.19 1.34 -3.84 0.00 -1.67 0.21 103.07 99.86 3gff h GLY 322 Ca -0.03 -0.44 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 3gff h GLY 322 CO 0.06 0.42 0.30 -2.00 0.00 0.00 0.00 176.54 175.32 3gff h LEU 323 N 1.13 0.77 -0.27 3.11 5.85 -1.80 1.40 115.31 125.50 3gff h LEU 323 Ca 0.31 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.89 3gff h LEU 323 Cb -0.11 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.72 3gff h LEU 323 CO -0.07 0.65 -0.10 0.03 -0.34 0.00 0.00 178.44 178.60 3gff h ARG 324 N 0.86 0.55 -0.47 1.25 -0.00 0.02 -2.81 114.38 113.77 3gff h ARG 324 Ca 0.21 -0.23 -0.04 0.00 -0.50 0.00 0.00 59.98 59.42 3gff h ARG 324 Cb 0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 29.97 30.00 3gff h ARG 324 CO -0.03 0.78 0.11 -0.56 0.00 0.00 0.00 179.97 180.26 3gff h GLN 325 N 0.29 0.72 0.35 0.04 -0.00 0.94 -2.32 115.11 115.13 3gff h GLN 325 Ca 0.06 -0.14 -0.00 0.00 -0.00 0.00 0.00 58.65 58.57 3gff h GLN 325 Cb 0.60 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.48 27.95 3gff h GLN 325 CO 0.03 0.66 -0.31 1.25 -0.00 0.00 0.00 178.83 180.46 3gff h HIS 326 N 0.69 -0.84 -0.06 0.06 6.17 0.20 -2.68 115.15 118.69 3gff h HIS 326 Ca 0.16 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.24 3gff h HIS 326 Cb 0.27 0.32 0.00 0.00 2.52 0.00 0.00 27.41 30.52 3gff h HIS 326 CO 0.01 -0.45 0.00 1.19 0.71 0.00 0.00 177.93 179.39 3gff n PHE 327 N -5.43 0.08 1.76 5.26 3.72 -1.08 -5.09 117.46 116.68 3gff n PHE 327 Ca -0.10 -0.04 0.14 0.00 -0.05 0.00 0.00 57.45 57.40 3gff n PHE 327 Cb 0.34 0.00 0.84 0.00 -0.94 0.00 0.00 39.48 39.71 3gff n PHE 327 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71