#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p9a h PRO 2 N 0.00 0.36 -0.23 -0.41 0.11 -2.02 -3.31 132.00 126.50 1p9a h PRO 2 Ca 0.00 -0.27 -0.16 0.00 0.11 0.00 0.00 66.00 65.67 1p9a h PRO 2 Cb 0.00 0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.16 1p9a h PRO 2 CO 0.00 0.90 -0.49 0.82 -0.21 0.00 0.00 178.00 179.02 1p9a h ILE 3 N 0.26 1.30 -2.04 4.15 2.04 -1.99 -3.46 117.51 117.77 1p9a h ILE 3 Ca -0.02 -1.70 -0.55 0.00 1.00 0.00 0.00 64.86 63.59 1p9a h ILE 3 Cb 1.22 1.78 -0.09 0.00 -0.74 0.00 0.00 36.82 39.00 1p9a h ILE 3 CO 0.11 0.54 -0.59 0.00 0.00 0.00 0.00 178.15 178.21 1p9a s GLU 5 N -3.76 4.45 -0.04 0.00 2.56 0.06 -4.64 118.70 117.35 1p9a s GLU 5 Ca 0.34 0.96 0.07 0.00 0.00 0.00 0.00 54.97 56.35 1p9a s GLU 5 Cb -0.04 -3.42 -0.01 0.00 2.00 0.00 0.00 34.13 32.66 1p9a s GLU 5 CO 0.21 0.14 -0.25 0.08 -0.56 0.00 0.00 175.26 174.88 1p9a s VAL 6 N 0.50 1.97 -0.06 3.70 1.01 -1.26 0.83 120.40 127.10 1p9a s VAL 6 Ca 0.38 -1.05 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 1p9a s VAL 6 Cb -0.19 -1.65 0.03 0.00 0.00 0.00 0.00 36.38 34.57 1p9a s VAL 6 CO 0.20 0.55 -0.01 -0.94 0.00 0.00 0.00 175.10 174.91 1p9a s SER 7 N -0.38 1.30 0.00 3.32 1.04 -0.47 -5.01 113.70 113.50 1p9a s SER 7 Ca 0.03 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.38 1p9a s SER 7 Cb -0.11 -0.42 0.00 0.00 0.10 0.00 0.00 66.02 65.59 1p9a s SER 7 CO 0.01 -0.15 0.00 1.17 0.98 0.00 0.00 173.24 175.25 1p9a n LYS 8 N 4.77 3.85 -0.00 4.02 4.81 -1.26 -1.32 118.16 133.02 1p9a n LYS 8 Ca -0.14 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.30 1p9a n LYS 8 Cb 0.50 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.55 1p9a n LYS 8 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 1p9a n VAL 9 N 0.00 -0.75 0.00 3.15 0.31 -1.25 -4.85 118.33 114.94 1p9a n VAL 9 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1p9a n VAL 9 Cb 0.00 -0.75 0.00 0.00 -0.91 0.00 0.00 33.84 32.18 1p9a n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1p9a n ALA 10 N 0.39 0.00 0.00 3.52 0.00 -1.26 -3.38 120.51 119.78 1p9a n ALA 10 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1p9a n ALA 10 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1p9a n ALA 10 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1p9a n SER 11 N 2.67 0.00 -0.27 0.00 2.88 -1.26 -4.80 113.62 112.84 1p9a n SER 11 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1p9a n SER 11 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1p9a n SER 11 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1p9a n HIS 12 N -2.48 -0.00 -4.05 0.66 -0.00 -1.22 -5.13 115.22 103.01 1p9a n HIS 12 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.72 57.39 1p9a n HIS 12 Cb 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 29.99 29.84 1p9a n HIS 12 CO 0.00 0.00 0.00 -1.17 -0.00 0.00 0.00 176.34 175.17 1p9a s LEU 13 N 0.00 3.36 -0.21 2.39 2.96 -1.26 -3.86 118.68 122.06 1p9a s LEU 13 Ca 0.00 -1.28 -0.08 0.00 -0.22 0.00 0.00 54.13 52.55 1p9a s LEU 13 Cb 0.00 -1.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.08 1p9a s LEU 13 CO 0.00 -0.18 0.08 -0.70 -1.32 0.00 0.00 176.35 174.23 1p9a s GLU 14 N 1.15 3.89 -0.22 1.98 2.12 -0.44 -1.29 118.70 125.89 1p9a s GLU 14 Ca -0.07 -0.38 -0.04 0.00 0.36 0.00 0.00 54.97 54.85 1p9a s GLU 14 Cb -0.19 -3.30 -0.01 0.00 0.26 0.00 0.00 34.13 30.89 1p9a s GLU 14 CO -0.05 0.10 -0.03 0.08 -0.54 0.00 0.00 175.26 174.81 1p9a s VAL 15 N 0.87 3.44 -0.41 3.70 1.01 0.15 -1.37 120.40 127.78 1p9a s VAL 15 Ca 0.04 -0.47 -0.13 0.00 0.00 0.00 0.00 61.98 61.42 1p9a s VAL 15 Cb -0.14 -2.57 0.04 0.00 0.00 0.00 0.00 36.38 33.72 1p9a s VAL 15 CO 0.03 0.41 0.29 0.21 0.00 0.00 0.00 175.10 176.04 1p9a s ASN 16 N 1.49 5.92 -0.23 3.32 3.84 0.24 -0.98 114.94 128.54 1p9a s ASN 16 Ca 0.06 -1.13 0.13 0.00 0.21 0.00 0.00 52.86 52.12 1p9a s ASN 16 Cb -0.14 -2.09 0.48 0.00 -0.55 0.00 0.00 41.25 38.94 1p9a s ASN 16 CO -0.03 -0.49 1.39 0.00 -2.79 0.00 0.00 177.10 175.18 1p9a s ASP 18 N -2.44 5.90 -1.29 0.00 -0.00 -1.22 -4.09 116.67 113.52 1p9a s ASP 18 Ca 0.42 2.37 -0.06 0.00 -0.00 0.00 0.00 52.55 55.28 1p9a s ASP 18 Cb 0.37 -2.61 -0.00 0.00 -0.00 0.00 0.00 42.92 40.68 1p9a s ASP 18 CO 0.03 -1.11 0.63 0.29 -0.00 0.00 0.00 175.17 175.00 1p9a n LYS 19 N -0.75 -3.20 -0.55 8.23 4.76 -0.62 -4.92 118.16 121.11 1p9a n LYS 19 Ca 0.09 0.50 0.06 0.00 -2.87 0.00 0.00 58.31 56.09 1p9a n LYS 19 Cb 0.48 -4.66 0.12 0.00 -1.84 0.00 0.00 35.03 29.13 1p9a n LYS 19 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1p9a n ARG 20 N -4.26 0.98 -1.84 1.97 1.74 -1.26 -4.97 116.66 109.03 1p9a n ARG 20 Ca -0.24 -2.49 -0.12 0.00 -0.77 0.00 0.00 57.85 54.22 1p9a n ARG 20 Cb 0.66 -1.15 -0.03 0.00 -1.02 0.00 0.00 32.46 30.92 1p9a n ARG 20 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1p9a n ASN 21 N -0.80 -3.56 -4.76 0.55 3.02 -1.26 -4.90 115.26 103.55 1p9a n ASN 21 Ca 0.13 0.26 -0.41 0.00 -0.03 0.00 0.00 54.58 54.53 1p9a n ASN 21 Cb 0.75 -3.20 -0.03 0.00 -0.61 0.00 0.00 39.78 36.69 1p9a n ASN 21 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1p9a s LEU 22 N -4.51 4.45 0.00 3.41 1.43 -1.26 -4.69 118.68 117.51 1p9a s LEU 22 Ca 0.00 2.55 0.09 0.00 -1.03 0.00 0.00 54.13 55.74 1p9a s LEU 22 Cb 0.00 -3.64 0.02 0.00 0.03 0.00 0.00 46.19 42.60 1p9a s LEU 22 CO 0.00 -0.45 0.64 0.35 0.23 0.00 0.00 176.35 177.12 1p9a n THR 23 N 1.21 0.00 -3.82 5.49 -2.24 -1.26 -0.82 114.28 112.84 1p9a n THR 23 Ca 0.01 -0.44 -0.06 0.00 -2.27 0.00 0.00 64.05 61.30 1p9a n THR 23 Cb 0.43 1.13 -0.01 0.00 -2.10 0.00 0.00 70.33 69.77 1p9a n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p9a s ALA 24 N -1.10 -1.35 0.10 6.98 0.00 -1.26 -4.70 121.76 120.43 1p9a s ALA 24 Ca 0.08 -0.20 -0.31 0.00 0.00 0.00 0.00 51.96 51.53 1p9a s ALA 24 Cb 0.07 0.75 -0.08 0.00 0.00 0.00 0.00 23.12 23.86 1p9a s ALA 24 CO 0.19 -1.04 1.54 -1.17 0.00 0.00 0.00 175.76 175.28 1p9a s LEU 25 N -2.97 4.36 0.09 0.00 2.96 -1.26 -4.94 118.68 116.92 1p9a s LEU 25 Ca 0.13 2.45 -0.31 0.00 -0.22 0.00 0.00 54.13 56.17 1p9a s LEU 25 Cb -0.04 -3.58 -0.09 0.00 0.50 0.00 0.00 46.19 42.98 1p9a s LEU 25 CO 0.06 -0.80 1.64 -2.84 -1.32 0.00 0.00 176.35 173.09 1p9a s PRO 26 N 1.81 4.20 0.07 0.98 0.02 -1.26 -4.85 135.00 135.96 1p9a s PRO 26 Ca 0.69 2.35 0.11 0.00 0.02 0.00 0.00 61.00 64.17 1p9a s PRO 26 Cb -0.39 -3.50 0.49 0.00 0.02 0.00 0.00 34.50 31.11 1p9a s PRO 26 CO 0.31 -0.71 1.33 -0.35 -0.33 0.00 0.00 177.00 177.25 1p9a n PRO 27 N 5.25 0.04 -3.47 5.54 -0.04 -1.26 -4.03 135.00 137.03 1p9a n PRO 27 Ca 0.15 0.42 -0.41 0.00 -0.04 0.00 0.00 63.50 63.62 1p9a n PRO 27 Cb 0.40 -1.61 -0.03 0.00 -0.04 0.00 0.00 33.50 32.22 1p9a n PRO 27 CO 0.00 0.00 0.00 0.16 -0.04 0.00 0.00 175.50 175.62 1p9a s ASP 28 N -3.29 6.62 -0.00 3.54 1.47 -1.26 -5.02 116.67 118.73 1p9a s ASP 28 Ca 0.03 -3.47 0.01 0.00 1.18 0.00 0.00 52.55 50.30 1p9a s ASP 28 Cb 0.05 -2.08 -0.00 0.00 -0.34 0.00 0.00 42.92 40.55 1p9a s ASP 28 CO 0.16 -0.29 -0.04 -0.76 0.68 0.00 0.00 175.17 174.92 1p9a s LEU 29 N -1.01 1.97 -0.03 2.11 1.43 -1.26 -1.47 118.68 120.42 1p9a s LEU 29 Ca 0.27 -0.08 -0.36 0.00 -1.03 0.00 0.00 54.13 52.93 1p9a s LEU 29 Cb -0.10 -0.22 -0.14 0.00 0.03 0.00 0.00 46.19 45.76 1p9a s LEU 29 CO -0.09 0.04 1.65 -2.65 0.23 0.00 0.00 176.35 175.53 1p9a n PRO 30 N 3.03 1.69 0.32 1.29 -0.02 -1.26 -4.83 135.00 135.23 1p9a n PRO 30 Ca -0.13 0.61 0.20 0.00 -2.02 0.00 0.00 63.50 62.16 1p9a n PRO 30 Cb 0.58 -2.36 1.09 0.00 -0.02 0.00 0.00 33.50 32.80 1p9a n PRO 30 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1p9a h LYS 31 N 6.83 0.00 -0.65 -0.52 1.79 -1.99 -1.93 116.57 120.10 1p9a h LYS 31 Ca -0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 1p9a h LYS 31 Cb 1.29 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.94 1p9a h LYS 31 CO 0.90 0.01 0.00 -0.25 -1.08 0.00 0.00 179.45 179.02 1p9a n ASP 32 N -3.27 4.66 -4.68 0.86 8.00 -1.26 -4.20 116.55 116.66 1p9a n ASP 32 Ca -0.03 -2.46 -0.45 0.00 0.71 0.00 0.00 54.79 52.56 1p9a n ASP 32 Cb 0.10 -0.58 -0.03 0.00 -0.02 0.00 0.00 41.12 40.59 1p9a n ASP 32 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1p9a n THR 33 N 1.04 0.35 -0.06 -3.53 -1.04 -0.73 -4.69 114.28 105.63 1p9a n THR 33 Ca 0.25 -0.09 -0.05 0.00 -2.04 0.00 0.00 64.05 62.12 1p9a n THR 33 Cb 0.88 -1.58 -0.11 0.00 -1.82 0.00 0.00 70.33 67.71 1p9a n THR 33 CO 0.00 0.00 0.00 0.35 -0.64 0.00 0.00 175.07 174.78 1p9a n THR 34 N 2.92 0.81 -4.27 12.58 -2.24 -0.41 -2.62 114.28 121.05 1p9a n THR 34 Ca 0.15 -0.55 -0.24 0.00 -2.27 0.00 0.00 64.05 61.15 1p9a n THR 34 Cb 0.30 -0.53 -0.17 0.00 -2.10 0.00 0.00 70.33 67.84 1p9a n THR 34 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1p9a s ILE 35 N -2.42 0.90 -0.11 2.28 1.01 -1.00 -0.26 121.20 121.59 1p9a s ILE 35 Ca -0.07 -0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.29 1p9a s ILE 35 Cb 0.05 -0.88 0.02 0.00 0.01 0.00 0.00 42.46 41.66 1p9a s ILE 35 CO 0.56 0.32 -0.14 -0.22 0.00 0.00 0.00 174.94 175.47 1p9a s LEU 36 N 1.04 1.62 -0.25 2.97 2.96 -0.30 -0.67 118.68 126.05 1p9a s LEU 36 Ca -0.08 -0.40 -0.07 0.00 -0.22 0.00 0.00 54.13 53.35 1p9a s LEU 36 Cb -0.14 -1.04 -0.03 0.00 0.50 0.00 0.00 46.19 45.48 1p9a s LEU 36 CO -0.00 -0.02 0.07 -1.00 -1.32 0.00 0.00 176.35 174.08 1p9a s HIS 37 N 1.15 3.09 -0.12 5.38 3.76 -0.15 -1.39 115.29 127.00 1p9a s HIS 37 Ca -0.04 -0.42 0.14 0.00 -0.15 0.00 0.00 55.06 54.60 1p9a s HIS 37 Cb -0.14 -2.24 0.31 0.00 1.11 0.00 0.00 32.58 31.62 1p9a s HIS 37 CO -0.04 -0.36 1.16 1.28 -0.85 0.00 0.00 174.74 175.93 1p9a n LEU 38 N 4.93 1.99 -4.72 0.89 4.77 0.17 -0.36 117.00 124.66 1p9a n LEU 38 Ca -0.16 -2.96 -0.32 0.00 -0.03 0.00 0.00 56.01 52.54 1p9a n LEU 38 Cb 0.51 -0.35 0.11 0.00 -2.33 0.00 0.00 43.42 41.36 1p9a n LEU 38 CO 0.31 0.87 0.73 -0.44 -1.33 0.00 0.00 177.39 177.53 1p9a s SER 39 N -2.64 3.97 -1.50 -1.43 0.01 -1.21 -3.80 113.70 107.10 1p9a s SER 39 Ca 0.30 2.14 -0.05 0.00 1.31 0.00 0.00 55.95 59.65 1p9a s SER 39 Cb 0.29 -2.56 0.02 0.00 0.21 0.00 0.00 66.02 63.97 1p9a s SER 39 CO -0.03 -2.40 0.55 -0.62 0.41 0.00 0.00 173.24 171.14 1p9a n GLU 40 N -3.34 -4.43 -1.15 12.44 -0.58 -0.84 -1.59 120.64 121.16 1p9a n GLU 40 Ca 0.12 0.82 0.00 0.00 -0.42 0.00 0.00 57.16 57.67 1p9a n GLU 40 Cb 0.52 -5.64 0.00 0.00 -0.57 0.00 0.00 31.44 25.75 1p9a n GLU 40 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1p9a n ASN 41 N -2.44 1.19 -3.21 1.62 3.02 -1.24 -3.37 115.26 110.83 1p9a n ASN 41 Ca -0.10 -0.72 -0.29 0.00 -0.03 0.00 0.00 54.58 53.44 1p9a n ASN 41 Cb 0.61 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.73 1p9a n ASN 41 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1p9a n LEU 42 N 0.00 4.59 -3.71 3.41 4.77 -0.00 -4.17 117.00 121.89 1p9a n LEU 42 Ca 0.00 -5.56 -0.41 0.00 -0.03 0.00 0.00 56.01 50.00 1p9a n LEU 42 Cb 0.00 -0.68 0.01 0.00 -2.33 0.00 0.00 43.42 40.42 1p9a n LEU 42 CO 0.00 2.20 1.69 0.18 -1.33 0.00 0.00 177.39 180.14 1p9a n LEU 43 N 0.21 7.24 -0.23 2.23 4.77 0.30 -4.31 117.00 127.21 1p9a n LEU 43 Ca 0.32 -5.12 0.18 0.00 -0.03 0.00 0.00 56.01 51.36 1p9a n LEU 43 Cb 0.38 -1.28 0.50 0.00 -2.33 0.00 0.00 43.42 40.68 1p9a n LEU 43 CO 0.40 1.88 1.22 1.88 -1.33 0.00 0.00 177.39 181.44 1p9a h TYR 44 N 4.80 0.56 -4.02 -1.77 -1.99 -1.70 -3.24 116.97 109.61 1p9a h TYR 44 Ca 0.49 0.02 -0.39 0.00 2.00 0.00 0.00 58.73 60.85 1p9a h TYR 44 Cb 0.42 -0.17 -0.26 0.00 2.00 0.00 0.00 36.73 38.72 1p9a h TYR 44 CO 1.32 0.17 -0.78 -0.08 -0.00 0.00 0.00 178.16 178.79 1p9a s THR 45 N -5.45 0.80 -0.13 -2.88 -1.32 -1.26 0.04 115.64 105.44 1p9a s THR 45 Ca -0.08 -0.70 -0.14 0.00 -1.21 0.00 0.00 61.69 59.56 1p9a s THR 45 Cb 0.22 -0.72 0.04 0.00 -1.51 0.00 0.00 72.50 70.53 1p9a s THR 45 CO 0.78 0.04 0.39 0.12 -2.21 0.00 0.00 174.62 173.73 1p9a s PHE 46 N -0.61 -0.41 -0.21 9.09 5.36 -0.78 -4.90 117.98 125.53 1p9a s PHE 46 Ca 0.01 0.97 -0.02 0.00 -0.96 0.00 0.00 56.93 56.93 1p9a s PHE 46 Cb -0.06 0.14 -0.00 0.00 -0.34 0.00 0.00 43.02 42.77 1p9a s PHE 46 CO 0.00 -0.23 -0.09 0.45 -1.46 0.00 0.00 175.22 173.89 1p9a s SER 47 N 0.05 3.95 0.48 6.13 0.15 -1.26 -0.64 113.70 122.55 1p9a s SER 47 Ca -0.01 -0.46 0.14 0.00 0.70 0.00 0.00 55.95 56.31 1p9a s SER 47 Cb -0.03 -1.66 1.12 0.00 -1.71 0.00 0.00 66.02 63.75 1p9a s SER 47 CO 0.01 -0.01 2.09 -0.07 1.20 0.00 0.00 173.24 176.47 1p9a h LEU 48 N 8.01 0.09 -2.44 3.45 3.38 -1.60 -2.28 115.31 123.92 1p9a h LEU 48 Ca -0.42 -0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.56 1p9a h LEU 48 Cb 1.16 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 1p9a h LEU 48 CO 0.61 0.11 0.09 0.00 0.09 0.00 0.00 178.44 179.34 1p9a h ALA 49 N 1.90 1.54 0.00 1.53 0.00 -1.93 -1.22 119.26 121.08 1p9a h ALA 49 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1p9a h ALA 49 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1p9a h ALA 49 CO -0.00 -0.12 0.00 0.25 0.00 0.00 0.00 179.25 179.38 1p9a n THR 50 N -3.67 0.99 1.10 0.00 -2.24 -0.86 -2.30 114.28 107.30 1p9a n THR 50 Ca -0.01 0.26 0.12 0.00 -2.27 0.00 0.00 64.05 62.15 1p9a n THR 50 Cb 0.18 -1.08 0.15 0.00 -2.10 0.00 0.00 70.33 67.48 1p9a n THR 50 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1p9a n LEU 51 N -1.74 2.07 -0.06 3.22 4.77 -0.46 -4.47 117.00 120.32 1p9a n LEU 51 Ca 0.03 -0.71 0.18 0.00 -0.03 0.00 0.00 56.01 55.48 1p9a n LEU 51 Cb 0.18 -0.02 0.62 0.00 -2.33 0.00 0.00 43.42 41.87 1p9a n LEU 51 CO 0.15 0.37 1.19 0.24 -1.33 0.00 0.00 177.39 178.01 1p9a h MET 52 N 2.87 0.16 0.00 3.23 2.86 -1.59 -1.12 114.93 121.33 1p9a h MET 52 Ca 0.00 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1p9a h MET 52 Cb 0.75 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 32.38 1p9a h MET 52 CO 0.00 0.10 -0.01 -1.35 1.06 0.00 0.00 176.91 176.71 1p9a h PRO 53 N 0.16 0.00 -4.13 -0.22 0.11 -1.83 -3.34 132.00 122.75 1p9a h PRO 53 Ca 0.30 0.00 -0.77 0.00 0.11 0.00 0.00 66.00 65.64 1p9a h PRO 53 Cb 0.95 0.00 -0.23 0.00 0.11 0.00 0.00 31.00 31.83 1p9a h PRO 53 CO -0.05 0.01 0.70 0.71 -0.21 0.00 0.00 178.00 179.17 1p9a s TYR 54 N -3.94 3.83 -0.30 0.65 1.51 -0.42 -4.89 117.35 113.78 1p9a s TYR 54 Ca -0.02 -2.26 0.23 0.00 -1.01 0.00 0.00 57.07 54.00 1p9a s TYR 54 Cb 0.11 -4.03 1.11 0.00 -0.11 0.00 0.00 41.96 39.04 1p9a s TYR 54 CO 0.49 -1.15 1.69 0.25 -1.11 0.00 0.00 175.55 175.72 1p9a n THR 55 N 3.80 0.94 0.14 -0.71 -2.24 -1.26 -2.54 114.28 112.41 1p9a n THR 55 Ca 0.26 0.52 0.08 0.00 -2.27 0.00 0.00 64.05 62.64 1p9a n THR 55 Cb 0.43 -1.50 0.15 0.00 -2.10 0.00 0.00 70.33 67.31 1p9a n THR 55 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1p9a n ARG 56 N -2.27 2.14 -1.98 -0.78 1.74 -1.26 -4.81 116.66 109.44 1p9a n ARG 56 Ca 0.00 -1.94 -0.43 0.00 -0.77 0.00 0.00 57.85 54.72 1p9a n ARG 56 Cb 0.12 -1.35 -0.03 0.00 -1.02 0.00 0.00 32.46 30.18 1p9a n ARG 56 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1p9a s LEU 57 N -1.14 3.88 -0.01 0.55 2.96 -1.05 -4.29 118.68 119.58 1p9a s LEU 57 Ca 0.27 1.77 0.10 0.00 -0.22 0.00 0.00 54.13 56.05 1p9a s LEU 57 Cb 0.16 -3.53 -0.14 0.00 0.50 0.00 0.00 46.19 43.18 1p9a s LEU 57 CO 0.22 -1.35 0.27 0.35 -1.32 0.00 0.00 176.35 174.51 1p9a n THR 58 N 6.54 0.00 -3.87 3.68 -2.24 0.64 -3.31 114.28 115.71 1p9a n THR 58 Ca 0.21 -0.24 -0.17 0.00 -2.27 0.00 0.00 64.05 61.58 1p9a n THR 58 Cb 0.45 0.49 -0.16 0.00 -2.10 0.00 0.00 70.33 69.00 1p9a n THR 58 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1p9a s GLN 59 N -2.45 0.22 -0.09 -0.78 0.74 -0.95 0.48 119.66 116.84 1p9a s GLN 59 Ca -0.01 0.12 0.01 0.00 0.05 0.00 0.00 55.36 55.52 1p9a s GLN 59 Cb 0.07 -0.46 0.02 0.00 1.10 0.00 0.00 33.01 33.74 1p9a s GLN 59 CO 0.40 -0.16 -0.09 -1.17 -0.55 0.00 0.00 175.29 173.72 1p9a s LEU 60 N 1.14 1.37 -0.30 3.68 2.96 -0.46 -1.15 118.68 125.92 1p9a s LEU 60 Ca -0.08 -0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 53.52 1p9a s LEU 60 Cb -0.13 -0.79 0.04 0.00 0.50 0.00 0.00 46.19 45.81 1p9a s LEU 60 CO -0.02 -0.05 0.02 0.20 -1.32 0.00 0.00 176.35 175.18 1p9a s ASN 61 N 1.22 4.95 -0.25 3.68 -0.87 -0.48 -1.53 114.94 121.66 1p9a s ASN 61 Ca -0.04 -1.16 0.11 0.00 -1.57 0.00 0.00 52.86 50.19 1p9a s ASN 61 Cb -0.14 -1.75 0.46 0.00 -0.02 0.00 0.00 41.25 39.80 1p9a s ASN 61 CO -0.03 -0.26 1.36 0.18 -2.57 0.00 0.00 177.10 175.78 1p9a n LEU 62 N 4.69 3.49 -4.81 0.60 4.77 0.28 -0.66 117.00 125.36 1p9a n LEU 62 Ca -0.13 -3.74 -0.33 0.00 -0.03 0.00 0.00 56.01 51.78 1p9a n LEU 62 Cb 0.44 -0.58 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 1p9a n LEU 62 CO 0.28 1.25 0.70 1.51 -1.33 0.00 0.00 177.39 179.79 1p9a s ASP 63 N -2.78 6.36 -1.49 -1.43 -4.77 -1.15 -3.91 116.67 107.50 1p9a s ASP 63 Ca 0.41 1.77 -0.12 0.00 -3.30 0.00 0.00 52.55 51.31 1p9a s ASP 63 Cb 0.38 -2.54 0.07 0.00 -1.09 0.00 0.00 42.92 39.74 1p9a s ASP 63 CO -0.02 -0.77 0.93 0.54 0.70 0.00 0.00 175.17 176.55 1p9a n ARG 64 N -1.36 -5.61 -0.31 2.11 1.74 -0.58 -2.13 116.66 110.52 1p9a n ARG 64 Ca 0.08 0.65 0.08 0.00 -0.77 0.00 0.00 57.85 57.89 1p9a n ARG 64 Cb 0.53 -5.55 0.15 0.00 -1.02 0.00 0.00 32.46 26.58 1p9a n ARG 64 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1p9a n ALA 65 N -4.51 2.70 -1.92 7.54 0.00 -1.25 -1.99 120.51 121.08 1p9a n ALA 65 Ca 0.02 -2.75 -0.19 0.00 0.00 0.00 0.00 53.44 50.52 1p9a n ALA 65 Cb 0.54 -0.39 -0.05 0.00 0.00 0.00 0.00 19.45 19.55 1p9a n ALA 65 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1p9a n GLU 66 N -1.19 -1.58 -1.68 0.00 -0.58 -1.26 -0.54 120.64 113.81 1p9a n GLU 66 Ca 0.16 1.05 -0.42 0.00 -0.42 0.00 0.00 57.16 57.52 1p9a n GLU 66 Cb 0.68 -5.53 -0.03 0.00 -0.57 0.00 0.00 31.44 25.98 1p9a n GLU 66 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1p9a s LEU 67 N -5.15 4.33 -0.09 -4.62 2.96 -1.22 -3.70 118.68 111.19 1p9a s LEU 67 Ca 0.00 2.58 0.02 0.00 -0.22 0.00 0.00 54.13 56.51 1p9a s LEU 67 Cb 0.00 -3.53 -0.06 0.00 0.50 0.00 0.00 46.19 43.10 1p9a s LEU 67 CO 0.00 -1.14 -0.06 0.41 -1.32 0.00 0.00 176.35 174.23 1p9a n THR 68 N 5.78 0.51 -3.80 3.68 -1.04 0.11 -0.86 114.28 118.65 1p9a n THR 68 Ca 0.21 -0.21 -0.26 0.00 -2.04 0.00 0.00 64.05 61.75 1p9a n THR 68 Cb 0.42 -0.82 -0.17 0.00 -1.82 0.00 0.00 70.33 67.94 1p9a n THR 68 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1p9a s LYS 69 N -2.18 0.90 -0.34 -2.82 1.02 -0.53 -4.59 119.74 111.20 1p9a s LYS 69 Ca -0.11 -0.22 -0.10 0.00 0.02 0.00 0.00 55.97 55.56 1p9a s LYS 69 Cb 0.03 -1.60 0.01 0.00 -0.52 0.00 0.00 37.83 35.75 1p9a s LYS 69 CO 0.22 -0.43 0.18 -1.17 -0.92 0.00 0.00 175.35 173.23 1p9a s LEU 70 N 1.84 4.41 -0.20 3.17 2.96 -1.26 -1.86 118.68 127.74 1p9a s LEU 70 Ca 0.02 -0.74 -0.27 0.00 -0.22 0.00 0.00 54.13 52.93 1p9a s LEU 70 Cb -0.14 -2.02 -0.00 0.00 0.50 0.00 0.00 46.19 44.52 1p9a s LEU 70 CO -0.07 -0.29 0.92 -1.10 -1.32 0.00 0.00 176.35 174.49 1p9a s GLN 71 N 1.59 4.27 -0.92 1.98 -0.21 0.18 -4.98 119.66 121.57 1p9a s GLN 71 Ca 0.03 1.15 -0.06 0.00 0.02 0.00 0.00 55.36 56.51 1p9a s GLN 71 Cb -0.18 -3.61 0.23 0.00 1.00 0.00 0.00 33.01 30.45 1p9a s GLN 71 CO 0.07 -0.47 0.85 0.08 -2.12 0.00 0.00 175.29 173.69 1p9a s VAL 72 N 2.64 5.01 0.00 1.09 1.01 -1.26 -1.35 120.40 127.54 1p9a s VAL 72 Ca 0.40 -3.42 0.00 0.00 0.00 0.00 0.00 61.98 58.97 1p9a s VAL 72 Cb -0.16 -4.08 0.00 0.00 0.00 0.00 0.00 36.38 32.14 1p9a s VAL 72 CO 0.10 -1.09 0.00 0.47 0.00 0.00 0.00 175.10 174.58 1p9a n ASP 73 N 2.82 0.00 0.00 3.32 9.92 -1.26 -4.97 116.55 126.38 1p9a n ASP 73 Ca 0.19 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.45 1p9a n ASP 73 Cb 0.39 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.87 1p9a n ASP 73 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1p9a n GLY 74 N 4.92 -2.35 3.00 0.44 0.00 -1.26 -4.84 105.19 105.10 1p9a n GLY 74 Ca 0.00 -0.45 -0.13 0.00 0.00 0.00 0.00 46.02 45.44 1p9a n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p9a s THR 75 N 0.00 -0.02 -0.72 2.61 2.01 -1.26 -4.46 115.64 113.80 1p9a s THR 75 Ca 0.00 0.08 0.03 0.00 0.31 0.00 0.00 61.69 62.11 1p9a s THR 75 Cb 0.00 -0.25 0.17 0.00 0.01 0.00 0.00 72.50 72.44 1p9a s THR 75 CO 0.00 0.03 0.52 -0.76 -0.69 0.00 0.00 174.62 173.73 1p9a s LEU 76 N 0.59 4.94 0.58 4.42 1.43 -0.52 -4.81 118.68 125.31 1p9a s LEU 76 Ca -0.04 -3.69 0.29 0.00 -1.03 0.00 0.00 54.13 49.65 1p9a s LEU 76 Cb -0.06 -1.70 1.47 0.00 0.03 0.00 0.00 46.19 45.93 1p9a s LEU 76 CO -0.03 -0.13 1.90 1.55 0.23 0.00 0.00 176.35 179.86 1p9a h PRO 77 N 5.72 0.00 -0.08 1.29 0.13 -1.95 -2.87 132.00 134.24 1p9a h PRO 77 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1p9a h PRO 77 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1p9a h PRO 77 CO 0.74 0.00 0.00 1.33 -0.23 0.00 0.00 178.00 179.84 1p9a n VAL 78 N -3.77 0.37 -1.95 1.56 0.24 -1.26 -4.35 118.33 109.17 1p9a n VAL 78 Ca 0.09 -0.69 -0.42 0.00 -2.04 0.00 0.00 64.34 61.28 1p9a n VAL 78 Cb 0.69 0.90 -0.03 0.00 -1.47 0.00 0.00 33.84 33.93 1p9a n VAL 78 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1p9a s LEU 79 N -0.70 4.34 -0.12 1.34 2.96 -1.08 -4.39 118.68 121.04 1p9a s LEU 79 Ca 0.09 2.32 0.15 0.00 -0.22 0.00 0.00 54.13 56.48 1p9a s LEU 79 Cb 0.06 -3.53 -0.22 0.00 0.50 0.00 0.00 46.19 43.00 1p9a s LEU 79 CO 0.08 -0.94 0.15 0.61 -1.32 0.00 0.00 176.35 174.93 1p9a n GLY 80 N 4.19 -0.78 3.03 7.98 0.00 0.18 -2.87 105.19 116.91 1p9a n GLY 80 Ca 0.18 -0.31 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 1p9a n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1p9a s THR 81 N -2.63 1.01 -0.14 2.61 2.01 -0.48 -0.24 115.64 117.79 1p9a s THR 81 Ca -0.07 -0.46 -0.02 0.00 0.31 0.00 0.00 61.69 61.45 1p9a s THR 81 Cb 0.07 -0.91 0.05 0.00 0.01 0.00 0.00 72.50 71.71 1p9a s THR 81 CO 0.67 0.31 0.01 -0.22 -0.69 0.00 0.00 174.62 174.70 1p9a s LEU 82 N 0.35 0.99 -0.32 4.42 2.96 -0.45 -1.35 118.68 125.29 1p9a s LEU 82 Ca -0.07 -0.52 -0.09 0.00 -0.22 0.00 0.00 54.13 53.22 1p9a s LEU 82 Cb -0.12 -0.57 0.01 0.00 0.50 0.00 0.00 46.19 46.01 1p9a s LEU 82 CO 0.02 -0.25 0.14 -0.62 -1.32 0.00 0.00 176.35 174.31 1p9a s ASP 83 N 1.88 5.43 -0.10 3.68 -1.08 -0.58 -1.64 116.67 124.25 1p9a s ASP 83 Ca 0.02 -0.72 0.14 0.00 -0.52 0.00 0.00 52.55 51.47 1p9a s ASP 83 Cb -0.15 -1.96 0.28 0.00 -1.46 0.00 0.00 42.92 39.63 1p9a s ASP 83 CO -0.07 -0.24 1.18 0.18 0.52 0.00 0.00 175.17 176.74 1p9a n LEU 84 N 4.94 2.63 -4.74 -1.34 4.77 0.15 -0.56 117.00 122.85 1p9a n LEU 84 Ca -0.14 -2.75 -0.35 0.00 -0.03 0.00 0.00 56.01 52.74 1p9a n LEU 84 Cb 0.48 -0.34 0.07 0.00 -2.33 0.00 0.00 43.42 41.29 1p9a n LEU 84 CO 0.33 0.66 0.82 -0.94 -1.33 0.00 0.00 177.39 176.93 1p9a s SER 85 N -2.13 4.63 -1.21 -1.43 1.04 -1.11 -3.85 113.70 109.64 1p9a s SER 85 Ca 0.26 2.37 -0.00 0.00 0.48 0.00 0.00 55.95 59.06 1p9a s SER 85 Cb 0.22 -2.59 -0.00 0.00 0.10 0.00 0.00 66.02 63.75 1p9a s SER 85 CO 0.05 -1.97 0.95 1.41 0.98 0.00 0.00 173.24 174.66 1p9a n HIS 86 N -2.25 -2.15 -3.89 5.02 8.25 -0.31 -1.52 115.22 118.37 1p9a n HIS 86 Ca 0.14 0.92 0.00 0.00 -0.26 0.00 0.00 57.72 58.52 1p9a n HIS 86 Cb 0.50 -4.96 0.00 0.00 1.12 0.00 0.00 29.99 26.65 1p9a n HIS 86 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1p9a n ASN 87 N -3.12 1.35 -1.14 0.41 3.02 -1.05 -2.46 115.26 112.26 1p9a n ASN 87 Ca -0.29 -0.89 -0.05 0.00 -0.03 0.00 0.00 54.58 53.32 1p9a n ASN 87 Cb 0.67 0.00 0.16 0.00 -0.61 0.00 0.00 39.78 40.00 1p9a n ASN 87 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1p9a n GLN 88 N 0.00 2.17 -2.23 3.52 1.13 -0.04 -4.16 117.38 117.77 1p9a n GLN 88 Ca 0.00 -3.49 -0.42 0.00 -1.94 0.00 0.00 57.00 51.15 1p9a n GLN 88 Cb 0.00 -1.85 -0.03 0.00 0.11 0.00 0.00 30.24 28.47 1p9a n GLN 88 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1p9a s LEU 89 N -3.35 4.34 0.00 1.08 1.43 -1.15 -4.66 118.68 116.38 1p9a s LEU 89 Ca 0.44 2.18 0.22 0.00 -1.03 0.00 0.00 54.13 55.95 1p9a s LEU 89 Cb 0.39 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 43.04 1p9a s LEU 89 CO -0.03 -0.66 1.07 0.00 0.23 0.00 0.00 176.35 176.96 1p9a n GLN 90 N 4.65 0.43 -3.89 1.70 6.02 -1.26 -0.36 117.38 124.66 1p9a n GLN 90 Ca 0.12 -0.34 -0.11 0.00 -0.01 0.00 0.00 57.00 56.66 1p9a n GLN 90 Cb 0.43 -1.49 -0.13 0.00 1.02 0.00 0.00 30.24 30.07 1p9a n GLN 90 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1p9a s SER 91 N -2.80 0.04 -0.03 1.08 0.01 -1.26 -4.40 113.70 106.33 1p9a s SER 91 Ca 0.13 -0.09 -0.30 0.00 1.31 0.00 0.00 55.95 56.99 1p9a s SER 91 Cb 0.17 0.04 -0.04 0.00 0.21 0.00 0.00 66.02 66.39 1p9a s SER 91 CO 0.73 -0.07 1.31 -0.22 0.41 0.00 0.00 173.24 175.41 1p9a s LEU 92 N -0.32 4.29 0.40 2.44 2.96 -1.26 -4.98 118.68 122.22 1p9a s LEU 92 Ca -0.03 1.97 -0.27 0.00 -0.22 0.00 0.00 54.13 55.58 1p9a s LEU 92 Cb -0.02 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 43.02 1p9a s LEU 92 CO -0.00 -0.67 1.36 -2.84 -1.32 0.00 0.00 176.35 172.89 1p9a s PRO 93 N 2.39 3.98 -0.53 0.98 0.02 -1.26 -4.94 135.00 135.65 1p9a s PRO 93 Ca 0.60 2.30 -0.21 0.00 0.02 0.00 0.00 61.00 63.71 1p9a s PRO 93 Cb -0.28 -2.82 0.05 0.00 0.02 0.00 0.00 34.50 31.48 1p9a s PRO 93 CO 0.24 -0.53 0.76 -0.51 -0.33 0.00 0.00 177.00 176.62 1p9a s LEU 94 N -2.35 4.62 0.00 -5.54 1.43 -1.26 -4.90 118.68 110.68 1p9a s LEU 94 Ca 0.56 -0.70 0.17 0.00 -1.03 0.00 0.00 54.13 53.12 1p9a s LEU 94 Cb -0.41 -2.59 -0.16 0.00 0.03 0.00 0.00 46.19 43.05 1p9a s LEU 94 CO 0.54 -1.03 0.72 0.18 0.23 0.00 0.00 176.35 176.98 1p9a n LEU 95 N 6.70 0.87 -0.28 1.79 4.77 -1.26 -4.72 117.00 124.87 1p9a n LEU 95 Ca -0.03 -0.52 0.07 0.00 -0.03 0.00 0.00 56.01 55.49 1p9a n LEU 95 Cb 0.46 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.77 1p9a n LEU 95 CO 0.58 0.21 1.07 1.23 -1.33 0.00 0.00 177.39 179.15 1p9a h GLY 96 N 3.89 1.31 2.00 -0.72 0.00 -1.85 0.85 103.07 108.56 1p9a h GLY 96 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.11 1p9a h GLY 96 CO 0.00 -0.07 0.00 -1.61 0.00 0.00 0.00 176.54 174.86 1p9a h GLN 97 N 0.56 0.00 0.00 4.80 4.15 -1.84 -3.32 115.11 119.46 1p9a h GLN 97 Ca 0.45 0.00 -0.30 0.00 0.77 0.00 0.00 58.65 59.57 1p9a h GLN 97 Cb 0.67 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 28.30 1p9a h GLN 97 CO -0.38 0.00 -2.15 2.41 -1.93 0.00 0.00 178.83 176.78 1p9a n THR 98 N -2.37 1.15 -3.19 2.39 -1.04 -0.79 -4.74 114.28 105.69 1p9a n THR 98 Ca 0.05 -0.62 -0.27 0.00 -2.04 0.00 0.00 64.05 61.17 1p9a n THR 98 Cb 0.42 -0.78 -0.06 0.00 -1.82 0.00 0.00 70.33 68.09 1p9a n THR 98 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1p9a n LEU 99 N -2.76 3.89 0.09 -4.42 4.77 0.23 -1.44 117.00 117.35 1p9a n LEU 99 Ca -0.30 -5.52 0.18 0.00 -0.03 0.00 0.00 56.01 50.34 1p9a n LEU 99 Cb 0.99 -0.53 0.72 0.00 -2.33 0.00 0.00 43.42 42.26 1p9a n LEU 99 CO 0.30 2.20 1.16 1.55 -1.33 0.00 0.00 177.39 181.27 1p9a h PRO 100 N 3.60 0.00 -0.53 3.23 0.13 -1.80 -2.31 132.00 134.32 1p9a h PRO 100 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1p9a h PRO 100 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1p9a h PRO 100 CO 0.81 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.58 1p9a n ALA 101 N -2.54 2.41 -1.70 -0.56 0.00 -1.26 -4.51 120.51 112.36 1p9a n ALA 101 Ca 0.06 -1.06 -0.44 0.00 0.00 0.00 0.00 53.44 52.01 1p9a n ALA 101 Cb 0.47 -0.93 -0.04 0.00 0.00 0.00 0.00 19.45 18.95 1p9a n ALA 101 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1p9a n LEU 102 N 1.38 3.64 -0.01 0.00 7.94 -0.87 -4.49 117.00 124.59 1p9a n LEU 102 Ca 0.21 1.06 0.01 0.00 -1.11 0.00 0.00 56.01 56.18 1p9a n LEU 102 Cb 0.56 -1.51 -0.04 0.00 0.53 0.00 0.00 43.42 42.96 1p9a n LEU 102 CO 0.15 -0.01 -0.59 0.35 -1.11 0.00 0.00 177.39 176.19 1p9a n THR 103 N 3.82 0.10 -4.06 1.96 -2.24 0.67 -2.49 114.28 112.04 1p9a n THR 103 Ca 0.17 -0.14 -0.23 0.00 -2.27 0.00 0.00 64.05 61.57 1p9a n THR 103 Cb 0.32 -0.01 -0.17 0.00 -2.10 0.00 0.00 70.33 68.38 1p9a n THR 103 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1p9a s VAL 104 N -2.28 0.71 -0.10 2.28 1.01 -0.55 0.46 120.40 121.92 1p9a s VAL 104 Ca -0.02 -0.15 -0.00 0.00 0.00 0.00 0.00 61.98 61.80 1p9a s VAL 104 Cb 0.03 -0.75 0.02 0.00 0.00 0.00 0.00 36.38 35.68 1p9a s VAL 104 CO 0.21 0.29 -0.07 -0.22 0.00 0.00 0.00 175.10 175.30 1p9a s LEU 105 N 1.35 1.18 -0.21 3.92 2.96 -0.45 -1.34 118.68 126.09 1p9a s LEU 105 Ca -0.03 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 53.61 1p9a s LEU 105 Cb -0.14 -0.80 0.04 0.00 0.50 0.00 0.00 46.19 45.80 1p9a s LEU 105 CO -0.03 -0.11 -0.15 -0.62 -1.32 0.00 0.00 176.35 174.13 1p9a s ASP 106 N 1.61 3.66 -0.19 3.68 3.68 -0.65 -1.26 116.67 127.20 1p9a s ASP 106 Ca 0.03 -0.97 0.15 0.00 2.13 0.00 0.00 52.55 53.88 1p9a s ASP 106 Cb -0.13 -1.45 0.45 0.00 -1.45 0.00 0.00 42.92 40.34 1p9a s ASP 106 CO -0.07 -0.10 1.19 0.52 0.13 0.00 0.00 175.17 176.84 1p9a n VAL 107 N 4.57 1.67 -1.70 1.11 0.31 0.12 0.31 118.33 124.73 1p9a n VAL 107 Ca -0.17 -2.96 -0.33 0.00 -0.01 0.00 0.00 64.34 60.86 1p9a n VAL 107 Cb 0.46 0.03 0.06 0.00 -0.91 0.00 0.00 33.84 33.47 1p9a n VAL 107 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1p9a s SER 108 N -3.15 4.95 -1.28 4.52 0.01 -1.15 -4.03 113.70 113.57 1p9a s SER 108 Ca 0.39 2.06 -0.10 0.00 1.31 0.00 0.00 55.95 59.60 1p9a s SER 108 Cb 0.38 -2.56 -0.00 0.00 0.21 0.00 0.00 66.02 64.05 1p9a s SER 108 CO -0.06 -1.74 0.60 0.49 0.41 0.00 0.00 173.24 172.94 1p9a n PHE 109 N -2.47 -1.76 -2.03 2.43 3.01 0.16 -1.16 117.46 115.63 1p9a n PHE 109 Ca 0.11 0.60 0.00 0.00 1.01 0.00 0.00 57.45 59.17 1p9a n PHE 109 Cb 0.52 -3.62 0.00 0.00 -0.01 0.00 0.00 39.48 36.36 1p9a n PHE 109 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1p9a n ASN 110 N -2.83 0.21 -2.08 4.37 3.02 -1.26 -2.52 115.26 114.17 1p9a n ASN 110 Ca -0.21 0.00 -0.20 0.00 -0.03 0.00 0.00 54.58 54.14 1p9a n ASN 110 Cb 0.64 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.84 1p9a n ASN 110 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1p9a n ARG 111 N 0.00 3.29 -2.51 3.52 1.74 0.51 -4.69 116.66 118.52 1p9a n ARG 111 Ca 0.00 -4.05 -0.41 0.00 -0.77 0.00 0.00 57.85 52.62 1p9a n ARG 111 Cb 0.00 -2.16 -0.04 0.00 -1.02 0.00 0.00 32.46 29.24 1p9a n ARG 111 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1p9a s LEU 112 N -3.60 4.50 -0.00 0.55 1.43 -1.21 -4.40 118.68 115.95 1p9a s LEU 112 Ca 0.47 2.11 0.00 0.00 -1.03 0.00 0.00 54.13 55.69 1p9a s LEU 112 Cb 0.40 -3.61 -0.00 0.00 0.03 0.00 0.00 46.19 43.01 1p9a s LEU 112 CO 0.03 -0.21 0.01 0.35 0.23 0.00 0.00 176.35 176.75 1p9a n THR 113 N 2.25 0.00 -3.69 5.49 -2.24 -1.26 -0.92 114.28 113.91 1p9a n THR 113 Ca 0.02 -0.45 -0.06 0.00 -2.27 0.00 0.00 64.05 61.29 1p9a n THR 113 Cb 0.46 0.96 -0.02 0.00 -2.10 0.00 0.00 70.33 69.63 1p9a n THR 113 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1p9a s SER 114 N -1.12 -0.28 -0.03 3.42 1.04 -1.26 -4.10 113.70 111.37 1p9a s SER 114 Ca 0.00 -0.32 0.05 0.00 0.48 0.00 0.00 55.95 56.16 1p9a s SER 114 Cb 0.00 0.53 -0.01 0.00 0.10 0.00 0.00 66.02 66.65 1p9a s SER 114 CO 0.01 -0.95 -0.20 -0.76 0.98 0.00 0.00 173.24 172.33 1p9a s LEU 115 N -2.82 2.00 0.73 2.42 1.43 -1.26 -4.69 118.68 116.47 1p9a s LEU 115 Ca 0.09 -0.38 -0.11 0.00 -1.03 0.00 0.00 54.13 52.70 1p9a s LEU 115 Cb -0.02 -1.06 0.03 0.00 0.03 0.00 0.00 46.19 45.16 1p9a s LEU 115 CO -0.01 0.21 1.09 -2.16 0.23 0.00 0.00 176.35 175.71 1p9a s PRO 116 N -0.23 2.70 0.32 1.29 0.04 -1.26 -4.60 135.00 133.25 1p9a s PRO 116 Ca 0.02 0.60 0.01 0.00 0.04 0.00 0.00 61.00 61.67 1p9a s PRO 116 Cb -0.10 -1.99 0.54 0.00 0.04 0.00 0.00 34.50 32.99 1p9a s PRO 116 CO 0.01 -1.18 1.91 -0.07 0.04 0.00 0.00 177.00 177.71 1p9a h LEU 117 N -0.77 0.69 -0.10 -3.56 3.38 -2.00 -2.56 115.31 110.40 1p9a h LEU 117 Ca -0.45 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.44 1p9a h LEU 117 Cb 1.25 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.82 1p9a h LEU 117 CO 0.61 0.62 0.00 1.23 0.09 0.00 0.00 178.44 181.00 1p9a h GLY 118 N 0.89 0.00 0.00 0.83 0.00 -2.00 -3.44 103.07 99.35 1p9a h GLY 118 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1p9a h GLY 118 CO -0.02 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.52 1p9a n ALA 119 N -1.95 0.00 -0.64 3.60 0.00 -0.97 -1.05 120.51 119.50 1p9a n ALA 119 Ca 0.04 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.57 1p9a n ALA 119 Cb 0.46 0.00 0.34 0.00 0.00 0.00 0.00 19.45 20.25 1p9a n ALA 119 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1p9a n LEU 120 N -0.19 4.61 -4.69 0.00 4.77 -1.26 -4.48 117.00 115.76 1p9a n LEU 120 Ca 0.00 -2.50 -0.44 0.00 -0.03 0.00 0.00 56.01 53.04 1p9a n LEU 120 Cb 0.00 -0.56 -0.03 0.00 -2.33 0.00 0.00 43.42 40.50 1p9a n LEU 120 CO 0.00 0.78 1.18 -1.14 -1.33 0.00 0.00 177.39 176.89 1p9a n ARG 121 N 0.89 2.34 -0.03 3.23 0.63 -0.22 -1.89 116.66 121.61 1p9a n ARG 121 Ca 0.24 0.84 0.00 0.00 -0.92 0.00 0.00 57.85 58.01 1p9a n ARG 121 Cb 0.88 -2.59 0.00 0.00 0.45 0.00 0.00 32.46 31.19 1p9a n ARG 121 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1p9a n GLY 122 N 2.91 1.37 2.71 5.14 0.00 -1.26 -3.60 105.19 112.46 1p9a n GLY 122 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1p9a n GLY 122 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p9a n LEU 123 N 0.00 7.07 0.28 0.99 4.77 -0.79 -4.70 117.00 124.62 1p9a n LEU 123 Ca 0.00 -4.52 0.19 0.00 -0.03 0.00 0.00 56.01 51.66 1p9a n LEU 123 Cb 0.00 -1.15 1.03 0.00 -2.33 0.00 0.00 43.42 40.97 1p9a n LEU 123 CO 0.00 1.76 1.08 1.23 -1.33 0.00 0.00 177.39 180.13 1p9a h GLY 124 N 3.51 0.00 -1.06 -0.72 0.00 -1.83 -1.59 103.07 101.39 1p9a h GLY 124 Ca 0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1p9a h GLY 124 CO 1.18 0.00 -0.10 1.18 0.00 0.00 0.00 176.54 178.80 1p9a n GLU 125 N -2.82 1.77 -1.68 4.80 -0.58 -1.26 -4.53 120.64 116.35 1p9a n GLU 125 Ca -0.02 -1.31 -0.45 0.00 -0.42 0.00 0.00 57.16 54.95 1p9a n GLU 125 Cb 0.06 -1.47 -0.04 0.00 -0.57 0.00 0.00 31.44 29.42 1p9a n GLU 125 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1p9a n LEU 126 N 0.53 3.28 -0.01 -4.62 7.94 -0.60 -4.41 117.00 119.12 1p9a n LEU 126 Ca 0.15 1.07 -0.00 0.00 -1.11 0.00 0.00 56.01 56.12 1p9a n LEU 126 Cb 0.47 -1.45 -0.02 0.00 0.53 0.00 0.00 43.42 42.94 1p9a n LEU 126 CO 0.19 -0.19 -0.58 0.00 -1.11 0.00 0.00 177.39 175.70 1p9a n GLN 127 N 3.69 2.21 -3.91 1.96 6.02 0.17 -2.99 117.38 124.54 1p9a n GLN 127 Ca 0.17 -0.01 -0.19 0.00 -0.01 0.00 0.00 57.00 56.96 1p9a n GLN 127 Cb 0.30 -1.08 -0.17 0.00 1.02 0.00 0.00 30.24 30.32 1p9a n GLN 127 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1p9a s GLU 128 N -2.13 0.38 -0.13 -1.09 2.02 -0.14 0.22 118.70 117.82 1p9a s GLU 128 Ca -0.01 0.09 -0.00 0.00 0.02 0.00 0.00 54.97 55.06 1p9a s GLU 128 Cb 0.01 -0.61 0.03 0.00 0.10 0.00 0.00 34.13 33.67 1p9a s GLU 128 CO 0.13 -0.17 -0.07 -1.17 0.02 0.00 0.00 175.26 174.00 1p9a s LEU 129 N 1.26 1.35 -0.20 1.80 2.96 -0.51 -1.34 118.68 123.99 1p9a s LEU 129 Ca -0.06 -0.45 -0.02 0.00 -0.22 0.00 0.00 54.13 53.38 1p9a s LEU 129 Cb -0.13 -0.87 0.01 0.00 0.50 0.00 0.00 46.19 45.70 1p9a s LEU 129 CO -0.02 -0.15 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.44 1p9a s TYR 130 N 1.68 2.89 -0.07 5.38 1.51 -0.39 -1.27 117.35 127.08 1p9a s TYR 130 Ca 0.03 -1.28 0.12 0.00 -1.01 0.00 0.00 57.07 54.92 1p9a s TYR 130 Cb -0.14 -2.02 0.21 0.00 -0.11 0.00 0.00 41.96 39.91 1p9a s TYR 130 CO -0.08 -0.67 1.10 1.28 -1.11 0.00 0.00 175.55 176.07 1p9a n LEU 131 N 4.71 1.30 -4.73 -1.29 4.77 -0.02 -0.70 117.00 121.04 1p9a n LEU 131 Ca -0.19 -2.24 -0.38 0.00 -0.03 0.00 0.00 56.01 53.17 1p9a n LEU 131 Cb 0.50 -0.22 0.05 0.00 -2.33 0.00 0.00 43.42 41.42 1p9a n LEU 131 CO 0.27 0.59 0.95 1.17 -1.33 0.00 0.00 177.39 179.05 1p9a n LYS 132 N -0.58 1.61 -1.34 3.23 4.81 -1.22 -3.69 118.16 120.99 1p9a n LYS 132 Ca 0.09 0.59 -0.07 0.00 -0.87 0.00 0.00 58.31 58.06 1p9a n LYS 132 Cb 0.74 -2.55 -0.02 0.00 0.02 0.00 0.00 35.03 33.22 1p9a n LYS 132 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1p9a n GLY 133 N 0.80 0.76 0.00 3.14 0.00 -0.55 0.35 105.19 109.69 1p9a n GLY 133 Ca 0.11 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1p9a n GLY 133 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1p9a n ASN 134 N 0.92 0.28 -2.21 1.61 3.02 -1.24 -3.94 115.26 113.69 1p9a n ASN 134 Ca -0.07 -0.16 -0.19 0.00 -0.03 0.00 0.00 54.58 54.14 1p9a n ASN 134 Cb 0.27 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.46 1p9a n ASN 134 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1p9a n GLU 135 N -0.14 3.19 -2.05 3.52 1.02 -0.09 -4.22 120.64 121.88 1p9a n GLU 135 Ca 0.00 -4.03 -0.41 0.00 -0.02 0.00 0.00 57.16 52.70 1p9a n GLU 135 Cb 0.00 -2.13 -0.02 0.00 -0.02 0.00 0.00 31.44 29.27 1p9a n GLU 135 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1p9a s LEU 136 N -3.64 4.39 -0.18 -4.62 1.43 -1.24 -4.51 118.68 110.30 1p9a s LEU 136 Ca 0.46 2.62 0.07 0.00 -1.03 0.00 0.00 54.13 56.25 1p9a s LEU 136 Cb 0.39 -3.62 -0.16 0.00 0.03 0.00 0.00 46.19 42.83 1p9a s LEU 136 CO 0.02 -0.68 -0.07 0.29 0.23 0.00 0.00 176.35 176.15 1p9a n LYS 137 N 2.45 0.96 -4.02 1.70 4.01 -1.26 -0.00 118.16 122.00 1p9a n LYS 137 Ca 0.07 0.06 -0.10 0.00 -0.51 0.00 0.00 58.31 57.83 1p9a n LYS 137 Cb 0.41 -1.40 -0.08 0.00 -0.51 0.00 0.00 35.03 33.45 1p9a n LYS 137 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 1p9a s THR 138 N -2.39 0.07 0.07 -0.18 -1.32 -1.26 -2.55 115.64 108.08 1p9a s THR 138 Ca -0.18 -1.55 0.09 0.00 -1.21 0.00 0.00 61.69 58.84 1p9a s THR 138 Cb 0.06 -1.94 -0.03 0.00 -1.51 0.00 0.00 72.50 69.08 1p9a s THR 138 CO 0.55 -0.32 -0.24 -0.76 -2.21 0.00 0.00 174.62 171.64 1p9a s LEU 139 N -3.00 2.22 0.33 9.08 1.43 -1.26 -4.69 118.68 122.79 1p9a s LEU 139 Ca 0.20 -0.62 -0.28 0.00 -1.03 0.00 0.00 54.13 52.40 1p9a s LEU 139 Cb 0.04 -1.13 -0.09 0.00 0.03 0.00 0.00 46.19 45.04 1p9a s LEU 139 CO 0.01 0.19 1.14 -2.16 0.23 0.00 0.00 176.35 175.76 1p9a s PRO 140 N -1.49 4.41 0.41 1.29 0.04 -1.26 -4.78 135.00 133.62 1p9a s PRO 140 Ca 0.10 1.84 -0.25 0.00 0.04 0.00 0.00 61.00 62.73 1p9a s PRO 140 Cb -0.10 -2.98 -0.08 0.00 0.04 0.00 0.00 34.50 31.38 1p9a s PRO 140 CO 0.03 -0.01 1.25 -2.14 0.04 0.00 0.00 177.00 176.18 1p9a s PRO 141 N -1.81 3.95 0.00 0.56 0.02 -1.26 -2.04 135.00 134.42 1p9a s PRO 141 Ca 0.49 2.04 0.00 0.00 0.02 0.00 0.00 61.00 63.55 1p9a s PRO 141 Cb -0.32 -2.69 0.00 0.00 0.02 0.00 0.00 34.50 31.51 1p9a s PRO 141 CO 0.41 -0.47 0.00 0.41 -0.33 0.00 0.00 177.00 177.02 1p9a n GLY 142 N 0.66 0.72 0.32 0.52 0.00 -1.26 -4.93 105.19 101.22 1p9a n GLY 142 Ca 0.04 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.16 1p9a n GLY 142 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1p9a h LEU 143 N 0.00 0.57 -2.54 0.99 5.85 -1.79 -2.17 115.31 116.22 1p9a h LEU 143 Ca 0.00 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1p9a h LEU 143 Cb 0.00 0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.04 1p9a h LEU 143 CO 0.00 0.21 0.00 0.18 -0.34 0.00 0.00 178.44 178.49 1p9a n LEU 144 N -4.87 3.71 0.24 2.25 4.77 -1.26 -4.42 117.00 117.42 1p9a n LEU 144 Ca 0.19 -1.81 0.08 0.00 -0.03 0.00 0.00 56.01 54.45 1p9a n LEU 144 Cb 0.49 -0.43 0.61 0.00 -2.33 0.00 0.00 43.42 41.76 1p9a n LEU 144 CO 0.20 0.91 0.94 0.71 -1.33 0.00 0.00 177.39 178.82 1p9a h THR 145 N 4.18 0.90 -0.00 -5.08 1.35 -1.74 -2.15 112.91 110.37 1p9a h THR 145 Ca 0.00 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.32 1p9a h THR 145 Cb 0.95 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1p9a h THR 145 CO 0.00 0.14 -0.05 -2.65 -0.25 0.00 0.00 175.52 172.72 1p9a n PRO 146 N -4.07 0.02 -3.25 4.72 -0.02 -1.26 -4.36 135.00 126.78 1p9a n PRO 146 Ca -0.02 -0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.19 1p9a n PRO 146 Cb 0.23 -1.50 -0.07 0.00 -0.02 0.00 0.00 33.50 32.14 1p9a n PRO 146 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1p9a n THR 147 N -1.49 2.52 0.31 3.45 -2.24 -0.81 -3.55 114.28 112.47 1p9a n THR 147 Ca 0.07 -5.32 0.20 0.00 -2.27 0.00 0.00 64.05 56.73 1p9a n THR 147 Cb 0.34 -1.84 0.94 0.00 -2.10 0.00 0.00 70.33 67.67 1p9a n THR 147 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1p9a h PRO 148 N 3.75 0.00 -0.35 -0.78 0.13 -1.76 -2.72 132.00 130.27 1p9a h PRO 148 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1p9a h PRO 148 Cb 0.61 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.74 1p9a h PRO 148 CO 0.82 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.22 1p9a n LYS 149 N -3.01 1.94 -1.67 0.86 5.02 -1.26 -4.31 118.16 115.73 1p9a n LYS 149 Ca -0.01 -1.45 -0.46 0.00 -2.02 0.00 0.00 58.31 54.37 1p9a n LYS 149 Cb 0.17 -1.36 -0.04 0.00 -0.02 0.00 0.00 35.03 33.79 1p9a n LYS 149 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 1p9a n LEU 150 N 0.67 3.09 -0.04 -0.35 7.94 -1.03 -4.55 117.00 122.73 1p9a n LEU 150 Ca 0.15 1.10 -0.05 0.00 -1.11 0.00 0.00 56.01 56.10 1p9a n LEU 150 Cb 0.36 -1.43 -0.06 0.00 0.53 0.00 0.00 43.42 42.83 1p9a n LEU 150 CO 0.11 -0.34 -0.79 -0.62 -1.11 0.00 0.00 177.39 174.64 1p9a n GLU 151 N 3.09 2.06 -4.24 1.96 1.02 0.13 -2.76 120.64 121.90 1p9a n GLU 151 Ca 0.16 0.01 -0.20 0.00 -0.02 0.00 0.00 57.16 57.11 1p9a n GLU 151 Cb 0.29 -1.21 -0.16 0.00 -0.02 0.00 0.00 31.44 30.34 1p9a n GLU 151 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1p9a s LYS 152 N -2.20 0.93 -0.08 3.49 1.02 -0.57 0.03 119.74 122.36 1p9a s LYS 152 Ca -0.07 -0.16 0.00 0.00 0.02 0.00 0.00 55.97 55.77 1p9a s LYS 152 Cb 0.03 -0.89 0.02 0.00 -0.52 0.00 0.00 37.83 36.47 1p9a s LYS 152 CO 0.31 -0.05 -0.05 -1.17 -0.92 0.00 0.00 175.35 173.48 1p9a s LEU 153 N 0.79 1.10 -0.18 3.17 2.96 -0.43 -1.43 118.68 124.66 1p9a s LEU 153 Ca -0.11 -0.19 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 1p9a s LEU 153 Cb -0.14 -0.61 0.02 0.00 0.50 0.00 0.00 46.19 45.96 1p9a s LEU 153 CO 0.01 -0.10 -0.19 -0.55 -1.32 0.00 0.00 176.35 174.19 1p9a s SER 154 N 1.44 3.15 -0.08 3.68 0.15 -0.40 -1.00 113.70 120.65 1p9a s SER 154 Ca -0.02 -0.67 0.12 0.00 0.70 0.00 0.00 55.95 56.08 1p9a s SER 154 Cb -0.13 -1.45 0.18 0.00 -1.71 0.00 0.00 66.02 62.91 1p9a s SER 154 CO -0.04 -0.02 1.09 0.18 1.20 0.00 0.00 173.24 175.66 1p9a n LEU 155 N 4.63 1.52 -4.72 3.45 4.77 0.43 -0.84 117.00 126.23 1p9a n LEU 155 Ca -0.20 -2.33 -0.34 0.00 -0.03 0.00 0.00 56.01 53.10 1p9a n LEU 155 Cb 0.50 -0.27 0.09 0.00 -2.33 0.00 0.00 43.42 41.40 1p9a n LEU 155 CO 0.25 0.54 0.81 0.00 -1.33 0.00 0.00 177.39 177.66 1p9a s ALA 156 N -1.84 2.14 -1.47 -1.18 0.00 -0.89 -3.81 121.76 114.71 1p9a s ALA 156 Ca 0.20 0.91 -0.07 0.00 0.00 0.00 0.00 51.96 53.00 1p9a s ALA 156 Cb 0.18 -3.48 0.05 0.00 0.00 0.00 0.00 23.12 19.87 1p9a s ALA 156 CO 0.02 -1.84 0.70 0.09 0.00 0.00 0.00 175.76 174.73 1p9a n ASN 157 N -2.64 -2.23 0.00 0.00 4.13 -0.10 -1.48 115.26 112.94 1p9a n ASN 157 Ca 0.14 -0.90 0.00 0.00 1.68 0.00 0.00 54.58 55.49 1p9a n ASN 157 Cb 0.50 -3.47 0.00 0.00 -1.54 0.00 0.00 39.78 35.27 1p9a n ASN 157 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 1p9a n ASN 158 N -2.91 0.47 -1.30 6.41 3.02 -1.24 -3.03 115.26 116.68 1p9a n ASN 158 Ca -0.15 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.38 1p9a n ASN 158 Cb 0.61 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.89 1p9a n ASN 158 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1p9a n ASN 159 N 0.00 2.30 -4.73 6.41 4.13 0.99 -4.51 115.26 119.85 1p9a n ASN 159 Ca 0.00 -3.33 -0.42 0.00 1.68 0.00 0.00 54.58 52.51 1p9a n ASN 159 Cb 0.00 -0.44 -0.03 0.00 -1.54 0.00 0.00 39.78 37.78 1p9a n ASN 159 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1p9a s LEU 160 N -2.75 4.39 -0.01 3.41 1.43 -0.67 -4.25 118.68 120.22 1p9a s LEU 160 Ca 0.39 2.55 0.14 0.00 -1.03 0.00 0.00 54.13 56.18 1p9a s LEU 160 Cb 0.38 -3.61 -0.20 0.00 0.03 0.00 0.00 46.19 42.79 1p9a s LEU 160 CO -0.06 -0.69 0.35 0.35 0.23 0.00 0.00 176.35 176.54 1p9a n THR 161 N 2.99 0.00 -3.44 5.49 -2.24 -1.06 -0.11 114.28 115.92 1p9a n THR 161 Ca 0.09 -0.29 -0.12 0.00 -2.27 0.00 0.00 64.05 61.46 1p9a n THR 161 Cb 0.41 0.35 -0.02 0.00 -2.10 0.00 0.00 70.33 68.97 1p9a n THR 161 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 1p9a s GLU 162 N -2.81 1.29 -0.02 -0.78 -1.05 -1.26 -3.38 118.70 110.69 1p9a s GLU 162 Ca -0.03 -0.48 0.06 0.00 -0.15 0.00 0.00 54.97 54.37 1p9a s GLU 162 Cb 0.09 0.59 -0.02 0.00 -0.44 0.00 0.00 34.13 34.34 1p9a s GLU 162 CO 0.56 -0.57 -0.21 -0.51 0.95 0.00 0.00 175.26 175.49 1p9a s LEU 163 N -2.75 2.38 0.34 1.83 1.43 -1.26 -4.65 118.68 115.99 1p9a s LEU 163 Ca 0.01 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 52.46 1p9a s LEU 163 Cb -0.01 -1.44 -0.11 0.00 0.03 0.00 0.00 46.19 44.66 1p9a s LEU 163 CO -0.12 0.32 1.39 -2.84 0.23 0.00 0.00 176.35 175.33 1p9a s PRO 164 N -0.77 4.25 0.33 1.29 0.02 -1.26 -4.77 135.00 134.09 1p9a s PRO 164 Ca 0.11 2.36 -0.29 0.00 0.02 0.00 0.00 61.00 63.20 1p9a s PRO 164 Cb -0.10 -3.04 -0.11 0.00 0.02 0.00 0.00 34.50 31.27 1p9a s PRO 164 CO 0.00 -0.35 1.42 0.00 -0.33 0.00 0.00 177.00 177.75 1p9a s ALA 165 N -0.96 3.57 0.00 -1.55 0.00 -1.26 -2.23 121.76 119.34 1p9a s ALA 165 Ca 0.52 1.41 0.00 0.00 0.00 0.00 0.00 51.96 53.89 1p9a s ALA 165 Cb -0.43 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.14 1p9a s ALA 165 CO 0.55 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.88 1p9a n GLY 166 N 1.10 0.88 0.37 0.00 0.00 -1.26 -4.93 105.19 101.34 1p9a n GLY 166 Ca 0.02 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.24 1p9a n GLY 166 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1p9a h LEU 167 N 0.00 0.60 -0.89 0.99 5.85 -1.78 -1.67 115.31 118.41 1p9a h LEU 167 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1p9a h LEU 167 Cb 0.00 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1p9a h LEU 167 CO 0.00 0.11 -0.39 0.18 -0.34 0.00 0.00 178.44 178.00 1p9a n LEU 168 N -4.78 1.78 -4.74 2.25 4.77 -1.26 -4.76 117.00 110.25 1p9a n LEU 168 Ca 0.26 -0.62 -0.42 0.00 -0.03 0.00 0.00 56.01 55.20 1p9a n LEU 168 Cb 0.78 -0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.81 1p9a n LEU 168 CO 0.20 0.33 1.20 0.20 -1.33 0.00 0.00 177.39 177.99 1p9a s ASN 169 N -2.46 6.54 0.00 -1.43 -0.87 -0.63 -1.99 114.94 114.10 1p9a s ASN 169 Ca 0.21 2.74 0.00 0.00 -1.57 0.00 0.00 52.86 54.24 1p9a s ASN 169 Cb 0.19 -2.62 0.00 0.00 -0.02 0.00 0.00 41.25 38.80 1p9a s ASN 169 CO 0.54 -0.82 0.00 0.61 -2.57 0.00 0.00 177.10 174.87 1p9a n GLY 170 N 2.81 1.53 3.11 0.66 0.00 -1.26 -4.97 105.19 107.07 1p9a n GLY 170 Ca 0.10 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 1p9a n GLY 170 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p9a n LEU 171 N 0.00 6.10 0.00 0.99 4.77 -0.84 -4.78 117.00 123.24 1p9a n LEU 171 Ca 0.00 -4.80 0.10 0.00 -0.03 0.00 0.00 56.01 51.28 1p9a n LEU 171 Cb 0.00 -1.46 0.59 0.00 -2.33 0.00 0.00 43.42 40.22 1p9a n LEU 171 CO 0.00 1.30 0.85 -0.62 -1.33 0.00 0.00 177.39 177.59 1p9a n GLU 172 N 3.47 0.92 -0.00 3.23 -0.58 -1.26 -3.03 120.64 123.39 1p9a n GLU 172 Ca 0.33 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 57.08 1p9a n GLU 172 Cb 0.37 -1.34 0.00 0.00 -0.57 0.00 0.00 31.44 29.91 1p9a n GLU 172 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1p9a n ASN 173 N -0.84 1.79 -4.69 1.62 4.13 -1.26 -5.02 115.26 110.99 1p9a n ASN 173 Ca 0.15 -1.76 -0.42 0.00 1.68 0.00 0.00 54.58 54.22 1p9a n ASN 173 Cb 0.07 -0.00 -0.03 0.00 -1.54 0.00 0.00 39.78 38.27 1p9a n ASN 173 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1p9a s LEU 174 N -0.77 4.35 -0.02 3.41 2.96 -1.11 -4.33 118.68 123.18 1p9a s LEU 174 Ca 0.01 2.41 0.03 0.00 -0.22 0.00 0.00 54.13 56.36 1p9a s LEU 174 Cb 0.00 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.08 1p9a s LEU 174 CO 0.00 -0.86 0.05 -0.90 -1.32 0.00 0.00 176.35 173.32 1p9a n ASP 175 N 5.61 4.12 -3.91 3.68 5.68 0.10 -4.64 116.55 127.20 1p9a n ASP 175 Ca 0.15 0.00 -0.22 0.00 -0.50 0.00 0.00 54.79 54.23 1p9a n ASP 175 Cb 0.41 0.86 -0.17 0.00 -1.14 0.00 0.00 41.12 41.09 1p9a n ASP 175 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1p9a s THR 176 N -2.17 0.67 -0.15 2.12 2.01 -0.66 -1.18 115.64 116.27 1p9a s THR 176 Ca -0.02 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 61.80 1p9a s THR 176 Cb 0.02 -0.68 0.04 0.00 0.01 0.00 0.00 72.50 71.88 1p9a s THR 176 CO 0.15 0.26 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.08 1p9a s LEU 177 N 1.01 1.42 -0.32 4.42 2.96 0.03 -1.32 118.68 126.88 1p9a s LEU 177 Ca -0.09 -0.56 -0.06 0.00 -0.22 0.00 0.00 54.13 53.20 1p9a s LEU 177 Cb -0.14 -0.84 0.03 0.00 0.50 0.00 0.00 46.19 45.74 1p9a s LEU 177 CO -0.00 -0.18 0.08 -0.76 -1.32 0.00 0.00 176.35 174.16 1p9a s LEU 178 N 1.69 4.12 -0.01 -0.68 1.43 -0.17 -1.12 118.68 123.94 1p9a s LEU 178 Ca 0.02 -1.07 0.01 0.00 -1.03 0.00 0.00 54.13 52.06 1p9a s LEU 178 Cb -0.15 -1.84 0.02 0.00 0.03 0.00 0.00 46.19 44.25 1p9a s LEU 178 CO -0.08 -0.28 0.82 0.18 0.23 0.00 0.00 176.35 177.22 1p9a n LEU 179 N 4.79 1.19 -4.72 1.79 4.77 -0.17 -0.43 117.00 124.22 1p9a n LEU 179 Ca -0.13 -1.28 -0.33 0.00 -0.03 0.00 0.00 56.01 54.25 1p9a n LEU 179 Cb 0.45 -0.03 0.11 0.00 -2.33 0.00 0.00 43.42 41.62 1p9a n LEU 179 CO 0.31 0.32 0.74 0.00 -1.33 0.00 0.00 177.39 177.42 1p9a s GLN 180 N -0.70 1.94 -1.29 3.23 0.00 -1.01 -4.02 119.66 117.82 1p9a s GLN 180 Ca 0.02 1.55 -0.05 0.00 -0.00 0.00 0.00 55.36 56.88 1p9a s GLN 180 Cb 0.02 -1.83 0.01 0.00 0.00 0.00 0.00 33.01 31.20 1p9a s GLN 180 CO 0.00 -1.94 1.09 0.39 0.00 0.00 0.00 175.29 174.83 1p9a n GLU 181 N -3.23 -7.25 0.00 9.60 -0.58 -0.66 -0.92 120.64 117.59 1p9a n GLU 181 Ca 0.12 0.83 0.00 0.00 -0.42 0.00 0.00 57.16 57.69 1p9a n GLU 181 Cb 0.51 -5.85 0.00 0.00 -0.57 0.00 0.00 31.44 25.53 1p9a n GLU 181 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1p9a n ASN 182 N -3.07 1.44 -1.48 1.62 3.02 -1.22 -3.31 115.26 112.27 1p9a n ASN 182 Ca -0.13 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.33 1p9a n ASN 182 Cb 0.61 0.00 0.10 0.00 -0.61 0.00 0.00 39.78 39.88 1p9a n ASN 182 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1p9a n SER 183 N 0.00 3.12 -4.74 6.41 2.88 0.85 -4.50 113.62 117.64 1p9a n SER 183 Ca 0.00 -3.56 -0.41 0.00 -1.33 0.00 0.00 58.87 53.56 1p9a n SER 183 Cb 0.00 -0.42 -0.03 0.00 -0.75 0.00 0.00 64.21 63.01 1p9a n SER 183 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1p9a s LEU 184 N -3.23 4.40 -0.10 2.46 1.43 -0.88 -4.26 118.68 118.50 1p9a s LEU 184 Ca 0.43 2.52 0.13 0.00 -1.03 0.00 0.00 54.13 56.18 1p9a s LEU 184 Cb 0.39 -3.61 -0.19 0.00 0.03 0.00 0.00 46.19 42.80 1p9a s LEU 184 CO -0.02 -0.61 0.14 -1.22 0.23 0.00 0.00 176.35 174.87 1p9a n TYR 185 N 2.57 0.00 -3.88 0.29 4.02 -1.22 -3.16 117.16 115.78 1p9a n TYR 185 Ca 0.07 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.87 1p9a n TYR 185 Cb 0.42 -0.58 -0.01 0.00 -0.02 0.00 0.00 39.34 39.14 1p9a n TYR 185 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 1p9a s THR 186 N -2.58 0.00 -0.10 -0.72 -1.32 -1.26 -0.28 115.64 109.37 1p9a s THR 186 Ca -0.06 -1.10 0.03 0.00 -1.21 0.00 0.00 61.69 59.34 1p9a s THR 186 Cb 0.06 -2.31 0.01 0.00 -1.51 0.00 0.00 72.50 68.75 1p9a s THR 186 CO 0.60 0.00 -0.18 -0.63 -2.21 0.00 0.00 174.62 172.19 1p9a s ILE 187 N -3.45 1.70 0.44 5.08 -1.09 -1.26 -4.72 121.20 117.90 1p9a s ILE 187 Ca 0.15 -0.78 -0.24 0.00 -2.23 0.00 0.00 60.65 57.54 1p9a s ILE 187 Cb -0.05 -1.51 -0.10 0.00 -1.58 0.00 0.00 42.46 39.23 1p9a s ILE 187 CO 0.09 0.48 1.13 -2.65 -1.23 0.00 0.00 174.94 172.76 1p9a n PRO 188 N 3.92 1.56 -1.81 2.79 -0.02 -1.26 -4.75 135.00 135.44 1p9a n PRO 188 Ca -0.20 0.56 -0.42 0.00 -2.02 0.00 0.00 63.50 61.43 1p9a n PRO 188 Cb 0.52 -2.21 -0.02 0.00 -0.02 0.00 0.00 33.50 31.76 1p9a n PRO 188 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1p9a s LYS 189 N -2.18 4.15 -0.18 -0.52 2.20 -1.26 -1.82 119.74 120.12 1p9a s LYS 189 Ca 0.64 2.53 0.00 0.00 -0.36 0.00 0.00 55.97 58.77 1p9a s LYS 189 Cb -0.52 -3.06 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1p9a s LYS 189 CO 0.56 -0.64 0.00 0.41 -0.36 0.00 0.00 175.35 175.32 1p9a n GLY 190 N 2.86 0.50 0.32 5.54 0.00 -1.26 -4.93 105.19 108.21 1p9a n GLY 190 Ca 0.11 -0.23 0.11 0.00 0.00 0.00 0.00 46.02 46.01 1p9a n GLY 190 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1p9a h PHE 191 N 0.00 0.78 -0.01 1.61 3.57 -1.71 -1.54 116.94 119.64 1p9a h PHE 191 Ca -0.04 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1p9a h PHE 191 Cb 0.32 -0.21 0.00 0.00 2.79 0.00 0.00 35.95 38.85 1p9a h PHE 191 CO 0.18 0.09 -0.14 1.19 -2.23 0.00 0.00 178.31 177.40 1p9a n PHE 192 N -4.92 0.00 -3.66 0.41 3.01 -1.26 -4.54 117.46 106.49 1p9a n PHE 192 Ca 0.21 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.67 1p9a n PHE 192 Cb 0.56 -0.09 0.00 0.00 -0.01 0.00 0.00 39.48 39.95 1p9a n PHE 192 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1p9a n GLY 193 N 1.26 2.16 0.84 1.37 0.00 -0.58 -3.02 105.19 107.22 1p9a n GLY 193 Ca 0.15 -0.40 0.07 0.00 0.00 0.00 0.00 46.02 45.84 1p9a n GLY 193 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1p9a n SER 194 N -0.63 3.36 -4.76 1.61 3.41 -1.26 -5.00 113.62 110.34 1p9a n SER 194 Ca 0.00 -2.22 -0.40 0.00 -0.26 0.00 0.00 58.87 56.00 1p9a n SER 194 Cb 0.00 -0.34 -0.06 0.00 -0.26 0.00 0.00 64.21 63.55 1p9a n SER 194 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1p9a s HIS 195 N -1.39 3.94 -0.37 7.33 5.65 -1.17 -5.02 115.29 124.26 1p9a s HIS 195 Ca 0.31 1.79 -0.23 0.00 0.25 0.00 0.00 55.06 57.19 1p9a s HIS 195 Cb 0.19 -2.89 0.01 0.00 -1.18 0.00 0.00 32.58 28.71 1p9a s HIS 195 CO 0.17 0.47 0.76 -1.17 -0.65 0.00 0.00 174.74 174.32 1p9a s LEU 196 N -1.21 4.17 -0.48 8.88 2.96 -1.26 -5.01 118.68 126.73 1p9a s LEU 196 Ca 0.39 0.26 -0.12 0.00 -0.22 0.00 0.00 54.13 54.44 1p9a s LEU 196 Cb -0.24 -2.98 0.10 0.00 0.50 0.00 0.00 46.19 43.57 1p9a s LEU 196 CO 0.29 -0.73 0.38 -0.22 -1.32 0.00 0.00 176.35 174.75 1p9a s LEU 197 N 3.05 5.68 0.33 -0.68 2.96 -1.26 -4.89 118.68 123.87 1p9a s LEU 197 Ca 0.30 -1.65 0.04 0.00 -0.22 0.00 0.00 54.13 52.60 1p9a s LEU 197 Cb -0.13 -2.09 0.58 0.00 0.50 0.00 0.00 46.19 45.04 1p9a s LEU 197 CO 0.17 -0.69 1.86 1.55 -1.32 0.00 0.00 176.35 177.93 1p9a h PRO 198 N 8.62 0.54 -3.69 0.98 0.13 -1.82 -3.41 132.00 133.34 1p9a h PRO 198 Ca -0.25 -0.12 -0.58 0.00 -0.87 0.00 0.00 66.00 64.18 1p9a h PRO 198 Cb 1.09 -0.08 -0.40 0.00 0.13 0.00 0.00 31.00 31.75 1p9a h PRO 198 CO 0.89 0.57 -0.76 -0.06 -0.23 0.00 0.00 178.00 178.41 1p9a s PHE 199 N -4.96 1.77 -0.07 1.56 0.40 -0.33 -4.49 117.98 111.87 1p9a s PHE 199 Ca -0.08 -1.66 0.05 0.00 -0.60 0.00 0.00 56.93 54.64 1p9a s PHE 199 Cb 0.15 -1.65 -0.01 0.00 0.51 0.00 0.00 43.02 42.02 1p9a s PHE 199 CO 0.77 -0.83 -0.23 0.00 0.70 0.00 0.00 175.22 175.63 1p9a s ALA 200 N 1.60 2.04 -0.25 5.36 0.00 -0.08 -0.79 121.76 129.63 1p9a s ALA 200 Ca 0.07 -0.95 0.01 0.00 0.00 0.00 0.00 51.96 51.09 1p9a s ALA 200 Cb -0.17 -0.68 0.05 0.00 0.00 0.00 0.00 23.12 22.31 1p9a s ALA 200 CO -0.20 0.35 -0.10 -0.06 0.00 0.00 0.00 175.76 175.76 1p9a s PHE 201 N 0.04 3.18 0.00 0.00 0.40 -0.28 -0.95 117.98 120.37 1p9a s PHE 201 Ca -0.08 -2.06 0.00 0.00 -0.60 0.00 0.00 56.93 54.19 1p9a s PHE 201 Cb -0.15 -1.98 0.00 0.00 0.51 0.00 0.00 43.02 41.41 1p9a s PHE 201 CO 0.05 -0.84 0.58 1.28 0.70 0.00 0.00 175.22 177.00 1p9a n LEU 202 N 4.52 1.02 -4.71 -0.37 4.77 -1.26 -1.00 117.00 119.97 1p9a n LEU 202 Ca -0.15 -1.02 -0.29 0.00 -0.03 0.00 0.00 56.01 54.52 1p9a n LEU 202 Cb 0.44 0.00 0.16 0.00 -2.33 0.00 0.00 43.42 41.69 1p9a n LEU 202 CO 0.23 0.26 0.66 -1.38 -1.33 0.00 0.00 177.39 175.83 1p9a s HIS 203 N -0.33 2.25 -1.05 -1.77 -3.43 -1.26 -4.11 115.29 105.59 1p9a s HIS 203 Ca 0.00 1.02 0.00 0.00 -0.80 0.00 0.00 55.06 55.28 1p9a s HIS 203 Cb 0.00 -3.26 0.00 0.00 -1.43 0.00 0.00 32.58 27.89 1p9a s HIS 203 CO 0.00 -2.66 0.00 0.41 -2.00 0.00 0.00 174.74 170.49 1p9a n GLY 204 N -1.36 0.81 3.35 -1.38 0.00 -1.26 -1.66 105.19 103.70 1p9a n GLY 204 Ca 0.06 -0.52 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 1p9a n GLY 204 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1p9a s ASN 205 N -2.78 3.24 -1.50 1.61 0.01 -1.26 -3.28 114.94 110.99 1p9a s ASN 205 Ca 0.00 -0.54 -0.09 0.00 -0.71 0.00 0.00 52.86 51.52 1p9a s ASN 205 Cb 0.00 -0.35 0.01 0.00 0.41 0.00 0.00 41.25 41.32 1p9a s ASN 205 CO 0.00 0.27 2.62 -0.81 -1.51 0.00 0.00 177.10 177.67 1p9a n PRO 206 N 1.88 3.81 -1.64 -0.60 -0.04 -1.19 -3.37 135.00 133.85 1p9a n PRO 206 Ca -0.17 -2.70 -0.47 0.00 -0.04 0.00 0.00 63.50 60.12 1p9a n PRO 206 Cb 0.52 -2.84 -0.04 0.00 -0.04 0.00 0.00 33.50 31.10 1p9a n PRO 206 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1p9a n TRP 207 N 3.48 1.95 -3.22 0.54 7.02 -1.19 -4.30 117.44 121.72 1p9a n TRP 207 Ca 0.67 0.45 -0.43 0.00 -1.02 0.00 0.00 57.50 57.18 1p9a n TRP 207 Cb 0.27 -2.44 -0.08 0.00 -2.42 0.00 0.00 31.31 26.64 1p9a n TRP 207 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 1p9a s LEU 208 N 0.54 4.60 -0.87 -0.99 2.96 0.62 0.32 118.68 125.86 1p9a s LEU 208 Ca 0.76 -0.39 -0.20 0.00 -0.22 0.00 0.00 54.13 54.08 1p9a s LEU 208 Cb -0.75 -2.57 0.11 0.00 0.50 0.00 0.00 46.19 43.48 1p9a s LEU 208 CO 0.45 -0.63 1.13 0.00 -1.32 0.00 0.00 176.35 175.97 1p9a n ASN 210 N 7.12 0.93 0.31 0.00 0.23 -1.26 -5.00 115.26 117.59 1p9a n ASN 210 Ca 0.18 -1.51 0.19 0.00 -0.53 0.00 0.00 54.58 52.91 1p9a n ASN 210 Cb 0.48 0.25 0.99 0.00 -2.08 0.00 0.00 39.78 39.43 1p9a n ASN 210 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1p9a n GLU 212 N -3.29 0.04 0.00 0.00 4.71 -1.26 -2.80 120.64 118.05 1p9a n GLU 212 Ca -0.02 0.14 0.13 0.00 -0.01 0.00 0.00 57.16 57.40 1p9a n GLU 212 Cb 0.15 -1.56 0.40 0.00 -1.01 0.00 0.00 31.44 29.42 1p9a n GLU 212 CO 0.00 0.00 0.00 1.51 0.09 0.00 0.00 177.13 178.73 1p9a n ILE 213 N -1.64 0.00 -0.01 -3.67 0.13 -0.59 -4.37 119.36 109.21 1p9a n ILE 213 Ca 0.05 -0.19 0.04 0.00 -1.10 0.00 0.00 62.75 61.55 1p9a n ILE 213 Cb 0.29 0.52 0.43 0.00 -0.84 0.00 0.00 39.64 40.03 1p9a n ILE 213 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 1p9a h LEU 214 N 1.83 0.47 -0.29 9.51 3.38 -1.66 0.53 115.31 129.08 1p9a h LEU 214 Ca 0.00 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1p9a h LEU 214 Cb 0.54 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1p9a h LEU 214 CO 0.00 0.34 0.12 0.22 0.09 0.00 0.00 178.44 179.21 1p9a h TYR 215 N 0.56 0.43 -0.71 1.13 3.20 -1.84 -1.82 116.97 117.92 1p9a h TYR 215 Ca 0.16 -0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 1p9a h TYR 215 Cb -0.04 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.07 1p9a h TYR 215 CO -0.00 0.42 0.22 0.35 -1.64 0.00 0.00 178.16 177.51 1p9a h PHE 216 N 0.32 1.14 -0.28 -3.82 3.57 -1.68 -1.41 116.94 114.78 1p9a h PHE 216 Ca 0.10 -0.12 0.04 0.00 3.53 0.00 0.00 57.97 61.52 1p9a h PHE 216 Cb 0.17 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 38.54 1p9a h PHE 216 CO -0.01 0.91 0.08 -0.09 -2.23 0.00 0.00 178.31 176.97 1p9a h ARG 217 N 1.05 0.19 -0.61 1.11 2.43 -0.67 -0.27 114.38 117.59 1p9a h ARG 217 Ca 0.23 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.32 1p9a h ARG 217 Cb 0.30 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.79 1p9a h ARG 217 CO -0.01 0.12 0.13 -0.09 -1.51 0.00 0.00 179.97 178.61 1p9a h ARG 218 N 0.19 1.00 -0.78 0.20 9.65 -1.14 -2.38 114.38 121.13 1p9a h ARG 218 Ca 0.13 -0.25 -0.01 0.00 -1.10 0.00 0.00 59.98 58.75 1p9a h ARG 218 Cb 0.12 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 28.54 1p9a h ARG 218 CO -0.15 0.92 0.46 2.35 2.80 0.00 0.00 179.97 186.35 1p9a h TRP 219 N 0.91 1.03 -0.75 2.20 7.01 -0.80 -1.41 115.95 124.14 1p9a h TRP 219 Ca 0.19 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.15 1p9a h TRP 219 Cb 0.39 -0.34 -0.03 0.00 -2.10 0.00 0.00 29.16 27.07 1p9a h TRP 219 CO 0.03 0.69 0.32 -0.07 -2.79 0.00 0.00 178.44 176.62 1p9a h LEU 220 N 1.07 1.01 -0.50 0.65 3.38 -0.84 0.80 115.31 120.88 1p9a h LEU 220 Ca 0.28 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 1p9a h LEU 220 Cb -0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1p9a h LEU 220 CO -0.05 0.89 -0.12 1.56 0.09 0.00 0.00 178.44 180.81 1p9a h GLN 221 N 1.08 0.97 0.00 1.13 4.20 -1.04 0.74 115.11 122.19 1p9a h GLN 221 Ca 0.25 -0.37 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1p9a h GLN 221 Cb 0.18 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 27.90 1p9a h GLN 221 CO -0.02 1.04 0.00 -0.44 -0.67 0.00 0.00 178.83 178.73 1p9a h ASP 222 N 0.83 0.00 0.00 1.46 3.32 -0.91 -3.29 116.42 117.83 1p9a h ASP 222 Ca 0.13 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 1p9a h ASP 222 Cb 0.68 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.16 1p9a h ASP 222 CO 0.05 0.00 -0.47 0.59 -1.72 0.00 0.00 179.24 177.69 1p9a n ASN 223 N -2.47 1.58 -0.23 6.45 3.02 0.24 -4.85 115.26 119.00 1p9a n ASN 223 Ca 0.04 -3.18 0.23 0.00 -0.03 0.00 0.00 54.58 51.65 1p9a n ASN 223 Cb 0.40 -0.43 0.59 0.00 -0.61 0.00 0.00 39.78 39.72 1p9a n ASN 223 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1p9a h ALA 224 N 0.66 2.44 -0.01 5.41 0.00 -0.92 0.97 119.26 127.81 1p9a h ALA 224 Ca -0.04 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1p9a h ALA 224 Cb 1.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1p9a h ALA 224 CO 0.02 -0.73 0.00 0.39 0.00 0.00 0.00 179.25 178.93 1p9a n GLU 225 N -4.44 1.16 -0.09 0.00 -0.58 -1.26 -3.43 120.64 111.99 1p9a n GLU 225 Ca 0.20 -0.23 0.04 0.00 -0.42 0.00 0.00 57.16 56.75 1p9a n GLU 225 Cb 0.82 -1.47 0.09 0.00 -0.57 0.00 0.00 31.44 30.31 1p9a n GLU 225 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1p9a n ASN 226 N -0.70 2.41 -4.47 1.62 3.02 0.33 -4.79 115.26 112.68 1p9a n ASN 226 Ca 0.22 -1.85 -0.35 0.00 -0.03 0.00 0.00 54.58 52.57 1p9a n ASN 226 Cb 0.16 -0.12 -0.12 0.00 -0.61 0.00 0.00 39.78 39.09 1p9a n ASN 226 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1p9a s VAL 227 N -0.92 4.11 0.32 2.41 1.01 -1.22 -0.90 120.40 125.21 1p9a s VAL 227 Ca 0.14 -0.26 0.03 0.00 0.00 0.00 0.00 61.98 61.90 1p9a s VAL 227 Cb 0.08 -2.87 -0.06 0.00 0.00 0.00 0.00 36.38 33.53 1p9a s VAL 227 CO 0.10 0.42 0.06 -0.31 0.00 0.00 0.00 175.10 175.38 1p9a s TYR 228 N 1.00 1.90 -0.13 5.22 1.51 -0.12 -0.10 117.35 126.64 1p9a s TYR 228 Ca 0.02 -0.99 -0.01 0.00 -1.01 0.00 0.00 57.07 55.08 1p9a s TYR 228 Cb -0.14 -1.23 -0.02 0.00 -0.11 0.00 0.00 41.96 40.46 1p9a s TYR 228 CO 0.02 -0.05 -0.09 0.08 -1.11 0.00 0.00 175.55 174.41 1p9a s VAL 229 N -3.36 3.45 0.32 0.71 1.01 -1.26 -4.33 120.40 116.94 1p9a s VAL 229 Ca 0.37 -0.53 -0.28 0.00 0.00 0.00 0.00 61.98 61.53 1p9a s VAL 229 Cb 0.09 -2.47 -0.10 0.00 0.00 0.00 0.00 36.38 33.90 1p9a s VAL 229 CO 0.15 0.52 1.23 0.86 0.00 0.00 0.00 175.10 177.87 1p9a s TRP 230 N 0.17 3.20 -0.12 5.22 -0.11 -1.26 -5.03 118.94 121.01 1p9a s TRP 230 Ca -0.05 1.51 -0.04 0.00 1.22 0.00 0.00 56.10 58.75 1p9a s TRP 230 Cb -0.14 -3.53 0.05 0.00 -1.50 0.00 0.00 33.47 28.34 1p9a s TRP 230 CO 0.04 -1.42 0.08 0.21 -4.62 0.00 0.00 176.95 171.24 1p9a s LYS 231 N -1.75 0.04 0.14 5.86 2.20 -1.26 -5.12 119.74 119.84 1p9a s LYS 231 Ca 0.49 0.07 -0.35 0.00 -0.36 0.00 0.00 55.97 55.82 1p9a s LYS 231 Cb -0.36 -1.37 -0.15 0.00 -1.51 0.00 0.00 37.83 34.44 1p9a s LYS 231 CO 0.48 -0.54 1.46 0.94 -0.36 0.00 0.00 175.35 177.33 1p9a n GLN 232 N 5.28 1.73 -0.97 4.03 -0.06 -1.26 -2.32 117.38 123.81 1p9a n GLN 232 Ca -0.06 0.62 0.00 0.00 -2.00 0.00 0.00 57.00 55.57 1p9a n GLN 232 Cb 0.49 -2.33 0.00 0.00 -4.06 0.00 0.00 30.24 24.34 1p9a n GLN 232 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1p9a n GLY 233 N 2.96 0.46 3.26 1.69 0.00 -1.26 -5.02 105.19 107.28 1p9a n GLY 233 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1p9a n GLY 233 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1p9a s VAL 234 N -2.09 2.11 0.44 1.61 1.01 -0.98 -5.12 120.40 117.37 1p9a s VAL 234 Ca 0.00 -1.03 -0.20 0.00 0.00 0.00 0.00 61.98 60.74 1p9a s VAL 234 Cb 0.00 -1.78 -0.10 0.00 0.00 0.00 0.00 36.38 34.50 1p9a s VAL 234 CO 0.00 0.57 0.95 -0.62 0.00 0.00 0.00 175.10 175.99 1p9a s ASP 235 N -0.01 6.88 0.00 3.32 -1.08 -1.26 -4.80 116.67 119.72 1p9a s ASP 235 Ca -0.08 1.65 -0.02 0.00 -0.52 0.00 0.00 52.55 53.58 1p9a s ASP 235 Cb -0.15 -2.53 -0.09 0.00 -1.46 0.00 0.00 42.92 38.69 1p9a s ASP 235 CO 0.05 -0.39 2.32 0.52 0.52 0.00 0.00 175.17 178.20 1p9a n VAL 236 N -0.77 2.08 -0.10 1.11 0.31 -1.26 -4.64 118.33 115.07 1p9a n VAL 236 Ca 0.07 -0.78 -0.03 0.00 -0.01 0.00 0.00 64.34 63.59 1p9a n VAL 236 Cb 0.54 -1.63 -0.02 0.00 -0.91 0.00 0.00 33.84 31.81 1p9a n VAL 236 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1p9a n LYS 237 N 1.96 -0.11 0.00 5.55 3.00 -1.26 -3.96 118.16 123.33 1p9a n LYS 237 Ca 0.15 0.76 0.00 0.00 -0.00 0.00 0.00 58.31 59.22 1p9a n LYS 237 Cb 0.58 -1.13 0.00 0.00 0.00 0.00 0.00 35.03 34.47 1p9a n LYS 237 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1p9a n ALA 238 N -2.97 0.97 -0.63 3.14 0.00 -1.26 -5.12 120.51 114.64 1p9a n ALA 238 Ca 0.00 -0.16 -0.25 0.00 0.00 0.00 0.00 53.44 53.04 1p9a n ALA 238 Cb 0.06 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.48 1p9a n ALA 238 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.50 177.38 1p9a n MET 239 N 0.00 0.00 -1.74 0.00 1.56 -1.25 -4.72 117.12 110.97 1p9a n MET 239 Ca 0.00 0.00 -0.42 0.00 -0.27 0.00 0.00 57.70 57.01 1p9a n MET 239 Cb 0.49 -0.62 -0.01 0.00 2.15 0.00 0.00 33.22 35.23 1p9a n MET 239 CO 0.00 0.00 0.00 2.41 -0.73 0.00 0.00 175.97 177.65 1p9a n THR 240 N 0.74 1.13 -1.42 1.12 -1.04 -1.26 -4.97 114.28 108.58 1p9a n THR 240 Ca 0.09 -0.28 -0.30 0.00 -2.04 0.00 0.00 64.05 61.52 1p9a n THR 240 Cb 0.03 -1.91 0.11 0.00 -1.82 0.00 0.00 70.33 66.73 1p9a n THR 240 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1p9a s SER 241 N 0.40 4.12 -0.50 8.00 1.04 -1.26 -4.77 113.70 120.73 1p9a s SER 241 Ca 0.63 1.39 0.06 0.00 0.48 0.00 0.00 55.95 58.51 1p9a s SER 241 Cb -0.51 -2.10 0.19 0.00 0.10 0.00 0.00 66.02 63.70 1p9a s SER 241 CO 0.50 -2.22 0.66 -3.20 0.98 0.00 0.00 173.24 169.97 1p9a n ASN 242 N -3.60 -2.92 0.25 7.02 5.15 0.86 -4.98 115.26 117.04 1p9a n ASN 242 Ca 0.07 -2.83 0.09 0.00 -0.60 0.00 0.00 54.58 51.31 1p9a n ASN 242 Cb 0.56 1.35 0.65 0.00 -0.53 0.00 0.00 39.78 41.81 1p9a n ASN 242 CO 0.00 0.00 0.00 1.62 1.40 0.00 0.00 177.26 180.28 1p9a h VAL 243 N 4.89 0.91 0.00 3.44 3.04 -1.71 -1.70 116.25 125.12 1p9a h VAL 243 Ca 0.09 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 65.52 1p9a h VAL 243 Cb 1.07 1.15 0.00 0.00 -2.01 0.00 0.00 31.29 31.50 1p9a h VAL 243 CO 0.08 0.07 0.00 0.00 -1.01 0.00 0.00 177.57 176.71 1p9a n ALA 244 N -2.46 1.41 0.32 3.17 0.00 -1.26 -2.13 120.51 119.56 1p9a n ALA 244 Ca -0.03 -0.03 0.15 0.00 0.00 0.00 0.00 53.44 53.53 1p9a n ALA 244 Cb 0.16 -1.12 0.50 0.00 0.00 0.00 0.00 19.45 18.98 1p9a n ALA 244 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1p9a h SER 245 N 0.00 0.00 -3.56 0.00 4.64 -1.71 -3.41 113.55 109.51 1p9a h SER 245 Ca 0.00 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.69 1p9a h SER 245 Cb 0.11 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.07 1p9a h SER 245 CO 0.00 0.00 0.37 -0.69 -0.87 0.00 0.00 176.83 175.64 1p9a s VAL 246 N -3.43 4.63 0.06 0.95 1.01 -0.91 -4.36 120.40 118.34 1p9a s VAL 246 Ca 0.04 0.36 0.07 0.00 0.00 0.00 0.00 61.98 62.46 1p9a s VAL 246 Cb 0.08 -4.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 1p9a s VAL 246 CO 0.55 -0.77 -0.20 -1.10 0.00 0.00 0.00 175.10 173.58 1p9a s GLN 247 N 3.34 1.29 0.14 2.72 -0.21 -1.26 -0.90 119.66 124.78 1p9a s GLN 247 Ca 0.29 -0.98 -0.31 0.00 0.02 0.00 0.00 55.36 54.38 1p9a s GLN 247 Cb -0.12 -1.43 -0.10 0.00 1.00 0.00 0.00 33.01 32.36 1p9a s GLN 247 CO 0.22 0.36 1.70 0.00 -2.12 0.00 0.00 175.29 175.44 1p9a n ASP 249 N 4.85 -3.56 -3.61 0.00 8.00 0.15 -0.39 116.55 122.00 1p9a n ASP 249 Ca 0.16 0.26 -0.27 0.00 0.71 0.00 0.00 54.79 55.65 1p9a n ASP 249 Cb 0.38 -3.20 0.03 0.00 -0.02 0.00 0.00 41.12 38.32 1p9a n ASP 249 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1p9a n ASN 250 N -1.04 -5.25 -4.48 -2.24 4.05 -0.33 -4.81 115.26 101.15 1p9a n ASN 250 Ca -0.13 -0.58 -0.39 0.00 0.45 0.00 0.00 54.58 53.92 1p9a n ASN 250 Cb 0.50 -4.20 -0.11 0.00 1.23 0.00 0.00 39.78 37.20 1p9a n ASN 250 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1p9a s SER 251 N -3.11 5.77 0.41 1.20 0.15 0.48 -4.99 113.70 113.61 1p9a s SER 251 Ca 0.55 -0.46 0.22 0.00 0.70 0.00 0.00 55.95 56.96 1p9a s SER 251 Cb -0.27 -2.06 1.20 0.00 -1.71 0.00 0.00 66.02 63.18 1p9a s SER 251 CO 0.68 -0.20 1.72 -0.78 1.20 0.00 0.00 173.24 175.86 1p9a h ASP 252 N 8.41 0.38 -0.02 5.45 3.58 -1.92 -0.87 116.42 131.43 1p9a h ASP 252 Ca -0.32 0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.23 1p9a h ASP 252 Cb 1.15 0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.25 1p9a h ASP 252 CO 0.62 -0.00 0.00 0.29 -2.88 0.00 0.00 179.24 177.27 1p9a n LYS 253 N -4.66 1.36 -3.30 0.28 5.02 -1.26 -4.44 118.16 111.16 1p9a n LYS 253 Ca 0.29 -0.53 -0.25 0.00 -2.02 0.00 0.00 58.31 55.80 1p9a n LYS 253 Cb 1.05 -1.47 -0.08 0.00 -0.02 0.00 0.00 35.03 34.51 1p9a n LYS 253 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1p9a n PHE 254 N -0.34 1.44 -2.00 2.13 3.01 -0.33 -5.10 117.46 116.26 1p9a n PHE 254 Ca 0.20 -3.83 -0.40 0.00 1.01 0.00 0.00 57.45 54.44 1p9a n PHE 254 Cb 0.24 -0.44 -0.00 0.00 -0.01 0.00 0.00 39.48 39.27 1p9a n PHE 254 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 1p9a s PRO 255 N -1.74 4.00 0.34 -1.08 0.04 -1.26 -0.98 135.00 134.32 1p9a s PRO 255 Ca 0.37 2.24 0.03 0.00 0.04 0.00 0.00 61.00 63.68 1p9a s PRO 255 Cb 0.16 -2.81 0.63 0.00 0.04 0.00 0.00 34.50 32.52 1p9a s PRO 255 CO -0.07 -0.50 1.97 0.28 0.04 0.00 0.00 177.00 178.72 1p9a h VAL 256 N 2.58 1.10 0.00 -0.36 2.07 -1.33 -1.89 116.25 118.41 1p9a h VAL 256 Ca -0.50 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 66.72 1p9a h VAL 256 Cb 1.25 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1p9a h VAL 256 CO 0.63 0.16 0.00 0.00 0.02 0.00 0.00 177.57 178.38 1p9a n TYR 257 N -4.46 0.00 0.35 1.57 0.18 -1.26 -1.59 117.16 111.94 1p9a n TYR 257 Ca 0.10 0.00 0.04 0.00 1.88 0.00 0.00 57.90 59.92 1p9a n TYR 257 Cb 0.14 -0.25 0.01 0.00 -0.38 0.00 0.00 39.34 38.86 1p9a n TYR 257 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 1p9a n LYS 258 N -1.25 1.66 -1.68 -3.48 4.76 -0.72 -4.91 118.16 112.53 1p9a n LYS 258 Ca 0.07 -0.66 -0.47 0.00 -2.87 0.00 0.00 58.31 54.38 1p9a n LYS 258 Cb 0.10 -1.05 -0.04 0.00 -1.84 0.00 0.00 35.03 32.20 1p9a n LYS 258 CO 0.00 0.00 0.00 0.98 -1.37 0.00 0.00 177.40 177.01 1p9a n TYR 259 N -0.09 2.36 -0.28 2.13 9.36 -0.62 -4.89 117.16 125.13 1p9a n TYR 259 Ca 0.04 -0.03 -0.04 0.00 3.32 0.00 0.00 57.90 61.19 1p9a n TYR 259 Cb 0.18 -2.67 0.12 0.00 -0.63 0.00 0.00 39.34 36.33 1p9a n TYR 259 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1p9a h PRO 260 N 9.04 1.14 -3.15 2.98 0.13 -1.94 -3.48 132.00 136.73 1p9a h PRO 260 Ca -0.48 -0.16 -0.23 0.00 -0.87 0.00 0.00 66.00 64.26 1p9a h PRO 260 Cb 1.26 -0.21 0.05 0.00 0.13 0.00 0.00 31.00 32.24 1p9a h PRO 260 CO 0.94 0.88 -0.36 0.41 -0.23 0.00 0.00 178.00 179.64 1p9a n GLY 261 N -1.04 0.04 3.71 1.56 0.00 -1.26 -4.94 105.19 103.26 1p9a n GLY 261 Ca 0.08 -0.22 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 1p9a n GLY 261 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p9a n LYS 262 N -2.79 2.77 -2.44 1.61 5.02 -1.26 -2.73 118.16 118.34 1p9a n LYS 262 Ca -0.04 1.00 -0.02 0.00 -2.02 0.00 0.00 58.31 57.23 1p9a n LYS 262 Cb 0.55 -2.86 0.01 0.00 -0.02 0.00 0.00 35.03 32.72 1p9a n LYS 262 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1p9a n GLY 263 N 4.03 0.63 3.00 0.72 0.00 -1.26 -5.03 105.19 107.27 1p9a n GLY 263 Ca 0.17 -0.52 -0.21 0.00 0.00 0.00 0.00 46.02 45.45 1p9a n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p9a n PRO 265 N 3.47 -0.07 0.00 0.00 -0.02 -1.26 -5.13 135.00 131.99 1p9a n PRO 265 Ca -0.20 0.04 0.07 0.00 -2.02 0.00 0.00 63.50 61.39 1p9a n PRO 265 Cb 0.53 -2.12 0.43 0.00 -0.02 0.00 0.00 33.50 32.32 1p9a n PRO 265 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89