#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qi9 n SER 4 N -0.74 0.00 -0.51 0.00 7.64 -1.26 -4.89 113.62 113.86 1qi9 n SER 4 Ca -0.05 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.95 1qi9 n SER 4 Cb 0.60 0.00 0.21 0.00 -1.01 0.00 0.00 64.21 64.01 1qi9 n SER 4 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1qi9 n THR 5 N -1.27 0.00 -3.72 0.44 -1.04 -1.26 -1.96 114.28 105.48 1qi9 n THR 5 Ca 0.00 -0.27 -0.12 0.00 -2.04 0.00 0.00 64.05 61.62 1qi9 n THR 5 Cb 0.00 0.94 -0.10 0.00 -1.82 0.00 0.00 70.33 69.35 1qi9 n THR 5 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1qi9 s SER 6 N -2.32 -0.47 0.00 8.00 0.15 -1.26 -4.47 113.70 113.33 1qi9 s SER 6 Ca 0.25 0.87 0.00 0.00 0.70 0.00 0.00 55.95 57.77 1qi9 s SER 6 Cb 0.19 0.83 0.00 0.00 -1.71 0.00 0.00 66.02 65.33 1qi9 s SER 6 CO 0.47 -0.17 0.00 -0.90 1.20 0.00 0.00 173.24 173.84 1qi9 n ASP 7 N 3.43 0.00 -0.24 5.45 5.75 -1.26 -4.88 116.55 124.79 1qi9 n ASP 7 Ca -0.17 -0.71 0.04 0.00 -0.01 0.00 0.00 54.79 53.95 1qi9 n ASP 7 Cb 0.56 0.00 0.19 0.00 -1.03 0.00 0.00 41.12 40.84 1qi9 n ASP 7 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1qi9 n ASP 8 N -1.82 0.71 -4.76 -1.12 8.00 -1.26 -4.85 116.55 111.46 1qi9 n ASP 8 Ca 0.00 -1.86 -0.40 0.00 0.71 0.00 0.00 54.79 53.24 1qi9 n ASP 8 Cb 0.00 -0.08 -0.05 0.00 -0.02 0.00 0.00 41.12 40.97 1qi9 n ASP 8 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qi9 s ALA 9 N -1.85 3.40 -1.27 2.24 0.00 -1.26 -4.97 121.76 118.06 1qi9 s ALA 9 Ca 0.15 0.30 -0.16 0.00 0.00 0.00 0.00 51.96 52.26 1qi9 s ALA 9 Cb 0.08 -2.98 0.11 0.00 0.00 0.00 0.00 23.12 20.33 1qi9 s ALA 9 CO 0.11 0.15 1.63 -0.25 0.00 0.00 0.00 175.76 177.40 1qi9 n ASP 10 N 2.39 5.04 -3.71 0.00 8.00 -1.26 -4.88 116.55 122.12 1qi9 n ASP 10 Ca -0.04 -2.94 -0.18 0.00 0.71 0.00 0.00 54.79 52.34 1qi9 n ASP 10 Cb 0.50 -1.67 -0.17 0.00 -0.02 0.00 0.00 41.12 39.75 1qi9 n ASP 10 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1qi9 s ASP 11 N 3.62 0.66 0.59 -2.24 -1.08 -1.26 -5.05 116.67 111.91 1qi9 s ASP 11 Ca 0.49 0.07 0.30 0.00 -0.52 0.00 0.00 52.55 52.89 1qi9 s ASP 11 Cb 0.01 -0.10 1.84 0.00 -1.46 0.00 0.00 42.92 43.21 1qi9 s ASP 11 CO 0.05 -0.20 2.26 -0.65 0.52 0.00 0.00 175.17 177.15 1qi9 h PRO 12 N 7.93 0.00 -5.94 4.34 0.11 -2.02 -3.42 132.00 133.00 1qi9 h PRO 12 Ca -0.27 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.27 1qi9 h PRO 12 Cb 1.12 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.17 1qi9 h PRO 12 CO 0.30 0.00 0.04 0.99 -0.21 0.00 0.00 178.00 179.12 1qi9 s THR 13 N -4.63 5.08 0.51 -1.15 2.01 -1.26 -5.04 115.64 111.16 1qi9 s THR 13 Ca -0.05 1.31 -0.23 0.00 0.31 0.00 0.00 61.69 63.03 1qi9 s THR 13 Cb 0.15 -3.98 -0.06 0.00 0.01 0.00 0.00 72.50 68.62 1qi9 s THR 13 CO 0.54 0.26 1.40 -0.81 -0.69 0.00 0.00 174.62 175.32 1qi9 n PRO 14 N 3.85 1.96 -0.30 4.92 -0.04 -1.26 -4.78 135.00 139.35 1qi9 n PRO 14 Ca -0.03 0.71 0.13 0.00 -0.04 0.00 0.00 63.50 64.27 1qi9 n PRO 14 Cb 0.51 -2.61 0.29 0.00 -0.04 0.00 0.00 33.50 31.65 1qi9 n PRO 14 CO 0.00 0.00 0.00 -1.35 -0.04 0.00 0.00 175.50 174.11 1qi9 h PRO 15 N 1.82 0.23 0.00 0.54 0.11 -1.78 0.95 132.00 133.87 1qi9 h PRO 15 Ca -0.51 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.59 1qi9 h PRO 15 Cb 1.29 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1qi9 h PRO 15 CO 0.59 0.15 0.00 0.27 -0.21 0.00 0.00 178.00 178.80 1qi9 n ASN 16 N -5.19 0.00 -0.15 -2.05 6.94 -0.83 -2.61 115.26 111.37 1qi9 n ASN 16 Ca 0.21 -0.55 0.04 0.00 -0.02 0.00 0.00 54.58 54.26 1qi9 n ASN 16 Cb 0.67 -0.10 -0.01 0.00 -2.36 0.00 0.00 39.78 37.98 1qi9 n ASN 16 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1qi9 n GLU 17 N -1.10 2.63 -0.01 -3.83 1.02 0.28 -4.73 120.64 114.90 1qi9 n GLU 17 Ca 0.17 -0.44 -0.04 0.00 -0.02 0.00 0.00 57.16 56.83 1qi9 n GLU 17 Cb 0.13 -1.00 0.18 0.00 -0.02 0.00 0.00 31.44 30.74 1qi9 n GLU 17 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1qi9 h ARG 18 N 0.74 0.54 -0.37 3.49 3.08 -1.18 -0.41 114.38 120.27 1qi9 h ARG 18 Ca 0.00 -0.20 -0.04 0.00 0.07 0.00 0.00 59.98 59.81 1qi9 h ARG 18 Cb 0.26 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1qi9 h ARG 18 CO 0.00 0.73 0.07 0.38 -1.07 0.00 0.00 179.97 180.08 1qi9 h ASP 19 N 0.48 0.58 -0.06 7.04 2.03 -1.85 -2.43 116.42 122.22 1qi9 h ASP 19 Ca 0.07 -0.25 0.00 0.00 -0.73 0.00 0.00 57.03 56.12 1qi9 h ASP 19 Cb 0.66 -0.15 -0.00 0.00 -0.83 0.00 0.00 39.33 39.00 1qi9 h ASP 19 CO 0.05 0.68 0.03 0.44 -1.03 0.00 0.00 179.24 179.42 1qi9 h ASP 20 N 0.45 0.06 -0.44 4.15 3.32 -1.73 -2.13 116.42 120.08 1qi9 h ASP 20 Ca 0.11 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1qi9 h ASP 20 Cb 0.35 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 1qi9 h ASP 20 CO 0.01 0.04 0.24 -0.33 -1.72 0.00 0.00 179.24 177.48 1qi9 h GLU 21 N 0.07 0.66 -0.23 3.56 5.08 -1.11 -0.53 114.58 122.09 1qi9 h GLU 21 Ca 0.02 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.15 1qi9 h GLU 21 Cb -0.00 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.11 1qi9 h GLU 21 CO -0.01 0.50 -0.54 0.00 -1.00 0.00 0.00 179.01 177.96 1qi9 h ALA 22 N 1.61 0.63 -0.37 3.43 0.00 -1.17 -2.42 119.26 120.96 1qi9 h ALA 22 Ca 0.17 -0.51 -0.06 0.00 0.00 0.00 0.00 54.91 54.51 1qi9 h ALA 22 Cb 0.05 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1qi9 h ALA 22 CO -0.03 0.68 -0.02 0.35 0.00 0.00 0.00 179.25 180.24 1qi9 h PHE 23 N 0.52 0.73 -0.82 0.00 3.57 -1.02 -2.12 116.94 117.80 1qi9 h PHE 23 Ca 0.01 -0.13 0.02 0.00 3.53 0.00 0.00 57.97 61.40 1qi9 h PHE 23 Cb 1.10 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 39.61 1qi9 h PHE 23 CO 0.05 0.77 0.53 0.00 -2.23 0.00 0.00 178.31 177.44 1qi9 h ALA 24 N 0.86 1.06 -0.37 2.41 0.00 -1.03 -0.74 119.26 121.46 1qi9 h ALA 24 Ca 0.10 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.81 1qi9 h ALA 24 Cb 0.49 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1qi9 h ALA 24 CO 0.02 0.39 -0.41 1.03 0.00 0.00 0.00 179.25 180.28 1qi9 h SER 25 N 1.06 1.00 -0.39 0.00 0.87 -1.26 -1.95 113.55 112.87 1qi9 h SER 25 Ca 0.32 -0.47 -0.12 0.00 -1.23 0.00 0.00 61.79 60.29 1qi9 h SER 25 Cb -0.04 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.62 1qi9 h SER 25 CO -0.10 1.27 -0.21 0.03 -0.53 0.00 0.00 176.83 177.30 1qi9 h ARG 26 N 0.75 0.88 -0.42 2.24 3.08 -1.01 -1.20 114.38 118.71 1qi9 h ARG 26 Ca 0.05 -0.36 -0.09 0.00 0.07 0.00 0.00 59.98 59.66 1qi9 h ARG 26 Cb 1.01 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 1qi9 h ARG 26 CO 0.10 1.01 -0.08 0.28 -1.07 0.00 0.00 179.97 180.21 1qi9 h VAL 27 N 0.77 1.27 -0.48 2.04 2.07 -1.12 -0.71 116.25 120.09 1qi9 h VAL 27 Ca 0.11 -1.16 -0.04 0.00 0.82 0.00 0.00 66.70 66.42 1qi9 h VAL 27 Cb 0.75 1.17 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 1qi9 h VAL 27 CO 0.06 0.39 0.12 0.00 0.02 0.00 0.00 177.57 178.16 1qi9 h ALA 28 N 0.86 1.31 -0.22 1.67 0.00 -1.14 0.19 119.26 121.92 1qi9 h ALA 28 Ca 0.11 -0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 1qi9 h ALA 28 Cb 0.60 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1qi9 h ALA 28 CO 0.04 0.49 -0.33 0.00 0.00 0.00 0.00 179.25 179.45 1qi9 h ALA 29 N 1.43 0.34 -0.55 0.00 0.00 -1.05 -1.49 119.26 117.94 1qi9 h ALA 29 Ca 0.16 -0.42 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1qi9 h ALA 29 Cb 0.26 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1qi9 h ALA 29 CO -0.00 0.38 0.04 0.00 0.00 0.00 0.00 179.25 179.67 1qi9 h ALA 30 N 0.63 1.04 -0.28 0.00 0.00 -0.87 -2.34 119.26 117.44 1qi9 h ALA 30 Ca 0.02 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 1qi9 h ALA 30 Cb 0.91 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 1qi9 h ALA 30 CO 0.08 0.61 -0.20 -0.22 0.00 0.00 0.00 179.25 179.51 1qi9 h LYS 31 N 0.85 0.51 -0.57 0.00 3.64 -0.50 -0.24 116.57 120.25 1qi9 h LYS 31 Ca 0.17 -0.17 -0.09 0.00 -1.27 0.00 0.00 60.65 59.28 1qi9 h LYS 31 Cb 0.45 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.20 1qi9 h LYS 31 CO 0.02 0.68 -0.01 -0.09 -2.27 0.00 0.00 179.45 177.78 1qi9 h ARG 32 N 0.45 0.99 -0.58 1.90 2.43 -0.96 -1.01 114.38 117.61 1qi9 h ARG 32 Ca 0.07 -0.30 -0.09 0.00 -0.81 0.00 0.00 59.98 58.85 1qi9 h ARG 32 Cb 0.61 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1qi9 h ARG 32 CO 0.04 0.98 0.02 0.93 -1.51 0.00 0.00 179.97 180.43 1qi9 h GLU 33 N 0.91 1.02 0.53 0.20 4.39 -1.15 0.17 114.58 120.65 1qi9 h GLU 33 Ca 0.16 -0.31 -0.02 0.00 0.34 0.00 0.00 59.36 59.53 1qi9 h GLU 33 Cb 0.54 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.09 1qi9 h GLU 33 CO 0.03 1.00 -0.28 1.25 -1.16 0.00 0.00 179.01 179.84 1qi9 h LEU 34 N 0.91 -0.68 -1.03 1.33 5.85 -0.73 -0.80 115.31 120.16 1qi9 h LEU 34 Ca 0.17 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.82 1qi9 h LEU 34 Cb 0.53 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1qi9 h LEU 34 CO 0.03 -0.46 -0.35 -0.33 -0.34 0.00 0.00 178.44 176.98 1qi9 h GLU 35 N -0.75 0.25 0.00 1.25 5.08 -1.20 -2.31 114.58 116.90 1qi9 h GLU 35 Ca -0.07 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.12 1qi9 h GLU 35 Cb 0.59 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.82 1qi9 h GLU 35 CO 0.10 0.57 -0.33 0.78 -1.00 0.00 0.00 179.01 179.13 1qi9 h GLY 36 N 1.13 0.00 0.00 -3.84 0.00 -0.90 -3.36 103.07 96.10 1qi9 h GLY 36 Ca 0.03 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.35 1qi9 h GLY 36 CO 0.06 0.00 -0.11 -0.84 0.00 0.00 0.00 176.54 175.65 1qi9 h THR 37 N 0.00 0.23 -0.11 4.70 2.02 -0.89 -3.45 112.91 115.41 1qi9 h THR 37 Ca -0.00 -1.18 0.00 0.00 0.77 0.00 0.00 66.41 65.99 1qi9 h THR 37 Cb 1.25 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 1qi9 h THR 37 CO 0.04 0.08 0.00 0.61 0.37 0.00 0.00 175.52 176.62 1qi9 n GLY 38 N 1.73 0.53 3.69 2.16 0.00 -0.89 -4.56 105.19 107.84 1qi9 n GLY 38 Ca -0.03 -0.79 -0.39 0.00 0.00 0.00 0.00 46.02 44.80 1qi9 n GLY 38 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1qi9 s THR 39 N 0.00 5.07 -0.17 2.61 2.01 -1.26 -5.04 115.64 118.86 1qi9 s THR 39 Ca 0.00 1.18 0.01 0.00 0.31 0.00 0.00 61.69 63.19 1qi9 s THR 39 Cb 0.00 -3.93 0.02 0.00 0.01 0.00 0.00 72.50 68.59 1qi9 s THR 39 CO 0.00 0.20 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.24 1qi9 s VAL 40 N 1.32 2.15 -0.28 3.82 1.01 -1.26 -5.10 120.40 122.07 1qi9 s VAL 40 Ca 0.30 -0.92 -0.16 0.00 0.00 0.00 0.00 61.98 61.20 1qi9 s VAL 40 Cb -0.16 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.29 1qi9 s VAL 40 CO 0.12 0.53 0.42 0.00 0.00 0.00 0.00 175.10 176.18 1qi9 s GLN 42 N 2.15 3.91 -0.19 0.00 -1.52 -1.26 -4.99 119.66 117.76 1qi9 s GLN 42 Ca 0.17 0.64 -0.01 0.00 -1.95 0.00 0.00 55.36 54.21 1qi9 s GLN 42 Cb -0.16 -3.77 0.00 0.00 -0.22 0.00 0.00 33.01 28.87 1qi9 s GLN 42 CO 0.10 -0.85 -0.13 0.42 -0.25 0.00 0.00 175.29 174.58 1qi9 s ILE 43 N 3.32 2.71 0.28 1.08 1.01 -1.26 -5.12 121.20 123.21 1qi9 s ILE 43 Ca 0.37 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 60.34 1qi9 s ILE 43 Cb -0.13 -2.18 0.04 0.00 0.01 0.00 0.00 42.46 40.21 1qi9 s ILE 43 CO 0.16 0.49 0.37 -0.46 0.00 0.00 0.00 174.94 175.50 1qi9 n ASN 44 N 4.53 1.11 0.00 3.58 0.23 -1.26 -4.10 115.26 119.35 1qi9 n ASN 44 Ca -0.19 -1.77 0.13 0.00 -0.53 0.00 0.00 54.58 52.22 1qi9 n ASN 44 Cb 0.51 -0.19 0.66 0.00 -2.08 0.00 0.00 39.78 38.68 1qi9 n ASN 44 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1qi9 n ASN 45 N -2.60 0.00 0.00 0.53 0.23 -1.26 -4.83 115.26 107.33 1qi9 n ASN 45 Ca 0.07 -0.02 0.00 0.00 -0.53 0.00 0.00 54.58 54.10 1qi9 n ASN 45 Cb 0.29 -0.31 0.00 0.00 -2.08 0.00 0.00 39.78 37.68 1qi9 n ASN 45 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1qi9 n GLY 46 N 1.01 0.94 3.78 4.83 0.00 -1.26 -4.99 105.19 109.50 1qi9 n GLY 46 Ca 0.12 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1qi9 n GLY 46 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1qi9 s GLU 47 N -0.15 3.51 -0.01 1.61 -1.05 -1.26 -4.95 118.70 116.41 1qi9 s GLU 47 Ca 0.00 1.61 0.14 0.00 -0.15 0.00 0.00 54.97 56.57 1qi9 s GLU 47 Cb 0.00 -2.11 -0.18 0.00 -0.44 0.00 0.00 34.13 31.40 1qi9 s GLU 47 CO 0.00 -0.72 0.45 0.25 0.95 0.00 0.00 175.26 176.20 1qi9 n THR 48 N -1.06 0.00 -1.67 1.83 -2.24 -1.26 -4.99 114.28 104.88 1qi9 n THR 48 Ca 0.10 -0.24 -0.46 0.00 -2.27 0.00 0.00 64.05 61.18 1qi9 n THR 48 Cb 0.51 0.64 -0.04 0.00 -2.10 0.00 0.00 70.33 69.33 1qi9 n THR 48 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1qi9 n ASP 49 N -1.61 3.17 0.25 3.42 2.03 -1.26 -4.88 116.55 117.67 1qi9 n ASP 49 Ca 0.00 1.07 0.13 0.00 0.52 0.00 0.00 54.79 56.52 1qi9 n ASP 49 Cb 0.28 -1.43 0.53 0.00 -0.72 0.00 0.00 41.12 39.77 1qi9 n ASP 49 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1qi9 h LEU 50 N 6.30 0.00 -2.13 -2.67 3.38 -1.95 -2.50 115.31 115.73 1qi9 h LEU 50 Ca -0.45 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 1qi9 h LEU 50 Cb 1.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.00 1qi9 h LEU 50 CO 0.90 0.11 -0.05 0.00 0.09 0.00 0.00 178.44 179.48 1qi9 h ALA 51 N 1.89 1.64 -0.43 1.53 0.00 -1.97 -2.45 119.26 119.47 1qi9 h ALA 51 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1qi9 h ALA 51 Cb 0.68 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1qi9 h ALA 51 CO 0.01 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1qi9 n ALA 52 N -2.40 2.78 -2.42 0.00 0.00 -0.94 -4.72 120.51 112.81 1qi9 n ALA 52 Ca -0.03 -0.97 -0.27 0.00 0.00 0.00 0.00 53.44 52.18 1qi9 n ALA 52 Cb 0.13 -1.01 -0.12 0.00 0.00 0.00 0.00 19.45 18.46 1qi9 n ALA 52 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1qi9 s LYS 53 N -1.65 1.46 0.16 0.00 -0.14 -0.92 -2.80 119.74 115.85 1qi9 s LYS 53 Ca 0.33 -1.46 -0.30 0.00 -1.36 0.00 0.00 55.97 53.17 1qi9 s LYS 53 Cb 0.20 -1.80 -0.08 0.00 -1.68 0.00 0.00 37.83 34.47 1qi9 s LYS 53 CO 0.17 0.40 1.25 0.12 -0.76 0.00 0.00 175.35 176.53 1qi9 s PHE 54 N -1.53 3.36 -0.09 3.18 5.36 -0.48 -4.10 117.98 123.68 1qi9 s PHE 54 Ca 0.18 1.30 0.06 0.00 -0.96 0.00 0.00 56.93 57.51 1qi9 s PHE 54 Cb -0.08 -3.50 0.16 0.00 -0.34 0.00 0.00 43.02 39.25 1qi9 s PHE 54 CO 0.08 -1.53 1.16 -2.39 -1.46 0.00 0.00 175.22 171.08 1qi9 n HIS 55 N 2.91 -0.47 -1.95 10.12 1.44 -1.26 -4.96 115.22 121.05 1qi9 n HIS 55 Ca 0.06 -0.86 -0.41 0.00 -2.01 0.00 0.00 57.72 54.50 1qi9 n HIS 55 Cb 0.44 0.68 -0.01 0.00 0.12 0.00 0.00 29.99 31.21 1qi9 n HIS 55 CO 0.00 0.00 0.00 0.21 -2.81 0.00 0.00 176.34 173.74 1qi9 s LYS 56 N -0.11 4.22 0.00 -1.40 2.20 -1.26 -2.07 119.74 121.33 1qi9 s LYS 56 Ca 0.06 2.40 0.00 0.00 -0.36 0.00 0.00 55.97 58.07 1qi9 s LYS 56 Cb 0.16 -3.04 0.00 0.00 -1.51 0.00 0.00 37.83 33.44 1qi9 s LYS 56 CO -0.05 -0.41 0.00 -1.13 -0.36 0.00 0.00 175.35 173.40 1qi9 n SER 57 N 1.17 0.00 -4.86 1.43 3.41 -0.15 -4.92 113.62 109.70 1qi9 n SER 57 Ca 0.03 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.35 1qi9 n SER 57 Cb 0.40 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.44 1qi9 n SER 57 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1qi9 s LEU 58 N 0.00 2.59 0.32 1.04 1.43 -0.88 -0.73 118.68 122.45 1qi9 s LEU 58 Ca 0.00 0.67 -0.29 0.00 -1.03 0.00 0.00 54.13 53.48 1qi9 s LEU 58 Cb 0.00 -3.17 -0.10 0.00 0.03 0.00 0.00 46.19 42.95 1qi9 s LEU 58 CO 0.00 -1.88 1.29 -2.84 0.23 0.00 0.00 176.35 173.15 1qi9 s PRO 59 N -5.51 4.38 0.15 1.29 0.02 -1.26 -3.96 135.00 130.11 1qi9 s PRO 59 Ca 0.62 2.18 0.05 0.00 0.02 0.00 0.00 61.00 63.87 1qi9 s PRO 59 Cb -0.10 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.28 1qi9 s PRO 59 CO 0.48 -0.16 -0.12 -1.01 -0.33 0.00 0.00 177.00 175.86 1qi9 s HIS 60 N -1.05 1.39 0.26 6.54 3.76 -1.26 -1.81 115.29 123.12 1qi9 s HIS 60 Ca 0.49 -0.68 -0.04 0.00 -0.15 0.00 0.00 55.06 54.68 1qi9 s HIS 60 Cb -0.39 -0.69 0.06 0.00 1.11 0.00 0.00 32.58 32.67 1qi9 s HIS 60 CO 0.51 0.16 0.35 -0.40 -0.85 0.00 0.00 174.74 174.51 1qi9 n ASP 61 N -0.09 0.00 0.00 1.40 5.68 0.31 -4.86 116.55 118.99 1qi9 n ASP 61 Ca -0.11 -1.12 0.12 0.00 -0.50 0.00 0.00 54.79 53.19 1qi9 n ASP 61 Cb 0.60 -0.27 0.73 0.00 -1.14 0.00 0.00 41.12 41.04 1qi9 n ASP 61 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1qi9 n ASP 62 N -3.23 0.00 -1.06 -1.12 8.00 -1.26 -1.56 116.55 116.32 1qi9 n ASP 62 Ca 0.04 -0.85 0.09 0.00 0.71 0.00 0.00 54.79 54.79 1qi9 n ASP 62 Cb 0.15 0.00 0.25 0.00 -0.02 0.00 0.00 41.12 41.51 1qi9 n ASP 62 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1qi9 n LEU 63 N -0.98 3.55 -0.42 0.64 4.77 -1.26 -4.96 117.00 118.34 1qi9 n LEU 63 Ca 0.19 -2.02 -0.05 0.00 -0.03 0.00 0.00 56.01 54.09 1qi9 n LEU 63 Cb 0.08 -0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 40.77 1qi9 n LEU 63 CO 0.14 0.87 -0.05 0.61 -1.33 0.00 0.00 177.39 177.63 1qi9 n GLY 64 N 1.14 0.80 3.79 -0.72 0.00 -0.60 -4.90 105.19 104.69 1qi9 n GLY 64 Ca 0.19 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 45.08 1qi9 n GLY 64 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1qi9 s GLN 65 N -2.38 4.18 0.30 1.61 -0.21 -1.26 -4.82 119.66 117.09 1qi9 s GLN 65 Ca 0.00 0.59 -0.29 0.00 0.02 0.00 0.00 55.36 55.68 1qi9 s GLN 65 Cb 0.00 -3.30 -0.10 0.00 1.00 0.00 0.00 33.01 30.61 1qi9 s GLN 65 CO 0.00 0.49 1.18 0.54 -2.12 0.00 0.00 175.29 175.38 1qi9 s VAL 66 N -0.54 3.20 0.14 1.09 0.11 -1.26 -0.53 120.40 122.61 1qi9 s VAL 66 Ca 0.27 1.21 -0.31 0.00 -2.93 0.00 0.00 61.98 60.22 1qi9 s VAL 66 Cb -0.18 -3.77 -0.10 0.00 -1.53 0.00 0.00 36.38 30.80 1qi9 s VAL 66 CO 0.15 0.29 1.72 -0.62 -3.33 0.00 0.00 175.10 173.32 1qi9 s ASP 67 N -0.74 6.47 0.22 3.54 -1.08 -0.75 -4.86 116.67 119.47 1qi9 s ASP 67 Ca 0.46 2.71 -0.09 0.00 -0.52 0.00 0.00 52.55 55.12 1qi9 s ASP 67 Cb -0.35 -2.58 0.21 0.00 -1.46 0.00 0.00 42.92 38.74 1qi9 s ASP 67 CO 0.45 -0.94 1.88 0.00 0.52 0.00 0.00 175.17 177.08 1qi9 h ALA 68 N 7.78 1.05 -0.14 3.66 0.00 -1.92 -2.13 119.26 127.56 1qi9 h ALA 68 Ca -0.44 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.25 1qi9 h ALA 68 Cb 1.21 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1qi9 h ALA 68 CO 0.94 0.41 -0.62 -0.44 0.00 0.00 0.00 179.25 179.53 1qi9 h ASP 69 N 1.07 0.55 -0.47 0.00 3.32 -2.00 -2.56 116.42 116.34 1qi9 h ASP 69 Ca 0.31 -0.32 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1qi9 h ASP 69 Cb -0.07 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 1qi9 h ASP 69 CO -0.09 1.04 0.30 0.00 -1.72 0.00 0.00 179.24 178.77 1qi9 h ALA 70 N 0.97 0.60 -0.92 3.45 0.00 -1.90 -0.86 119.26 120.60 1qi9 h ALA 70 Ca -0.01 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.88 1qi9 h ALA 70 Cb 1.18 -0.17 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 1qi9 h ALA 70 CO 0.11 0.02 0.60 0.35 0.00 0.00 0.00 179.25 180.33 1qi9 h PHE 71 N 0.61 1.17 -0.22 0.00 3.57 -1.28 0.13 116.94 120.92 1qi9 h PHE 71 Ca 0.18 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.62 1qi9 h PHE 71 Cb -0.04 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 38.29 1qi9 h PHE 71 CO -0.05 0.74 -0.21 0.00 -2.23 0.00 0.00 178.31 176.56 1qi9 h ALA 72 N 1.33 1.25 -0.75 2.41 0.00 -1.17 -0.49 119.26 121.84 1qi9 h ALA 72 Ca 0.34 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1qi9 h ALA 72 Cb -0.13 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1qi9 h ALA 72 CO -0.07 0.49 0.31 0.00 0.00 0.00 0.00 179.25 179.98 1qi9 h ALA 73 N 1.44 1.12 -0.60 0.00 0.00 0.43 -1.79 119.26 119.86 1qi9 h ALA 73 Ca 0.06 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1qi9 h ALA 73 Cb 0.57 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1qi9 h ALA 73 CO 0.04 0.63 -0.02 1.25 0.00 0.00 0.00 179.25 181.15 1qi9 h LEU 74 N 1.09 1.05 -1.18 0.00 5.85 -0.28 -1.17 115.31 120.66 1qi9 h LEU 74 Ca 0.25 -0.31 -0.01 0.00 0.84 0.00 0.00 57.88 58.65 1qi9 h LEU 74 Cb 0.19 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 1qi9 h LEU 74 CO -0.02 1.11 0.41 -0.33 -0.34 0.00 0.00 178.44 179.27 1qi9 h GLU 75 N 0.96 0.98 -0.41 1.25 5.08 -0.80 0.37 114.58 122.01 1qi9 h GLU 75 Ca 0.17 -0.09 -0.12 0.00 -1.00 0.00 0.00 59.36 58.31 1qi9 h GLU 75 Cb 0.58 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1qi9 h GLU 75 CO 0.03 0.70 -0.23 0.22 -1.00 0.00 0.00 179.01 178.74 1qi9 h ASP 76 N 0.99 0.84 -0.40 1.42 3.58 -1.03 -1.35 116.42 120.47 1qi9 h ASP 76 Ca 0.26 -0.31 -0.01 0.00 0.42 0.00 0.00 57.03 57.39 1qi9 h ASP 76 Cb -0.01 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 40.79 1qi9 h ASP 76 CO -0.04 1.04 0.21 0.00 -2.88 0.00 0.00 179.24 177.57 1qi9 h ILE 78 N 0.52 1.19 -0.44 0.00 2.04 -0.84 -3.18 117.51 116.79 1qi9 h ILE 78 Ca 0.14 -0.53 -0.10 0.00 1.00 0.00 0.00 64.86 65.37 1qi9 h ILE 78 Cb 0.07 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1qi9 h ILE 78 CO -0.02 0.21 -0.15 0.25 0.00 0.00 0.00 178.15 178.44 1qi9 h LEU 79 N 0.61 0.81 -1.17 1.44 5.85 -1.07 -3.39 115.31 118.40 1qi9 h LEU 79 Ca 0.16 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.62 1qi9 h LEU 79 Cb 0.12 -0.22 0.00 0.00 0.37 0.00 0.00 40.66 40.93 1qi9 h LEU 79 CO -0.02 0.97 -0.17 0.59 -0.34 0.00 0.00 178.44 179.47 1qi9 n ASN 80 N -4.14 1.98 -3.85 1.25 3.02 -0.92 -4.99 115.26 107.61 1qi9 n ASN 80 Ca 0.01 -1.53 -0.29 0.00 -0.03 0.00 0.00 54.58 52.74 1qi9 n ASN 80 Cb 0.39 0.14 0.04 0.00 -0.61 0.00 0.00 39.78 39.74 1qi9 n ASN 80 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qi9 n GLY 81 N 1.32 -0.51 2.90 7.41 0.00 -1.25 -4.95 105.19 110.11 1qi9 n GLY 81 Ca 0.14 0.21 -0.27 0.00 0.00 0.00 0.00 46.02 46.09 1qi9 n GLY 81 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qi9 s ASP 82 N -3.29 2.37 0.14 1.61 -1.08 -1.26 -5.02 116.67 110.13 1qi9 s ASP 82 Ca 0.65 -0.40 -0.17 0.00 -0.52 0.00 0.00 52.55 52.11 1qi9 s ASP 82 Cb -0.32 -0.87 -0.01 0.00 -1.46 0.00 0.00 42.92 40.27 1qi9 s ASP 82 CO 0.81 -0.14 1.80 -0.07 0.52 0.00 0.00 175.17 178.09 1qi9 h LEU 83 N 8.16 0.35 -0.73 -1.34 3.38 -1.96 -2.64 115.31 120.53 1qi9 h LEU 83 Ca -0.28 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.72 1qi9 h LEU 83 Cb 1.13 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.75 1qi9 h LEU 83 CO 0.41 0.25 0.46 -1.28 0.09 0.00 0.00 178.44 178.37 1qi9 h SER 84 N 0.43 0.74 -0.67 -0.43 0.87 -1.99 -1.27 113.55 111.22 1qi9 h SER 84 Ca 0.13 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.63 1qi9 h SER 84 Cb -0.03 -0.15 -0.03 0.00 -0.44 0.00 0.00 62.40 61.75 1qi9 h SER 84 CO -0.04 0.50 0.19 0.40 -0.53 0.00 0.00 176.83 177.35 1qi9 h ILE 85 N 0.88 1.25 0.00 2.23 2.04 -1.94 -2.16 117.51 119.81 1qi9 h ILE 85 Ca 0.30 -0.91 -0.05 0.00 1.00 0.00 0.00 64.86 65.20 1qi9 h ILE 85 Cb 0.05 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1qi9 h ILE 85 CO -0.12 0.35 -0.25 0.00 0.00 0.00 0.00 178.15 178.13 1qi9 h GLU 87 N 0.00 0.00 -0.00 0.00 4.39 -0.57 -2.41 114.58 115.98 1qi9 h GLU 87 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1qi9 h GLU 87 Cb 0.63 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1qi9 h GLU 87 CO 0.03 0.00 -0.07 -0.25 -1.16 0.00 0.00 179.01 177.56 1qi9 n ASP 88 N -2.56 0.47 -4.71 1.42 8.00 0.17 -4.86 116.55 114.49 1qi9 n ASP 88 Ca 0.02 -0.70 -0.42 0.00 0.71 0.00 0.00 54.79 54.40 1qi9 n ASP 88 Cb 0.31 -0.07 -0.03 0.00 -0.02 0.00 0.00 41.12 41.32 1qi9 n ASP 88 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1qi9 s VAL 89 N -2.36 3.40 0.77 2.53 1.01 -0.91 -4.97 120.40 119.87 1qi9 s VAL 89 Ca 0.33 0.96 -0.14 0.00 0.00 0.00 0.00 61.98 63.13 1qi9 s VAL 89 Cb 0.20 -3.62 0.06 0.00 0.00 0.00 0.00 36.38 33.03 1qi9 s VAL 89 CO 0.44 0.06 1.22 -2.84 0.00 0.00 0.00 175.10 173.98 1qi9 s PRO 90 N 1.45 1.86 0.01 2.72 0.02 -1.26 -5.03 135.00 134.77 1qi9 s PRO 90 Ca 0.65 1.80 0.08 0.00 0.02 0.00 0.00 61.00 63.54 1qi9 s PRO 90 Cb -0.36 -1.80 -0.02 0.00 0.02 0.00 0.00 34.50 32.35 1qi9 s PRO 90 CO 0.30 -2.06 -0.24 0.08 -0.33 0.00 0.00 177.00 174.75 1qi9 s VAL 91 N -2.01 1.93 -2.12 3.83 1.01 -1.26 -4.46 120.40 117.32 1qi9 s VAL 91 Ca 0.75 -1.16 0.29 0.00 0.00 0.00 0.00 61.98 61.85 1qi9 s VAL 91 Cb -0.30 -1.63 0.61 0.00 0.00 0.00 0.00 36.38 35.06 1qi9 s VAL 91 CO 0.48 0.43 1.90 0.61 0.00 0.00 0.00 175.10 178.52 1qi9 n GLY 92 N 2.17 -0.54 3.34 4.51 0.00 0.09 -4.55 105.19 110.21 1qi9 n GLY 92 Ca -0.16 -0.33 -0.12 0.00 0.00 0.00 0.00 46.02 45.41 1qi9 n GLY 92 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1qi9 s ASN 93 N -2.14 -0.53 0.00 1.61 3.84 -0.76 -4.81 114.94 112.15 1qi9 s ASN 93 Ca 0.38 0.95 0.27 0.00 0.21 0.00 0.00 52.86 54.67 1qi9 s ASN 93 Cb 0.21 0.90 0.78 0.00 -0.55 0.00 0.00 41.25 42.59 1qi9 s ASN 93 CO 0.39 -0.18 1.59 -1.20 -2.79 0.00 0.00 177.10 174.91 1qi9 n SER 94 N 3.51 1.81 0.14 -4.21 7.64 -1.26 -4.46 113.62 116.80 1qi9 n SER 94 Ca -0.18 -1.55 0.11 0.00 1.01 0.00 0.00 58.87 58.26 1qi9 n SER 94 Cb 0.56 0.03 0.51 0.00 -1.01 0.00 0.00 64.21 64.31 1qi9 n SER 94 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1qi9 n GLU 95 N 0.35 0.15 -1.13 1.43 1.02 -1.26 -4.86 120.64 116.33 1qi9 n GLU 95 Ca 0.17 0.54 -0.05 0.00 -0.02 0.00 0.00 57.16 57.80 1qi9 n GLU 95 Cb 0.41 -1.89 -0.02 0.00 -0.02 0.00 0.00 31.44 29.92 1qi9 n GLU 95 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1qi9 n GLY 96 N -0.75 0.73 3.75 0.62 0.00 -1.26 -4.99 105.19 103.29 1qi9 n GLY 96 Ca 0.00 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.87 1qi9 n GLY 96 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qi9 s ASP 97 N -2.85 6.93 0.59 1.61 -1.08 -1.26 -4.90 116.67 115.70 1qi9 s ASP 97 Ca 0.00 2.48 0.28 0.00 -0.52 0.00 0.00 52.55 54.80 1qi9 s ASP 97 Cb 0.00 -2.63 1.63 0.00 -1.46 0.00 0.00 42.92 40.46 1qi9 s ASP 97 CO 0.00 -0.45 2.08 1.55 0.52 0.00 0.00 175.17 178.87 1qi9 h PRO 98 N 4.30 0.00 0.00 4.34 0.13 -1.94 -1.50 132.00 137.33 1qi9 h PRO 98 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1qi9 h PRO 98 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1qi9 h PRO 98 CO 0.71 0.00 -0.01 -0.39 -0.23 0.00 0.00 178.00 178.08 1qi9 h VAL 99 N 0.00 0.04 0.00 1.56 -1.51 -1.90 -2.03 116.25 112.41 1qi9 h VAL 99 Ca 0.10 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 65.31 1qi9 h VAL 99 Cb 0.56 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.97 1qi9 h VAL 99 CO -0.00 0.01 0.00 1.23 -1.23 0.00 0.00 177.57 177.58 1qi9 h GLY 100 N 0.95 0.00 -3.37 5.19 0.00 -1.40 -3.42 103.07 101.03 1qi9 h GLY 100 Ca -0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 1qi9 h GLY 100 CO 0.00 0.00 0.66 0.50 0.00 0.00 0.00 176.54 177.70 1qi9 s ARG 101 N -3.21 3.76 0.17 4.80 0.52 -0.76 -4.81 118.95 119.41 1qi9 s ARG 101 Ca 0.08 2.30 -0.31 0.00 -0.52 0.00 0.00 55.73 57.28 1qi9 s ARG 101 Cb 0.07 -2.66 -0.09 0.00 0.52 0.00 0.00 34.95 32.79 1qi9 s ARG 101 CO 0.64 -0.72 1.37 -0.51 0.02 0.00 0.00 175.30 176.10 1qi9 s LEU 102 N -2.67 4.39 -0.75 2.53 1.43 -1.26 -4.65 118.68 117.69 1qi9 s LEU 102 Ca 0.60 2.42 -0.22 0.00 -1.03 0.00 0.00 54.13 55.90 1qi9 s LEU 102 Cb -0.41 -3.60 0.08 0.00 0.03 0.00 0.00 46.19 42.29 1qi9 s LEU 102 CO 0.53 -0.61 1.06 -0.69 0.23 0.00 0.00 176.35 176.87 1qi9 s VAL 103 N 0.50 4.33 -1.21 -1.59 1.01 -0.66 -4.62 120.40 118.16 1qi9 s VAL 103 Ca 0.60 -0.60 -0.34 0.00 0.00 0.00 0.00 61.98 61.64 1qi9 s VAL 103 Cb -0.38 -4.76 0.04 0.00 0.00 0.00 0.00 36.38 31.29 1qi9 s VAL 103 CO 0.36 -1.54 0.69 -3.20 0.00 0.00 0.00 175.10 171.41 1qi9 n ASN 104 N 7.68 -4.21 0.28 3.32 4.05 -1.26 -4.86 115.26 120.27 1qi9 n ASN 104 Ca 0.06 -1.29 0.14 0.00 0.45 0.00 0.00 54.58 53.94 1qi9 n ASN 104 Cb 0.47 -1.77 0.83 0.00 1.23 0.00 0.00 39.78 40.54 1qi9 n ASN 104 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1qi9 h PRO 105 N -2.61 0.00 -0.01 1.20 0.13 -1.96 -1.76 132.00 126.98 1qi9 h PRO 105 Ca -0.71 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.42 1qi9 h PRO 105 Cb 1.40 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.53 1qi9 h PRO 105 CO 0.52 0.07 -0.02 0.25 -0.23 0.00 0.00 178.00 178.58 1qi9 n THR 106 N -3.67 0.00 -0.34 1.56 -2.24 -1.26 -4.46 114.28 103.87 1qi9 n THR 106 Ca -0.02 -0.15 0.07 0.00 -2.27 0.00 0.00 64.05 61.68 1qi9 n THR 106 Cb 0.17 0.14 0.23 0.00 -2.10 0.00 0.00 70.33 68.77 1qi9 n THR 106 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1qi9 h ALA 107 N 4.15 1.45 -0.54 6.98 0.00 -1.68 -2.70 119.26 126.91 1qi9 h ALA 107 Ca 0.00 0.04 0.03 0.00 0.00 0.00 0.00 54.91 54.98 1qi9 h ALA 107 Cb 0.34 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1qi9 h ALA 107 CO 0.00 0.13 0.36 0.00 0.00 0.00 0.00 179.25 179.74 1qi9 h ALA 108 N 1.54 1.73 0.00 0.00 0.00 -1.79 -3.34 119.26 117.39 1qi9 h ALA 108 Ca 0.49 -0.03 -0.65 0.00 0.00 0.00 0.00 54.91 54.72 1qi9 h ALA 108 Cb 0.54 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1qi9 h ALA 108 CO -0.29 0.21 2.81 1.19 0.00 0.00 0.00 179.25 183.18 1qi9 n PHE 109 N -4.47 2.52 -3.64 0.00 3.72 -1.02 -4.75 117.46 109.82 1qi9 n PHE 109 Ca 0.06 -2.41 -0.12 0.00 -0.05 0.00 0.00 57.45 54.94 1qi9 n PHE 109 Cb 0.14 -2.11 -0.12 0.00 -0.94 0.00 0.00 39.48 36.45 1qi9 n PHE 109 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1qi9 s ALA 110 N 3.84 -0.76 -0.53 4.37 0.00 -1.26 -5.10 121.76 122.32 1qi9 s ALA 110 Ca 0.52 1.08 -0.26 0.00 0.00 0.00 0.00 51.96 53.31 1qi9 s ALA 110 Cb 0.14 -1.17 0.03 0.00 0.00 0.00 0.00 23.12 22.13 1qi9 s ALA 110 CO 0.00 -0.74 1.02 0.42 0.00 0.00 0.00 175.76 176.46 1qi9 s ILE 111 N 2.48 4.30 0.25 0.00 1.01 -1.26 -4.71 121.20 123.27 1qi9 s ILE 111 Ca 0.01 0.62 -0.30 0.00 0.00 0.00 0.00 60.65 60.99 1qi9 s ILE 111 Cb -0.12 -4.57 -0.09 0.00 0.01 0.00 0.00 42.46 37.69 1qi9 s ILE 111 CO -0.10 -1.10 1.05 -1.81 0.00 0.00 0.00 174.94 172.97 1qi9 s ASP 112 N 2.71 7.39 0.30 3.58 1.01 -1.26 -4.93 116.67 125.46 1qi9 s ASP 112 Ca 0.37 2.13 0.05 0.00 0.71 0.00 0.00 52.55 55.81 1qi9 s ASP 112 Cb -0.10 -2.62 0.47 0.00 1.01 0.00 0.00 42.92 41.68 1qi9 s ASP 112 CO 0.23 -0.06 1.73 -0.29 0.21 0.00 0.00 175.17 177.00 1qi9 h ILE 113 N 3.24 1.27 -2.54 0.77 2.10 -1.99 -3.44 117.51 116.92 1qi9 h ILE 113 Ca -0.46 -1.31 -0.46 0.00 1.08 0.00 0.00 64.86 63.71 1qi9 h ILE 113 Cb 1.21 1.46 0.01 0.00 -1.09 0.00 0.00 36.82 38.41 1qi9 h ILE 113 CO 0.68 0.40 -0.24 -0.94 -1.08 0.00 0.00 178.15 176.98 1qi9 s SER 114 N -6.84 6.16 0.24 2.19 1.04 -1.26 -4.99 113.70 110.24 1qi9 s SER 114 Ca -0.06 0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.63 1qi9 s SER 114 Cb 0.14 -1.79 0.00 0.00 0.10 0.00 0.00 66.02 64.47 1qi9 s SER 114 CO 0.78 -0.35 0.00 0.61 0.98 0.00 0.00 173.24 175.26 1qi9 n GLY 115 N -1.75 -1.91 3.73 7.32 0.00 -1.26 -4.84 105.19 106.48 1qi9 n GLY 115 Ca -0.04 -1.33 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 1qi9 n GLY 115 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1qi9 s PRO 116 N -0.74 4.49 0.91 1.61 0.04 -1.26 -5.00 135.00 135.06 1qi9 s PRO 116 Ca 0.00 1.84 -0.10 0.00 0.04 0.00 0.00 61.00 62.78 1qi9 s PRO 116 Cb 0.00 -3.26 0.14 0.00 0.04 0.00 0.00 34.50 31.42 1qi9 s PRO 116 CO 0.00 -0.10 1.13 0.00 0.04 0.00 0.00 177.00 178.08 1qi9 s ALA 117 N 0.10 1.43 0.58 8.56 0.00 -1.26 -4.88 121.76 126.29 1qi9 s ALA 117 Ca 0.53 0.49 0.28 0.00 0.00 0.00 0.00 51.96 53.27 1qi9 s ALA 117 Cb -0.32 -3.41 1.58 0.00 0.00 0.00 0.00 23.12 20.97 1qi9 s ALA 117 CO 0.35 -2.72 2.04 0.27 0.00 0.00 0.00 175.76 175.71 1qi9 h PHE 118 N -1.84 0.00 -0.27 0.00 -5.15 -1.88 -2.19 116.94 105.61 1qi9 h PHE 118 Ca -0.45 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.32 1qi9 h PHE 118 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.44 1qi9 h PHE 118 CO 0.49 0.00 0.00 -1.13 -2.00 0.00 0.00 178.31 175.67 1qi9 n SER 119 N -3.84 2.72 -0.01 -0.68 3.41 -1.26 -4.50 113.62 109.47 1qi9 n SER 119 Ca 0.04 -1.86 0.14 0.00 -0.26 0.00 0.00 58.87 56.93 1qi9 n SER 119 Cb 0.43 -0.18 0.67 0.00 -0.26 0.00 0.00 64.21 64.87 1qi9 n SER 119 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1qi9 n ALA 120 N 0.63 2.46 -2.40 7.33 0.00 -0.82 -4.83 120.51 122.88 1qi9 n ALA 120 Ca 0.11 -0.14 -0.21 0.00 0.00 0.00 0.00 53.44 53.21 1qi9 n ALA 120 Cb 0.40 -1.46 -0.10 0.00 0.00 0.00 0.00 19.45 18.29 1qi9 n ALA 120 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1qi9 s THR 121 N -2.78 1.89 0.18 0.00 -4.23 -1.26 -4.99 115.64 104.45 1qi9 s THR 121 Ca 0.21 -2.23 0.03 0.00 -1.18 0.00 0.00 61.69 58.52 1qi9 s THR 121 Cb 0.20 -2.21 -0.05 0.00 1.34 0.00 0.00 72.50 71.78 1qi9 s THR 121 CO 0.50 -0.47 -0.04 0.42 -0.54 0.00 0.00 174.62 174.48 1qi9 s THR 122 N -2.87 1.00 0.10 3.99 -4.23 -1.26 -5.01 115.64 107.35 1qi9 s THR 122 Ca 0.26 -2.03 0.05 0.00 -1.18 0.00 0.00 61.69 58.79 1qi9 s THR 122 Cb -0.00 -2.07 -0.03 0.00 1.34 0.00 0.00 72.50 71.73 1qi9 s THR 122 CO 0.10 -0.55 -0.14 0.27 -0.54 0.00 0.00 174.62 173.77 1qi9 s ILE 123 N -3.44 1.20 0.80 2.99 -4.36 -1.26 -4.97 121.20 112.16 1qi9 s ILE 123 Ca 0.22 -1.53 -0.13 0.00 -0.26 0.00 0.00 60.65 58.96 1qi9 s ILE 123 Cb 0.04 -1.31 0.08 0.00 1.25 0.00 0.00 42.46 42.52 1qi9 s ILE 123 CO 0.04 -0.34 1.16 -2.84 0.24 0.00 0.00 174.94 173.20 1qi9 s PRO 124 N -2.27 1.78 0.50 0.37 0.02 -1.26 -4.85 135.00 129.29 1qi9 s PRO 124 Ca 0.04 1.58 -0.22 0.00 0.02 0.00 0.00 61.00 62.42 1qi9 s PRO 124 Cb -0.07 -1.81 -0.08 0.00 0.02 0.00 0.00 34.50 32.56 1qi9 s PRO 124 CO 0.02 -2.07 1.08 -2.30 -0.33 0.00 0.00 177.00 173.40 1qi9 n PRO 125 N -3.37 1.34 -2.61 5.54 -0.02 -1.26 -4.95 135.00 129.67 1qi9 n PRO 125 Ca 0.12 0.49 -0.39 0.00 -2.02 0.00 0.00 63.50 61.70 1qi9 n PRO 125 Cb 0.51 -2.21 -0.05 0.00 -0.02 0.00 0.00 33.50 31.73 1qi9 n PRO 125 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1qi9 s VAL 126 N -1.35 3.81 0.24 -1.45 1.01 -1.26 -4.90 120.40 116.50 1qi9 s VAL 126 Ca 0.68 1.67 -0.29 0.00 0.00 0.00 0.00 61.98 64.03 1qi9 s VAL 126 Cb -0.48 -4.00 -0.15 0.00 0.00 0.00 0.00 36.38 31.75 1qi9 s VAL 126 CO 0.53 0.28 1.00 -2.65 0.00 0.00 0.00 175.10 174.26 1qi9 n PRO 127 N 0.89 1.15 -1.44 2.72 -0.02 -1.26 -4.60 135.00 132.43 1qi9 n PRO 127 Ca 0.00 0.40 -0.30 0.00 -2.02 0.00 0.00 63.50 61.59 1qi9 n PRO 127 Cb 0.47 -1.77 0.09 0.00 -0.02 0.00 0.00 33.50 32.27 1qi9 n PRO 127 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1qi9 s THR 128 N -0.79 3.24 0.26 3.45 -4.23 -1.26 -4.79 115.64 111.52 1qi9 s THR 128 Ca 0.64 0.40 -0.02 0.00 -1.18 0.00 0.00 61.69 61.53 1qi9 s THR 128 Cb -0.77 -3.05 0.24 0.00 1.34 0.00 0.00 72.50 70.26 1qi9 s THR 128 CO 0.57 -0.53 1.80 0.25 -0.54 0.00 0.00 174.62 176.17 1qi9 h LEU 129 N -1.11 0.67 0.00 4.79 5.85 -1.96 -1.64 115.31 121.92 1qi9 h LEU 129 Ca -0.46 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.32 1qi9 h LEU 129 Cb 1.25 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.22 1qi9 h LEU 129 CO 0.56 0.34 0.00 -2.65 -0.34 0.00 0.00 178.44 176.36 1qi9 n PRO 130 N -4.77 0.49 -1.79 5.25 -0.02 -1.26 -4.46 135.00 128.45 1qi9 n PRO 130 Ca 0.16 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.33 1qi9 n PRO 130 Cb 0.36 -1.50 0.03 0.00 -0.02 0.00 0.00 33.50 32.37 1qi9 n PRO 130 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1qi9 s SER 131 N -2.51 5.67 0.23 2.55 1.04 -0.62 -3.36 113.70 116.70 1qi9 s SER 131 Ca 0.31 1.65 0.06 0.00 0.48 0.00 0.00 55.95 58.44 1qi9 s SER 131 Cb 0.20 -2.50 0.20 0.00 0.10 0.00 0.00 66.02 64.03 1qi9 s SER 131 CO 0.45 -1.25 1.52 1.55 0.98 0.00 0.00 173.24 176.50 1qi9 h PRO 132 N -0.25 0.16 -0.17 4.02 0.13 -1.91 -1.97 132.00 132.01 1qi9 h PRO 132 Ca -0.45 -0.13 -0.00 0.00 -0.87 0.00 0.00 66.00 64.55 1qi9 h PRO 132 Cb 1.21 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1qi9 h PRO 132 CO 0.58 0.78 0.09 0.93 -0.23 0.00 0.00 178.00 180.14 1qi9 h GLU 133 N 0.11 0.24 -0.64 0.86 3.07 -1.92 -1.51 114.58 114.78 1qi9 h GLU 133 Ca -0.01 -0.03 0.02 0.00 -0.50 0.00 0.00 59.36 58.83 1qi9 h GLU 133 Cb 1.21 -0.05 -0.04 0.00 -0.84 0.00 0.00 28.75 29.04 1qi9 h GLU 133 CO 0.10 0.26 0.41 1.25 -1.40 0.00 0.00 179.01 179.63 1qi9 h LEU 134 N 0.16 0.69 -0.41 1.33 5.85 -1.76 0.03 115.31 121.19 1qi9 h LEU 134 Ca 0.06 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.81 1qi9 h LEU 134 Cb 0.09 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.92 1qi9 h LEU 134 CO -0.01 0.49 0.19 0.00 -0.34 0.00 0.00 178.44 178.77 1qi9 h ALA 135 N 1.26 0.51 -0.06 1.25 0.00 -1.08 -0.69 119.26 120.46 1qi9 h ALA 135 Ca 0.25 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 55.06 1qi9 h ALA 135 Cb -0.03 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1qi9 h ALA 135 CO -0.08 -0.18 -0.54 0.00 0.00 0.00 0.00 179.25 178.44 1qi9 h ALA 136 N 1.24 0.98 0.31 0.00 0.00 -0.76 -0.76 119.26 120.26 1qi9 h ALA 136 Ca 0.18 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 1qi9 h ALA 136 Cb 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1qi9 h ALA 136 CO -0.15 0.69 -0.15 1.96 0.00 0.00 0.00 179.25 181.60 1qi9 h GLN 137 N 0.13 -0.41 -0.40 0.00 1.08 -0.53 -1.94 115.11 113.04 1qi9 h GLN 137 Ca 0.00 0.03 -0.09 0.00 -1.45 0.00 0.00 58.65 57.14 1qi9 h GLN 137 Cb 1.00 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.51 1qi9 h GLN 137 CO 0.08 -0.26 -0.11 1.25 -0.95 0.00 0.00 178.83 178.84 1qi9 h LEU 138 N -0.43 0.69 -0.54 1.46 5.85 -1.10 -2.64 115.31 118.60 1qi9 h LEU 138 Ca -0.04 -0.20 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 1qi9 h LEU 138 Cb 0.33 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 1qi9 h LEU 138 CO 0.07 0.83 0.28 0.00 -0.34 0.00 0.00 178.44 179.28 1qi9 h ALA 139 N 1.24 0.69 -0.86 1.25 0.00 -1.04 -1.75 119.26 118.80 1qi9 h ALA 139 Ca 0.11 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 55.00 1qi9 h ALA 139 Cb 0.56 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.06 1qi9 h ALA 139 CO 0.03 0.23 0.51 1.49 0.00 0.00 0.00 179.25 181.51 1qi9 h GLU 140 N 0.72 0.84 0.08 0.00 4.81 -1.05 0.16 114.58 120.13 1qi9 h GLU 140 Ca 0.19 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 1qi9 h GLU 140 Cb 0.08 -0.19 0.00 0.00 0.63 0.00 0.00 28.75 29.27 1qi9 h GLU 140 CO -0.03 0.55 -0.04 0.28 -0.73 0.00 0.00 179.01 179.05 1qi9 h VAL 141 N 0.86 0.93 -0.70 0.32 2.07 -1.12 0.12 116.25 118.73 1qi9 h VAL 141 Ca 0.41 -0.02 0.06 0.00 0.82 0.00 0.00 66.70 67.97 1qi9 h VAL 141 Cb 0.34 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 30.99 1qi9 h VAL 141 CO -0.23 0.00 0.40 1.88 0.02 0.00 0.00 177.57 179.64 1qi9 h TYR 142 N -0.11 0.73 -0.59 1.57 0.05 -0.82 -1.37 116.97 116.44 1qi9 h TYR 142 Ca -0.01 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.71 1qi9 h TYR 142 Cb 0.09 -0.23 -0.02 0.00 1.01 0.00 0.00 36.73 37.57 1qi9 h TYR 142 CO -0.07 0.36 0.05 -1.49 -1.05 0.00 0.00 178.16 175.95 1qi9 h TRP 143 N 0.73 1.05 -1.00 4.88 4.06 -0.20 -1.37 115.95 124.10 1qi9 h TRP 143 Ca 0.31 -0.15 0.09 0.00 2.06 0.00 0.00 58.89 61.20 1qi9 h TRP 143 Cb 0.18 -0.29 -0.08 0.00 -1.00 0.00 0.00 29.16 27.98 1qi9 h TRP 143 CO -0.07 0.92 0.64 0.52 -3.56 0.00 0.00 178.44 176.88 1qi9 h MET 144 N 0.91 1.05 -0.60 0.49 2.86 -0.40 0.16 114.93 119.40 1qi9 h MET 144 Ca 0.18 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.68 1qi9 h MET 144 Cb 0.47 -0.24 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 1qi9 h MET 144 CO 0.02 0.70 0.11 0.00 1.06 0.00 0.00 176.91 178.80 1qi9 h ALA 145 N 1.49 0.80 0.00 6.32 0.00 -0.74 -2.12 119.26 125.01 1qi9 h ALA 145 Ca 0.46 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 55.02 1qi9 h ALA 145 Cb 0.32 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1qi9 h ALA 145 CO -0.22 0.54 -0.48 -0.07 0.00 0.00 0.00 179.25 179.03 1qi9 h LEU 146 N 0.90 0.00 -1.21 0.00 3.38 -0.30 -3.06 115.31 115.02 1qi9 h LEU 146 Ca 0.18 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1qi9 h LEU 146 Cb 0.41 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1qi9 h LEU 146 CO 0.01 0.48 0.00 0.00 0.09 0.00 0.00 178.44 179.01 1qi9 n ALA 147 N -2.43 2.50 -0.30 1.53 0.00 0.48 -4.64 120.51 117.64 1qi9 n ALA 147 Ca -0.01 -0.57 0.11 0.00 0.00 0.00 0.00 53.44 52.96 1qi9 n ALA 147 Cb 0.50 -1.05 0.28 0.00 0.00 0.00 0.00 19.45 19.18 1qi9 n ALA 147 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qi9 h ARG 148 N 2.27 0.48 -0.61 0.00 3.08 -1.28 -2.76 114.38 115.56 1qi9 h ARG 148 Ca 0.00 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1qi9 h ARG 148 Cb 0.50 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1qi9 h ARG 148 CO 0.00 0.32 0.00 -0.25 -1.07 0.00 0.00 179.97 178.97 1qi9 n ASP 149 N -4.97 3.48 -4.62 7.04 8.00 -1.26 -1.40 116.55 122.82 1qi9 n ASP 149 Ca 0.20 -2.14 -0.40 0.00 0.71 0.00 0.00 54.79 53.16 1qi9 n ASP 149 Cb 0.57 -0.44 -0.07 0.00 -0.02 0.00 0.00 41.12 41.15 1qi9 n ASP 149 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1qi9 s VAL 150 N -1.44 5.05 0.32 2.53 1.01 -1.04 -5.03 120.40 121.80 1qi9 s VAL 150 Ca 0.40 0.95 -0.29 0.00 0.00 0.00 0.00 61.98 63.04 1qi9 s VAL 150 Cb 0.23 -3.85 -0.11 0.00 0.00 0.00 0.00 36.38 32.65 1qi9 s VAL 150 CO 0.24 0.08 1.51 -2.84 0.00 0.00 0.00 175.10 174.09 1qi9 s PRO 151 N 2.30 4.16 0.42 2.72 0.02 -1.26 -4.42 135.00 138.94 1qi9 s PRO 151 Ca 0.23 2.50 0.20 0.00 0.02 0.00 0.00 61.00 63.94 1qi9 s PRO 151 Cb -0.16 -3.02 1.14 0.00 0.02 0.00 0.00 34.50 32.48 1qi9 s PRO 151 CO 0.09 -0.53 1.82 0.74 -0.33 0.00 0.00 177.00 178.79 1qi9 h PHE 152 N 4.11 0.53 0.00 6.54 0.04 -1.67 -0.16 116.94 126.34 1qi9 h PHE 152 Ca -0.48 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.30 1qi9 h PHE 152 Cb 1.23 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 39.22 1qi9 h PHE 152 CO 0.57 0.10 0.00 -1.33 -0.60 0.00 0.00 178.31 177.04 1qi9 n MET 153 N -4.53 0.15 -0.63 1.51 2.81 -1.26 -2.89 117.12 112.28 1qi9 n MET 153 Ca 0.22 0.02 0.09 0.00 -1.81 0.00 0.00 57.70 56.23 1qi9 n MET 153 Cb 0.82 -1.50 0.36 0.00 -0.71 0.00 0.00 33.22 32.18 1qi9 n MET 153 CO 0.00 0.00 0.00 1.04 1.51 0.00 0.00 175.97 178.52 1qi9 n GLN 154 N -1.42 3.82 -0.30 0.03 6.02 -0.07 -4.58 117.38 120.88 1qi9 n GLN 154 Ca 0.09 -2.91 -0.05 0.00 -0.01 0.00 0.00 57.00 54.12 1qi9 n GLN 154 Cb 0.29 -1.92 0.07 0.00 1.02 0.00 0.00 30.24 29.70 1qi9 n GLN 154 CO 0.00 0.00 0.00 1.88 -1.01 0.00 0.00 177.06 177.93 1qi9 h TYR 155 N 3.96 1.22 0.00 1.08 -1.99 -1.55 0.16 116.97 119.84 1qi9 h TYR 155 Ca 0.00 -0.08 0.00 0.00 2.00 0.00 0.00 58.73 60.65 1qi9 h TYR 155 Cb 1.49 -0.37 0.00 0.00 2.00 0.00 0.00 36.73 39.86 1qi9 h TYR 155 CO 0.78 0.90 0.00 0.78 -0.00 0.00 0.00 178.16 180.63 1qi9 h GLY 156 N 1.18 0.00 0.00 3.88 0.00 -1.85 -3.28 103.07 102.99 1qi9 h GLY 156 Ca 0.27 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.53 1qi9 h GLY 156 CO -0.03 0.00 -1.39 -1.30 0.00 0.00 0.00 176.54 173.82 1qi9 n THR 157 N -2.62 0.29 -2.12 4.70 -2.24 -0.96 -4.88 114.28 106.46 1qi9 n THR 157 Ca 0.02 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 1qi9 n THR 157 Cb 0.29 -0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 68.05 1qi9 n THR 157 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qi9 s ASP 158 N -3.44 6.77 0.36 3.42 -1.08 0.51 -4.90 116.67 118.31 1qi9 s ASP 158 Ca -0.03 2.36 0.05 0.00 -0.52 0.00 0.00 52.55 54.41 1qi9 s ASP 158 Cb 0.03 -2.58 0.72 0.00 -1.46 0.00 0.00 42.92 39.62 1qi9 s ASP 158 CO 0.27 -0.70 1.99 -0.78 0.52 0.00 0.00 175.17 176.46 1qi9 h ASP 159 N 7.01 0.66 -0.28 -0.34 3.58 -1.90 -0.71 116.42 124.45 1qi9 h ASP 159 Ca -0.42 -0.01 0.04 0.00 0.42 0.00 0.00 57.03 57.06 1qi9 h ASP 159 Cb 1.20 -0.15 -0.03 0.00 1.72 0.00 0.00 39.33 42.07 1qi9 h ASP 159 CO 0.88 0.45 0.07 0.40 -2.88 0.00 0.00 179.24 178.16 1qi9 h ILE 160 N 0.77 0.89 0.08 2.25 2.04 -1.94 -1.89 117.51 119.70 1qi9 h ILE 160 Ca 0.27 -0.06 -0.27 0.00 1.00 0.00 0.00 64.86 65.80 1qi9 h ILE 160 Cb 0.11 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.87 1qi9 h ILE 160 CO -0.08 0.03 -1.29 0.71 0.00 0.00 0.00 178.15 177.52 1qi9 h THR 161 N 0.18 1.41 -0.53 -0.27 1.35 -1.69 -1.14 112.91 112.23 1qi9 h THR 161 Ca 0.13 -3.06 0.01 0.00 -0.55 0.00 0.00 66.41 62.93 1qi9 h THR 161 Cb 0.12 2.82 -0.03 0.00 -1.73 0.00 0.00 68.15 69.34 1qi9 h THR 161 CO -0.16 0.86 0.34 0.58 -0.25 0.00 0.00 175.52 176.90 1qi9 h VAL 162 N 0.05 1.12 -0.18 6.82 2.07 -1.16 -2.22 116.25 122.74 1qi9 h VAL 162 Ca -0.14 -0.24 -0.19 0.00 0.82 0.00 0.00 66.70 66.95 1qi9 h VAL 162 Cb 1.93 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 1qi9 h VAL 162 CO 0.16 0.13 -0.67 0.74 0.02 0.00 0.00 177.57 177.95 1qi9 h THR 163 N 0.69 1.31 -0.37 2.57 2.02 -1.35 -2.98 112.91 114.80 1qi9 h THR 163 Ca 0.20 -1.92 0.06 0.00 0.77 0.00 0.00 66.41 65.52 1qi9 h THR 163 Cb -0.06 1.89 -0.06 0.00 -1.74 0.00 0.00 68.15 68.18 1qi9 h THR 163 CO -0.05 0.60 0.03 0.00 0.37 0.00 0.00 175.52 176.47 1qi9 h ALA 164 N 0.75 0.36 -0.47 6.16 0.00 -1.09 0.36 119.26 125.33 1qi9 h ALA 164 Ca -0.02 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.01 1qi9 h ALA 164 Cb 1.27 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 19.17 1qi9 h ALA 164 CO 0.13 -0.37 0.27 0.00 0.00 0.00 0.00 179.25 179.29 1qi9 h ALA 165 N 1.30 0.60 -0.25 0.00 0.00 -1.41 0.95 119.26 120.46 1qi9 h ALA 165 Ca 0.18 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 1qi9 h ALA 165 Cb 0.23 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1qi9 h ALA 165 CO -0.27 -0.04 -0.54 0.00 0.00 0.00 0.00 179.25 178.39 1qi9 h ALA 166 N 1.21 0.40 0.04 0.00 0.00 -1.21 -1.98 119.26 117.73 1qi9 h ALA 166 Ca 0.19 -0.51 0.01 0.00 0.00 0.00 0.00 54.91 54.59 1qi9 h ALA 166 Cb 0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1qi9 h ALA 166 CO -0.09 0.61 -0.07 -0.97 0.00 0.00 0.00 179.25 178.73 1qi9 h ASN 167 N 0.56 -0.18 -0.64 0.00 -0.73 0.02 -1.88 115.58 112.72 1qi9 h ASN 167 Ca 0.00 0.02 -0.01 0.00 1.87 0.00 0.00 56.30 58.18 1qi9 h ASN 167 Cb 1.16 0.07 -0.03 0.00 0.27 0.00 0.00 38.32 39.78 1qi9 h ASN 167 CO 0.12 -0.10 0.34 -0.07 -0.37 0.00 0.00 177.43 177.35 1qi9 h LEU 168 N -0.14 0.81 -1.97 0.34 3.38 -0.88 -2.20 115.31 114.66 1qi9 h LEU 168 Ca 0.01 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.86 1qi9 h LEU 168 Cb 0.15 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.69 1qi9 h LEU 168 CO -0.04 0.68 -0.09 0.00 0.09 0.00 0.00 178.44 179.08 1qi9 h ALA 169 N 1.16 1.63 -0.00 1.53 0.00 -1.16 -1.60 119.26 120.82 1qi9 h ALA 169 Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1qi9 h ALA 169 Cb 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1qi9 h ALA 169 CO -0.03 0.11 -0.21 0.41 0.00 0.00 0.00 179.25 179.52 1qi9 n GLY 170 N -1.12 -1.18 3.71 0.00 0.00 -0.72 -4.85 105.19 101.03 1qi9 n GLY 170 Ca -0.03 -0.25 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 1qi9 n GLY 170 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1qi9 s MET 171 N -2.79 4.44 0.22 1.61 1.00 -0.60 -4.95 119.30 118.22 1qi9 s MET 171 Ca 0.19 1.77 -0.15 0.00 0.00 0.00 0.00 55.69 57.49 1qi9 s MET 171 Cb 0.19 -3.34 0.24 0.00 0.00 0.00 0.00 34.83 31.92 1qi9 s MET 171 CO 0.57 -0.25 1.59 1.49 0.00 0.00 0.00 175.02 178.42 1qi9 h GLU 172 N 6.74 -0.05 -0.00 2.03 4.81 -1.88 -1.26 114.58 124.96 1qi9 h GLU 172 Ca -0.42 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 1qi9 h GLU 172 Cb 1.21 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1qi9 h GLU 172 CO 0.81 -0.04 -0.05 0.41 -0.73 0.00 0.00 179.01 179.41 1qi9 n GLY 173 N -1.48 -1.14 0.24 1.92 0.00 -1.26 -4.38 105.19 99.09 1qi9 n GLY 173 Ca 0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 1qi9 n GLY 173 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1qi9 h PHE 174 N 0.22 0.55 0.00 1.61 3.57 -1.48 -1.14 116.94 120.28 1qi9 h PHE 174 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 1qi9 h PHE 174 Cb 0.31 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.89 1qi9 h PHE 174 CO 0.00 0.25 0.00 -1.35 -2.23 0.00 0.00 178.31 174.98 1qi9 h PRO 175 N 0.56 0.00 -0.45 6.41 0.11 -1.78 -1.78 132.00 135.08 1qi9 h PRO 175 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1qi9 h PRO 175 Cb 0.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.32 1qi9 h PRO 175 CO -0.20 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.68 1qi9 n ASN 176 N -2.41 3.12 -4.79 -2.05 5.03 -0.43 -4.92 115.26 108.80 1qi9 n ASN 176 Ca -0.01 -1.95 -0.32 0.00 0.87 0.00 0.00 54.58 53.17 1qi9 n ASN 176 Cb 0.10 -0.29 0.05 0.00 -1.02 0.00 0.00 39.78 38.61 1qi9 n ASN 176 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1qi9 s LEU 177 N -1.30 3.31 -0.10 3.41 1.43 -0.67 -4.92 118.68 119.84 1qi9 s LEU 177 Ca 0.39 1.85 -0.31 0.00 -1.03 0.00 0.00 54.13 55.02 1qi9 s LEU 177 Cb 0.21 -4.53 -0.09 0.00 0.03 0.00 0.00 46.19 41.81 1qi9 s LEU 177 CO 0.29 -1.54 2.03 0.47 0.23 0.00 0.00 176.35 177.84 1qi9 n ASP 178 N -2.64 3.57 -4.16 2.29 9.92 -1.26 -2.43 116.55 121.84 1qi9 n ASP 178 Ca 0.09 0.70 -0.33 0.00 -0.53 0.00 0.00 54.79 54.72 1qi9 n ASP 178 Cb 0.53 -1.47 -0.03 0.00 -0.64 0.00 0.00 41.12 39.51 1qi9 n ASP 178 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1qi9 n ALA 179 N 8.56 -1.48 -1.86 2.24 0.00 -1.26 -4.85 120.51 121.86 1qi9 n ALA 179 Ca 0.25 -0.09 -0.41 0.00 0.00 0.00 0.00 53.44 53.20 1qi9 n ALA 179 Cb 0.37 -2.89 -0.03 0.00 0.00 0.00 0.00 19.45 16.90 1qi9 n ALA 179 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1qi9 s VAL 180 N -3.51 3.31 -0.27 0.00 0.11 -1.02 -1.32 120.40 117.70 1qi9 s VAL 180 Ca 0.52 1.23 -0.19 0.00 -2.93 0.00 0.00 61.98 60.61 1qi9 s VAL 180 Cb -0.28 -3.79 -0.02 0.00 -1.53 0.00 0.00 36.38 30.76 1qi9 s VAL 180 CO 0.92 0.26 0.59 -0.55 -3.33 0.00 0.00 175.10 172.99 1qi9 s SER 181 N -0.42 6.50 -0.01 3.54 0.15 -1.25 -4.61 113.70 117.61 1qi9 s SER 181 Ca 0.49 0.56 -0.24 0.00 0.70 0.00 0.00 55.95 57.46 1qi9 s SER 181 Cb -0.34 -2.32 0.05 0.00 -1.71 0.00 0.00 66.02 61.71 1qi9 s SER 181 CO 0.42 -0.37 0.54 -0.51 1.20 0.00 0.00 173.24 174.53 1qi9 s ILE 182 N 2.46 0.02 0.80 6.45 2.07 -1.26 -4.78 121.20 126.97 1qi9 s ILE 182 Ca 0.24 -0.19 -0.11 0.00 -1.41 0.00 0.00 60.65 59.18 1qi9 s ILE 182 Cb -0.15 -0.90 0.07 0.00 0.13 0.00 0.00 42.46 41.61 1qi9 s ILE 182 CO 0.10 -0.10 1.09 -0.83 -1.91 0.00 0.00 174.94 173.28 1qi9 s GLY 183 N -1.48 1.65 0.58 1.50 0.00 0.49 -4.91 107.32 105.15 1qi9 s GLY 183 Ca -0.10 0.06 0.36 0.00 0.00 0.00 0.00 44.72 45.04 1qi9 s GLY 183 CO 0.05 0.46 2.13 1.48 0.00 0.00 0.00 173.10 177.21 1qi9 h SER 184 N -1.19 0.00 -0.04 1.64 4.64 -2.02 0.49 113.55 117.06 1qi9 h SER 184 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1qi9 h SER 184 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1qi9 h SER 184 CO 0.54 0.03 0.00 -0.90 -0.87 0.00 0.00 176.83 175.64 1qi9 n ASP 185 N -3.21 1.03 0.00 4.97 5.75 -1.26 -4.91 116.55 118.92 1qi9 n ASP 185 Ca -0.01 -1.42 0.00 0.00 -0.01 0.00 0.00 54.79 53.35 1qi9 n ASP 185 Cb 0.22 -0.02 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 1qi9 n ASP 185 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1qi9 n GLY 186 N 1.08 1.02 3.95 6.12 0.00 0.16 -5.05 105.19 112.48 1qi9 n GLY 186 Ca 0.19 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.98 1qi9 n GLY 186 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qi9 s THR 187 N -3.43 4.82 -0.22 2.61 -4.23 -1.26 -4.78 115.64 109.16 1qi9 s THR 187 Ca 0.00 -0.58 -0.05 0.00 -1.18 0.00 0.00 61.69 59.88 1qi9 s THR 187 Cb 0.00 -3.75 -0.02 0.00 1.34 0.00 0.00 72.50 70.08 1qi9 s THR 187 CO 0.00 -0.45 -0.02 -0.69 -0.54 0.00 0.00 174.62 172.92 1qi9 s VAL 188 N -2.31 3.65 -0.18 2.29 1.01 -1.26 -0.38 120.40 123.22 1qi9 s VAL 188 Ca 0.41 -0.40 -0.29 0.00 0.00 0.00 0.00 61.98 61.70 1qi9 s VAL 188 Cb -0.10 -2.67 -0.00 0.00 0.00 0.00 0.00 36.38 33.62 1qi9 s VAL 188 CO 0.35 0.41 1.00 -0.62 0.00 0.00 0.00 175.10 176.24 1qi9 s ASP 189 N 1.38 7.13 0.14 3.32 2.15 -1.26 -4.72 116.67 124.81 1qi9 s ASP 189 Ca 0.05 1.40 -0.23 0.00 0.43 0.00 0.00 52.55 54.20 1qi9 s ASP 189 Cb -0.14 -2.53 -0.00 0.00 -0.30 0.00 0.00 42.92 39.94 1qi9 s ASP 189 CO -0.01 -0.56 1.64 -0.65 -0.17 0.00 0.00 175.17 175.42 1qi9 h PRO 190 N 7.32 -0.27 -0.48 4.34 0.11 -1.88 0.50 132.00 141.64 1qi9 h PRO 190 Ca -0.24 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.86 1qi9 h PRO 190 Cb 1.10 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.25 1qi9 h PRO 190 CO 0.92 -0.18 0.21 1.25 -0.21 0.00 0.00 178.00 179.99 1qi9 h LEU 191 N -0.28 0.65 -0.98 2.35 5.85 -1.90 -3.18 115.31 117.82 1qi9 h LEU 191 Ca 0.11 -0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1qi9 h LEU 191 Cb 0.44 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.30 1qi9 h LEU 191 CO -0.31 0.63 -0.17 -1.54 -0.34 0.00 0.00 178.44 176.70 1qi9 n SER 192 N -4.59 1.52 0.00 1.25 3.41 -1.14 -4.79 113.62 109.27 1qi9 n SER 192 Ca 0.02 -1.26 0.00 0.00 -0.26 0.00 0.00 58.87 57.36 1qi9 n SER 192 Cb 0.14 0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 1qi9 n SER 192 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1qi9 n GLN 193 N 0.04 2.01 -1.69 4.33 6.02 0.17 -4.75 117.38 123.50 1qi9 n GLN 193 Ca 0.05 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.61 1qi9 n GLN 193 Cb 0.26 -0.79 -0.03 0.00 1.02 0.00 0.00 30.24 30.70 1qi9 n GLN 193 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1qi9 n LEU 194 N -1.47 3.84 -2.84 1.08 7.94 -0.87 -1.69 117.00 123.00 1qi9 n LEU 194 Ca 0.00 1.02 -0.21 0.00 -1.11 0.00 0.00 56.01 55.70 1qi9 n LEU 194 Cb 0.29 -1.52 0.01 0.00 0.53 0.00 0.00 43.42 42.74 1qi9 n LEU 194 CO 0.00 0.09 -0.09 0.49 -1.11 0.00 0.00 177.39 176.76 1qi9 n PHE 195 N 5.05 -1.63 -4.44 1.96 3.72 -1.26 -4.98 117.46 115.88 1qi9 n PHE 195 Ca 0.18 0.32 -0.30 0.00 -0.05 0.00 0.00 57.45 57.59 1qi9 n PHE 195 Cb 0.35 -3.99 -0.05 0.00 -0.94 0.00 0.00 39.48 34.85 1qi9 n PHE 195 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1qi9 s ARG 196 N -5.50 2.21 0.08 -1.08 0.52 -0.68 -5.08 118.95 109.43 1qi9 s ARG 196 Ca 0.20 -2.25 -0.00 0.00 -0.52 0.00 0.00 55.73 53.16 1qi9 s ARG 196 Cb -0.09 -1.74 -0.04 0.00 0.52 0.00 0.00 34.95 33.60 1qi9 s ARG 196 CO 0.25 -0.44 -0.02 0.00 0.02 0.00 0.00 175.30 175.11 1qi9 s ALA 197 N -2.83 0.72 -2.13 2.13 0.00 -1.26 -3.83 121.76 114.55 1qi9 s ALA 197 Ca 0.17 -1.30 0.20 0.00 0.00 0.00 0.00 51.96 51.03 1qi9 s ALA 197 Cb 0.00 0.35 0.98 0.00 0.00 0.00 0.00 23.12 24.45 1qi9 s ALA 197 CO 0.10 -0.35 1.66 0.25 0.00 0.00 0.00 175.76 177.42 1qi9 n THR 198 N 0.03 0.09 -1.68 0.00 -2.24 -0.44 -4.14 114.28 105.90 1qi9 n THR 198 Ca -0.12 -0.15 -0.39 0.00 -2.27 0.00 0.00 64.05 61.11 1qi9 n THR 198 Cb 0.61 0.01 0.03 0.00 -2.10 0.00 0.00 70.33 68.89 1qi9 n THR 198 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1qi9 n PHE 199 N -0.30 1.69 -1.63 4.78 3.72 -1.26 -4.79 117.46 119.66 1qi9 n PHE 199 Ca 0.15 0.47 -0.56 0.00 -0.05 0.00 0.00 57.45 57.47 1qi9 n PHE 199 Cb 0.19 -2.29 -0.07 0.00 -0.94 0.00 0.00 39.48 36.37 1qi9 n PHE 199 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 1qi9 n VAL 200 N -0.90 0.11 0.00 -4.37 0.31 -0.63 -2.20 118.33 110.64 1qi9 n VAL 200 Ca 0.10 -0.02 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 1qi9 n VAL 200 Cb 0.43 -0.87 0.00 0.00 -0.91 0.00 0.00 33.84 32.49 1qi9 n VAL 200 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1qi9 n GLY 201 N 3.11 2.69 0.27 2.92 0.00 -1.26 -4.51 105.19 108.41 1qi9 n GLY 201 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 1qi9 n GLY 201 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1qi9 h VAL 202 N 0.00 1.19 -0.00 1.61 2.07 -1.67 -2.51 116.25 116.93 1qi9 h VAL 202 Ca 0.00 -0.76 0.00 0.00 0.82 0.00 0.00 66.70 66.76 1qi9 h VAL 202 Cb 0.00 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 1qi9 h VAL 202 CO 0.00 0.26 -0.26 -0.62 0.02 0.00 0.00 177.57 176.97 1qi9 n GLU 203 N -4.28 0.45 -3.40 1.57 1.02 -1.26 -4.85 120.64 109.89 1qi9 n GLU 203 Ca 0.01 -0.22 -0.38 0.00 -0.02 0.00 0.00 57.16 56.56 1qi9 n GLU 203 Cb 0.24 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.11 1qi9 n GLU 203 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1qi9 s THR 204 N -2.70 5.13 0.00 2.62 2.01 -0.95 -4.91 115.64 116.85 1qi9 s THR 204 Ca 0.20 0.88 0.00 0.00 0.31 0.00 0.00 61.69 63.08 1qi9 s THR 204 Cb 0.19 -3.76 0.00 0.00 0.01 0.00 0.00 72.50 68.93 1qi9 s THR 204 CO 0.56 0.42 0.00 0.61 -0.69 0.00 0.00 174.62 175.53 1qi9 n GLY 205 N 2.76 -1.09 3.70 4.40 0.00 -1.26 -4.88 105.19 108.81 1qi9 n GLY 205 Ca -0.10 -1.19 -0.34 0.00 0.00 0.00 0.00 46.02 44.39 1qi9 n GLY 205 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1qi9 s PRO 206 N 0.00 1.66 0.17 1.61 0.02 -1.26 -4.94 135.00 132.26 1qi9 s PRO 206 Ca 0.00 1.78 -0.14 0.00 0.02 0.00 0.00 61.00 62.67 1qi9 s PRO 206 Cb 0.00 -1.78 0.06 0.00 0.02 0.00 0.00 34.50 32.81 1qi9 s PRO 206 CO 0.00 -2.20 1.78 0.35 -0.33 0.00 0.00 177.00 176.60 1qi9 h PHE 207 N -0.84 0.74 -3.35 6.54 3.04 -1.90 -3.43 116.94 117.76 1qi9 h PHE 207 Ca -0.46 -0.01 -0.56 0.00 3.98 0.00 0.00 57.97 60.91 1qi9 h PHE 207 Cb 1.30 -0.24 -0.05 0.00 2.56 0.00 0.00 35.95 39.52 1qi9 h PHE 207 CO 0.46 0.54 0.04 0.42 -2.02 0.00 0.00 178.31 177.74 1qi9 s ILE 208 N -5.88 4.98 0.48 1.41 -1.09 -1.26 -4.95 121.20 114.89 1qi9 s ILE 208 Ca -0.13 1.34 -0.21 0.00 -2.23 0.00 0.00 60.65 59.42 1qi9 s ILE 208 Cb 0.12 -3.99 -0.10 0.00 -1.58 0.00 0.00 42.46 36.91 1qi9 s ILE 208 CO 0.76 0.33 0.67 -0.24 -1.23 0.00 0.00 174.94 175.22 1qi9 n SER 209 N 3.32 -0.37 0.27 3.58 2.88 -1.26 -4.86 113.62 117.18 1qi9 n SER 209 Ca -0.04 0.88 0.12 0.00 -1.33 0.00 0.00 58.87 58.50 1qi9 n SER 209 Cb 0.51 -1.20 0.74 0.00 -0.75 0.00 0.00 64.21 63.51 1qi9 n SER 209 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1qi9 h GLN 210 N 0.77 0.00 0.00 -1.46 1.08 -1.91 -1.76 115.11 111.83 1qi9 h GLN 210 Ca -0.43 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 1qi9 h GLN 210 Cb 1.38 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.81 1qi9 h GLN 210 CO 0.51 0.10 0.00 -0.07 -0.95 0.00 0.00 178.83 178.42 1qi9 h LEU 211 N 0.00 0.00 0.00 1.46 3.38 -1.89 -2.61 115.31 115.66 1qi9 h LEU 211 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1qi9 h LEU 211 Cb 0.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1qi9 h LEU 211 CO 0.01 0.00 -1.50 0.18 0.09 0.00 0.00 178.44 177.22 1qi9 n LEU 212 N -2.70 0.42 -0.02 1.67 4.32 -0.66 -4.41 117.00 115.63 1qi9 n LEU 212 Ca 0.01 -0.11 0.04 0.00 -0.02 0.00 0.00 56.01 55.93 1qi9 n LEU 212 Cb 0.26 -0.02 -0.04 0.00 -1.62 0.00 0.00 43.42 41.99 1qi9 n LEU 212 CO 0.23 0.06 -0.00 1.33 -1.22 0.00 0.00 177.39 177.79 1qi9 n VAL 213 N -2.03 0.00 -3.83 4.08 0.24 -1.08 -4.82 118.33 110.88 1qi9 n VAL 213 Ca -0.01 -0.31 -0.27 0.00 -2.04 0.00 0.00 64.34 61.71 1qi9 n VAL 213 Cb 0.48 1.01 -0.03 0.00 -1.47 0.00 0.00 33.84 33.83 1qi9 n VAL 213 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1qi9 s ASN 214 N -1.73 6.36 0.63 -1.34 0.01 -1.00 -4.71 114.94 113.16 1qi9 s ASN 214 Ca 0.03 0.28 -0.18 0.00 -0.71 0.00 0.00 52.86 52.28 1qi9 s ASN 214 Cb 0.06 -1.96 -0.02 0.00 0.41 0.00 0.00 41.25 39.75 1qi9 s ASN 214 CO 0.33 0.02 1.28 -0.44 -1.51 0.00 0.00 177.10 176.77 1qi9 s SER 215 N -3.15 4.75 0.11 -1.22 0.01 -1.26 -4.63 113.70 108.32 1qi9 s SER 215 Ca 0.36 2.58 0.07 0.00 1.31 0.00 0.00 55.95 60.28 1qi9 s SER 215 Cb -0.11 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.47 1qi9 s SER 215 CO 0.29 -1.90 -0.18 0.72 0.41 0.00 0.00 173.24 172.58 1qi9 s PHE 216 N -1.43 1.59 -0.12 2.43 -0.71 -0.89 -4.88 117.98 113.97 1qi9 s PHE 216 Ca 0.81 -0.46 0.00 0.00 -1.04 0.00 0.00 56.93 56.24 1qi9 s PHE 216 Cb -0.36 -0.85 -0.02 0.00 -1.21 0.00 0.00 43.02 40.58 1qi9 s PHE 216 CO 0.38 0.18 -0.14 0.99 -1.34 0.00 0.00 175.22 175.30 1qi9 s THR 217 N -1.55 3.00 -0.11 -4.49 2.01 -1.26 -0.24 115.64 113.01 1qi9 s THR 217 Ca 0.07 -0.69 -0.00 0.00 0.31 0.00 0.00 61.69 61.38 1qi9 s THR 217 Cb -0.08 -2.25 0.02 0.00 0.01 0.00 0.00 72.50 70.21 1qi9 s THR 217 CO 0.04 0.53 -0.08 -0.51 -0.69 0.00 0.00 174.62 173.91 1qi9 s ILE 218 N 0.25 1.07 -1.37 1.82 2.07 0.64 -4.82 121.20 120.86 1qi9 s ILE 218 Ca -0.09 -0.32 -0.02 0.00 -1.41 0.00 0.00 60.65 58.81 1qi9 s ILE 218 Cb -0.16 -1.07 0.01 0.00 0.13 0.00 0.00 42.46 41.38 1qi9 s ILE 218 CO 0.05 0.37 0.66 0.47 -1.91 0.00 0.00 174.94 174.58 1qi9 n ASP 219 N 4.87 -1.37 -0.75 4.50 8.00 -1.26 0.13 116.55 130.67 1qi9 n ASP 219 Ca -0.13 -0.87 -0.10 0.00 0.71 0.00 0.00 54.79 54.40 1qi9 n ASP 219 Cb 0.50 -3.74 -0.04 0.00 -0.02 0.00 0.00 41.12 37.82 1qi9 n ASP 219 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1qi9 n SER 220 N -3.01 -5.25 -4.30 -2.24 7.64 -1.26 -4.96 113.62 100.24 1qi9 n SER 220 Ca -0.26 0.24 -0.37 0.00 1.01 0.00 0.00 58.87 59.50 1qi9 n SER 220 Cb 0.66 -3.62 -0.13 0.00 -1.01 0.00 0.00 64.21 60.11 1qi9 n SER 220 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1qi9 s ILE 221 N -2.01 3.74 -0.16 0.44 1.01 0.12 -5.08 121.20 119.27 1qi9 s ILE 221 Ca 0.00 -0.87 -0.20 0.00 0.00 0.00 0.00 60.65 59.57 1qi9 s ILE 221 Cb 0.00 -2.99 -0.03 0.00 0.01 0.00 0.00 42.46 39.45 1qi9 s ILE 221 CO 0.00 0.02 0.59 -0.89 0.00 0.00 0.00 174.94 174.66 1qi9 s THR 222 N 1.44 5.08 -0.18 2.92 2.01 -1.26 -0.26 115.64 125.39 1qi9 s THR 222 Ca 0.01 1.14 0.00 0.00 0.31 0.00 0.00 61.69 63.14 1qi9 s THR 222 Cb -0.18 -3.91 0.01 0.00 0.01 0.00 0.00 72.50 68.43 1qi9 s THR 222 CO 0.02 0.20 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.29 1qi9 s VAL 223 N 1.38 2.44 -0.17 3.82 1.01 0.67 -4.98 120.40 124.57 1qi9 s VAL 223 Ca 0.29 -0.82 -0.20 0.00 0.00 0.00 0.00 61.98 61.25 1qi9 s VAL 223 Cb -0.16 -2.04 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1qi9 s VAL 223 CO 0.11 0.51 0.56 -0.70 0.00 0.00 0.00 175.10 175.59 1qi9 s GLU 224 N 1.19 4.25 -0.95 2.72 2.12 -1.26 -2.09 118.70 124.67 1qi9 s GLU 224 Ca 0.02 0.53 -0.08 0.00 0.36 0.00 0.00 54.97 55.79 1qi9 s GLU 224 Cb -0.14 -3.53 -0.15 0.00 0.26 0.00 0.00 34.13 30.57 1qi9 s GLU 224 CO -0.07 -0.09 3.20 -0.35 -0.54 0.00 0.00 175.26 177.41 1qi9 n PRO 225 N 4.53 3.04 -3.04 4.30 -0.04 -1.26 -4.83 135.00 137.70 1qi9 n PRO 225 Ca -0.04 -1.78 -0.41 0.00 -0.04 0.00 0.00 63.50 61.23 1qi9 n PRO 225 Cb 0.51 -2.47 -0.06 0.00 -0.04 0.00 0.00 33.50 31.44 1qi9 n PRO 225 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1qi9 s LYS 226 N 1.50 3.93 0.31 0.54 1.02 -1.26 -4.33 119.74 121.45 1qi9 s LYS 226 Ca 0.68 0.43 0.07 0.00 0.02 0.00 0.00 55.97 57.16 1qi9 s LYS 226 Cb 0.24 -3.73 -0.02 0.00 -0.52 0.00 0.00 37.83 33.80 1qi9 s LYS 226 CO -0.04 -0.62 0.34 1.14 -0.92 0.00 0.00 175.35 175.25 1qi9 s GLN 227 N 2.76 2.97 -0.31 1.68 -2.07 -0.41 -4.63 119.66 119.65 1qi9 s GLN 227 Ca 0.28 -1.10 -0.28 0.00 -1.82 0.00 0.00 55.36 52.45 1qi9 s GLN 227 Cb -0.15 -2.65 0.01 0.00 -1.09 0.00 0.00 33.01 29.14 1qi9 s GLN 227 CO 0.12 0.18 1.00 -2.00 -1.32 0.00 0.00 175.29 173.27 1qi9 s GLU 228 N -4.02 4.06 0.48 9.60 2.12 -1.26 -1.11 118.70 128.57 1qi9 s GLU 228 Ca 0.40 0.97 0.04 0.00 0.36 0.00 0.00 54.97 56.74 1qi9 s GLU 228 Cb -0.08 -3.72 -0.03 0.00 0.26 0.00 0.00 34.13 30.56 1qi9 s GLU 228 CO 0.28 -0.82 0.08 -0.08 -0.54 0.00 0.00 175.26 174.18 1qi9 s THR 229 N 3.42 1.58 0.57 -1.70 -1.32 -1.26 -5.00 115.64 111.93 1qi9 s THR 229 Ca 0.42 -1.90 -0.17 0.00 -1.21 0.00 0.00 61.69 58.83 1qi9 s THR 229 Cb -0.13 -2.48 -0.05 0.00 -1.51 0.00 0.00 72.50 68.34 1qi9 s THR 229 CO 0.14 0.00 1.06 -0.36 -2.21 0.00 0.00 174.62 173.24 1qi9 s PHE 230 N -2.79 2.99 0.66 9.09 0.08 -1.26 -1.25 117.98 125.50 1qi9 s PHE 230 Ca 0.21 1.52 -0.14 0.00 0.12 0.00 0.00 56.93 58.64 1qi9 s PHE 230 Cb 0.04 -3.02 -0.00 0.00 -0.57 0.00 0.00 43.02 39.46 1qi9 s PHE 230 CO 0.11 -1.07 1.09 0.00 -0.10 0.00 0.00 175.22 175.25 1qi9 s ALA 231 N -2.35 2.54 0.75 5.36 0.00 -0.45 -4.16 121.76 123.44 1qi9 s ALA 231 Ca 0.64 0.41 -0.11 0.00 0.00 0.00 0.00 51.96 52.91 1qi9 s ALA 231 Cb -0.16 -3.27 0.04 0.00 0.00 0.00 0.00 23.12 19.73 1qi9 s ALA 231 CO 0.33 -1.21 1.08 -1.25 0.00 0.00 0.00 175.76 174.71 1qi9 s PRO 232 N -4.32 2.51 0.00 0.00 0.04 -1.26 -4.44 135.00 127.54 1qi9 s PRO 232 Ca 0.64 0.96 0.00 0.00 0.04 0.00 0.00 61.00 62.64 1qi9 s PRO 232 Cb -0.18 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.42 1qi9 s PRO 232 CO 0.44 -1.40 0.00 -0.25 0.04 0.00 0.00 177.00 175.83 1qi9 n ASP 233 N -3.33 0.00 -4.73 6.66 8.00 -1.26 -4.96 116.55 116.92 1qi9 n ASP 233 Ca 0.08 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.16 1qi9 n ASP 233 Cb 0.54 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.61 1qi9 n ASP 233 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1qi9 s VAL 234 N 0.00 3.14 0.25 2.53 1.01 -1.26 -5.03 120.40 121.03 1qi9 s VAL 234 Ca 0.00 0.91 0.05 0.00 0.00 0.00 0.00 61.98 62.94 1qi9 s VAL 234 Cb 0.00 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.74 1qi9 s VAL 234 CO 0.00 0.12 -0.03 0.20 0.00 0.00 0.00 175.10 175.39 1qi9 s ASN 235 N 0.51 2.27 0.40 3.32 0.01 -1.26 -4.91 114.94 115.27 1qi9 s ASN 235 Ca 0.59 -1.20 0.04 0.00 -0.71 0.00 0.00 52.86 51.58 1qi9 s ASN 235 Cb -0.37 -0.07 -0.05 0.00 0.41 0.00 0.00 41.25 41.16 1qi9 s ASN 235 CO 0.37 -0.42 0.05 -0.31 -1.51 0.00 0.00 177.10 175.28 1qi9 s TYR 236 N -3.22 2.04 -1.56 2.20 2.02 0.14 -4.83 117.35 114.13 1qi9 s TYR 236 Ca 0.28 -0.96 -0.15 0.00 -0.37 0.00 0.00 57.07 55.88 1qi9 s TYR 236 Cb 0.05 -1.43 0.10 0.00 -0.40 0.00 0.00 41.96 40.27 1qi9 s TYR 236 CO 0.10 0.09 0.95 -1.33 -1.57 0.00 0.00 175.55 173.79 1qi9 n MET 237 N -0.90 -5.12 0.00 -0.62 2.81 -1.26 -1.81 117.12 110.21 1qi9 n MET 237 Ca -0.07 0.56 0.05 0.00 -1.81 0.00 0.00 57.70 56.43 1qi9 n MET 237 Cb 0.66 -5.42 -0.00 0.00 -0.71 0.00 0.00 33.22 27.75 1qi9 n MET 237 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 1qi9 n VAL 238 N -4.63 0.00 -3.35 2.03 0.24 -1.26 -4.62 118.33 106.74 1qi9 n VAL 238 Ca 0.05 -0.39 -0.38 0.00 -2.04 0.00 0.00 64.34 61.57 1qi9 n VAL 238 Cb 0.52 1.11 -0.06 0.00 -1.47 0.00 0.00 33.84 33.94 1qi9 n VAL 238 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1qi9 s ASP 239 N -1.35 6.68 0.17 -1.34 -1.08 -1.26 -4.67 116.67 113.82 1qi9 s ASP 239 Ca 0.08 0.81 -0.14 0.00 -0.52 0.00 0.00 52.55 52.77 1qi9 s ASP 239 Cb 0.08 -2.27 0.12 0.00 -1.46 0.00 0.00 42.92 39.39 1qi9 s ASP 239 CO 0.25 0.05 1.76 0.15 0.52 0.00 0.00 175.17 177.90 1qi9 h PHE 240 N 6.48 0.32 -0.89 -5.34 3.57 -1.98 -1.75 116.94 117.35 1qi9 h PHE 240 Ca -0.42 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.08 1qi9 h PHE 240 Cb 1.18 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.80 1qi9 h PHE 240 CO 0.63 0.13 0.47 -0.44 -2.23 0.00 0.00 178.31 176.87 1qi9 h ASP 241 N 0.36 1.13 -0.52 0.41 3.32 -1.99 -0.43 116.42 118.71 1qi9 h ASP 241 Ca 0.21 -0.11 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 1qi9 h ASP 241 Cb 0.18 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 1qi9 h ASP 241 CO -0.19 0.91 0.13 -0.33 -1.72 0.00 0.00 179.24 178.05 1qi9 h GLU 242 N 1.25 0.82 -0.61 3.56 5.08 -1.90 0.05 114.58 122.84 1qi9 h GLU 242 Ca 0.31 -0.19 0.03 0.00 -1.00 0.00 0.00 59.36 58.51 1qi9 h GLU 242 Cb 0.05 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 1qi9 h GLU 242 CO -0.05 0.78 0.37 2.35 -1.00 0.00 0.00 179.01 181.46 1qi9 h TRP 243 N 0.71 0.68 -0.41 4.33 7.01 -0.92 -2.06 115.95 125.29 1qi9 h TRP 243 Ca 0.16 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.09 1qi9 h TRP 243 Cb 0.32 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 27.15 1qi9 h TRP 243 CO 0.02 0.38 -0.11 1.25 -2.79 0.00 0.00 178.44 177.19 1qi9 h LEU 244 N 0.72 0.81 -0.32 0.65 6.46 -0.57 -1.47 115.31 121.59 1qi9 h LEU 244 Ca 0.25 -0.37 0.05 0.00 -0.12 0.00 0.00 57.88 57.69 1qi9 h LEU 244 Cb 0.05 -0.22 -0.04 0.00 -0.73 0.00 0.00 40.66 39.71 1qi9 h LEU 244 CO -0.11 0.99 0.06 -1.13 -0.62 0.00 0.00 178.44 177.63 1qi9 h ASN 245 N 0.62 0.01 -0.37 1.25 -1.24 -0.83 -0.50 115.58 114.52 1qi9 h ASN 245 Ca 0.10 0.05 0.00 0.00 0.71 0.00 0.00 56.30 57.17 1qi9 h ASN 245 Cb 0.64 0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.74 1qi9 h ASN 245 CO 0.04 0.04 0.24 0.40 -1.29 0.00 0.00 177.43 176.87 1qi9 h ILE 246 N 0.18 1.10 -0.03 2.57 1.08 -1.24 -0.82 117.51 120.35 1qi9 h ILE 246 Ca 0.15 -0.19 -0.02 0.00 -0.39 0.00 0.00 64.86 64.42 1qi9 h ILE 246 Cb 0.17 0.56 -0.00 0.00 -3.07 0.00 0.00 36.82 34.48 1qi9 h ILE 246 CO -0.20 0.10 -0.07 1.56 -0.69 0.00 0.00 178.15 178.85 1qi9 h GLN 247 N 0.50 0.04 -0.35 2.37 1.08 -0.57 -1.72 115.11 116.44 1qi9 h GLN 247 Ca 0.13 -0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.33 1qi9 h GLN 247 Cb -0.05 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.37 1qi9 h GLN 247 CO -0.03 0.11 0.00 0.09 -0.95 0.00 0.00 178.83 178.05 1qi9 n ASN 248 N -4.44 1.55 0.00 1.46 3.02 -0.26 -0.98 115.26 115.61 1qi9 n ASN 248 Ca -0.02 -2.05 0.00 0.00 -0.03 0.00 0.00 54.58 52.47 1qi9 n ASN 248 Cb 0.16 -0.23 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 1qi9 n ASN 248 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qi9 n GLY 249 N 0.78 0.53 3.87 7.41 0.00 -0.65 -1.82 105.19 115.31 1qi9 n GLY 249 Ca 0.09 -0.64 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 1qi9 n GLY 249 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qi9 s GLY 250 N -2.58 1.61 0.62 -0.02 0.00 -0.39 -4.00 107.32 102.56 1qi9 s GLY 250 Ca 0.00 -0.45 -0.16 0.00 0.00 0.00 0.00 44.72 44.11 1qi9 s GLY 250 CO 0.00 -0.01 1.10 2.56 0.00 0.00 0.00 173.10 176.75 1qi9 s PRO 251 N -5.40 3.02 0.73 2.90 0.04 -1.26 -4.56 135.00 130.46 1qi9 s PRO 251 Ca 0.60 1.38 -0.16 0.00 0.04 0.00 0.00 61.00 62.87 1qi9 s PRO 251 Cb -0.12 -1.98 0.03 0.00 0.04 0.00 0.00 34.50 32.47 1qi9 s PRO 251 CO 0.51 -1.07 1.18 -2.30 0.04 0.00 0.00 177.00 175.36 1qi9 n PRO 252 N -2.13 0.61 0.20 0.56 -0.02 -1.26 -4.82 135.00 128.14 1qi9 n PRO 252 Ca 0.10 0.27 0.07 0.00 -2.02 0.00 0.00 63.50 61.93 1qi9 n PRO 252 Cb 0.52 -2.42 0.41 0.00 -0.02 0.00 0.00 33.50 31.98 1qi9 n PRO 252 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qi9 h ALA 253 N -0.22 1.05 -1.54 3.55 0.00 -1.94 -3.48 119.26 116.69 1qi9 h ALA 253 Ca -0.48 -0.28 0.12 0.00 0.00 0.00 0.00 54.91 54.27 1qi9 h ALA 253 Cb 1.32 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 1qi9 h ALA 253 CO 0.49 0.39 0.32 0.41 0.00 0.00 0.00 179.25 180.86 1qi9 n GLY 254 N 0.08 0.51 3.93 0.00 0.00 -1.26 -5.16 105.19 103.29 1qi9 n GLY 254 Ca -0.00 -0.91 -0.26 0.00 0.00 0.00 0.00 46.02 44.85 1qi9 n GLY 254 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1qi9 s PRO 255 N -2.01 2.45 0.21 1.61 0.04 -1.26 -4.75 135.00 131.29 1qi9 s PRO 255 Ca 0.11 -0.23 -0.20 0.00 0.04 0.00 0.00 61.00 60.72 1qi9 s PRO 255 Cb -0.00 -2.23 -0.08 0.00 0.04 0.00 0.00 34.50 32.22 1qi9 s PRO 255 CO -0.00 -1.02 0.71 -1.21 0.04 0.00 0.00 177.00 175.51 1qi9 s GLU 256 N -5.12 4.25 0.11 4.56 8.01 -1.26 -4.94 118.70 124.31 1qi9 s GLU 256 Ca 0.58 0.85 -0.31 0.00 0.01 0.00 0.00 54.97 56.11 1qi9 s GLU 256 Cb -0.11 -2.93 -0.07 0.00 -4.31 0.00 0.00 34.13 26.71 1qi9 s GLU 256 CO 0.44 0.42 1.31 -1.17 0.01 0.00 0.00 175.26 176.28 1qi9 s LEU 257 N -1.87 4.38 0.12 1.80 2.96 -1.26 -4.99 118.68 119.81 1qi9 s LEU 257 Ca 0.41 2.22 0.07 0.00 -0.22 0.00 0.00 54.13 56.61 1qi9 s LEU 257 Cb -0.17 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 1qi9 s LEU 257 CO 0.21 -0.57 -0.06 -0.76 -1.32 0.00 0.00 176.35 173.86 1qi9 s LEU 258 N 0.93 3.18 0.27 -0.68 1.43 -1.26 -1.34 118.68 121.21 1qi9 s LEU 258 Ca 0.61 -0.36 -0.29 0.00 -1.03 0.00 0.00 54.13 53.06 1qi9 s LEU 258 Cb -0.34 -1.92 -0.09 0.00 0.03 0.00 0.00 46.19 43.87 1qi9 s LEU 258 CO 0.31 0.15 0.99 -0.62 0.23 0.00 0.00 176.35 177.41 1qi9 s ASP 259 N -2.45 7.45 0.51 2.29 -1.08 -0.38 -4.43 116.67 118.58 1qi9 s ASP 259 Ca 0.24 2.02 0.30 0.00 -0.52 0.00 0.00 52.55 54.59 1qi9 s ASP 259 Cb -0.11 -2.61 1.16 0.00 -1.46 0.00 0.00 42.92 39.91 1qi9 s ASP 259 CO 0.16 0.00 1.91 0.44 0.52 0.00 0.00 175.17 178.20 1qi9 h ASP 260 N 3.81 0.00 -3.20 -0.34 3.32 -1.96 -3.42 116.42 114.63 1qi9 h ASP 260 Ca -0.46 0.00 -0.62 0.00 0.02 0.00 0.00 57.03 55.97 1qi9 h ASP 260 Cb 1.20 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.62 1qi9 h ASP 260 CO 0.67 0.07 -0.52 -1.61 -1.72 0.00 0.00 179.24 176.12 1qi9 s GLU 261 N -3.63 3.96 0.32 3.56 2.02 -1.26 -5.08 118.70 118.58 1qi9 s GLU 261 Ca 0.01 -0.26 -0.28 0.00 0.02 0.00 0.00 54.97 54.46 1qi9 s GLU 261 Cb 0.09 -3.28 -0.10 0.00 0.10 0.00 0.00 34.13 30.94 1qi9 s GLU 261 CO 0.58 0.37 1.18 -0.51 0.02 0.00 0.00 175.26 176.90 1qi9 s LEU 262 N 0.13 4.45 -0.01 1.80 1.02 -1.26 -4.68 118.68 120.13 1qi9 s LEU 262 Ca 0.07 2.43 -0.11 0.00 0.02 0.00 0.00 54.13 56.53 1qi9 s LEU 262 Cb -0.12 -3.70 0.01 0.00 0.02 0.00 0.00 46.19 42.41 1qi9 s LEU 262 CO -0.00 -0.36 0.24 -0.13 0.02 0.00 0.00 176.35 176.11 1qi9 s ARG 263 N -1.71 0.57 0.90 1.70 0.52 -0.26 -4.81 118.95 115.87 1qi9 s ARG 263 Ca 0.48 -0.25 -0.11 0.00 -0.52 0.00 0.00 55.73 55.33 1qi9 s ARG 263 Cb -0.34 0.25 0.14 0.00 0.52 0.00 0.00 34.95 35.51 1qi9 s ARG 263 CO 0.45 -0.15 1.11 -0.06 0.02 0.00 0.00 175.30 176.67 1qi9 s PHE 264 N -1.28 1.92 -0.20 -0.53 0.08 0.48 -1.29 117.98 117.15 1qi9 s PHE 264 Ca -0.13 1.60 -0.29 0.00 0.12 0.00 0.00 56.93 58.22 1qi9 s PHE 264 Cb -0.06 -3.22 -0.02 0.00 -0.57 0.00 0.00 43.02 39.15 1qi9 s PHE 264 CO 0.03 -2.62 1.50 0.08 -0.10 0.00 0.00 175.22 174.11 1qi9 s VAL 265 N -2.73 3.86 0.00 -0.44 1.01 -1.26 -4.66 120.40 116.18 1qi9 s VAL 265 Ca 0.65 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.62 1qi9 s VAL 265 Cb -0.21 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.37 1qi9 s VAL 265 CO 0.58 -0.27 0.36 -2.11 0.00 0.00 0.00 175.10 173.66 1qi9 n ARG 266 N 7.35 0.22 -4.04 2.72 -4.01 -1.26 -4.78 116.66 112.86 1qi9 n ARG 266 Ca 0.17 -0.42 -0.12 0.00 -1.04 0.00 0.00 57.85 56.44 1qi9 n ARG 266 Cb 0.45 -0.62 -0.04 0.00 -3.04 0.00 0.00 32.46 29.21 1qi9 n ARG 266 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 1qi9 s ASN 267 N -0.12 0.42 0.33 2.89 2.20 -1.26 -1.59 114.94 117.81 1qi9 s ASN 267 Ca 0.00 -1.25 0.03 0.00 -0.94 0.00 0.00 52.86 50.70 1qi9 s ASN 267 Cb 0.00 0.63 0.57 0.00 -2.00 0.00 0.00 41.25 40.45 1qi9 s ASN 267 CO 0.00 -1.23 1.90 0.00 -2.94 0.00 0.00 177.10 174.83 1qi9 h ALA 268 N 2.19 1.39 -0.58 3.54 0.00 -1.75 -1.82 119.26 122.23 1qi9 h ALA 268 Ca -0.28 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.41 1qi9 h ALA 268 Cb 1.25 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1qi9 h ALA 268 CO 0.39 0.45 0.12 -0.09 0.00 0.00 0.00 179.25 180.12 1qi9 h ARG 269 N 0.65 0.91 -0.31 0.00 2.43 -1.55 -0.76 114.38 115.76 1qi9 h ARG 269 Ca 0.15 -0.21 -0.14 0.00 -0.81 0.00 0.00 59.98 58.98 1qi9 h ARG 269 Cb 0.21 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1qi9 h ARG 269 CO -0.01 0.83 -0.38 -0.44 -1.51 0.00 0.00 179.97 178.47 1qi9 h ASP 270 N 0.87 0.77 -0.05 -3.80 3.32 -1.69 -1.61 116.42 114.23 1qi9 h ASP 270 Ca 0.19 -0.34 -0.13 0.00 0.02 0.00 0.00 57.03 56.77 1qi9 h ASP 270 Cb 0.34 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1qi9 h ASP 270 CO 0.00 1.07 -0.38 0.25 -1.72 0.00 0.00 179.24 178.46 1qi9 h LEU 271 N 0.60 0.59 -0.45 1.55 5.85 -1.10 -2.63 115.31 119.73 1qi9 h LEU 271 Ca 0.05 -0.25 -0.02 0.00 0.84 0.00 0.00 57.88 58.50 1qi9 h LEU 271 Cb 0.92 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1qi9 h LEU 271 CO 0.08 0.91 0.19 0.00 -0.34 0.00 0.00 178.44 179.28 1qi9 h ALA 272 N 1.12 0.58 -1.01 1.25 0.00 -0.97 -2.73 119.26 117.50 1qi9 h ALA 272 Ca 0.05 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 54.91 1qi9 h ALA 272 Cb 0.87 -0.18 -0.08 0.00 0.00 0.00 0.00 17.79 18.41 1qi9 h ALA 272 CO 0.07 0.17 0.64 -0.09 0.00 0.00 0.00 179.25 180.05 1qi9 h ARG 273 N 0.58 1.06 -0.17 0.00 9.65 -1.00 -0.84 114.38 123.65 1qi9 h ARG 273 Ca 0.15 -0.06 0.04 0.00 -1.10 0.00 0.00 59.98 59.01 1qi9 h ARG 273 Cb 0.17 -0.24 -0.05 0.00 -1.39 0.00 0.00 29.97 28.46 1qi9 h ARG 273 CO -0.01 0.70 -0.12 0.28 2.80 0.00 0.00 179.97 183.61 1qi9 h VAL 274 N 1.09 0.64 0.00 0.20 2.07 -1.17 -1.94 116.25 117.14 1qi9 h VAL 274 Ca 0.46 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.98 1qi9 h VAL 274 Cb 0.32 0.64 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1qi9 h VAL 274 CO -0.22 0.00 0.00 0.71 0.02 0.00 0.00 177.57 178.08 1qi9 h THR 275 N -0.13 0.00 0.00 2.57 1.35 -1.20 -0.90 112.91 114.60 1qi9 h THR 275 Ca 0.10 -0.44 -0.11 0.00 -0.55 0.00 0.00 66.41 65.41 1qi9 h THR 275 Cb 0.28 1.34 -0.02 0.00 -1.73 0.00 0.00 68.15 68.02 1qi9 h THR 275 CO -0.25 0.00 -0.65 0.15 -0.25 0.00 0.00 175.52 174.52 1qi9 h PHE 276 N 0.00 0.00 -0.01 4.73 3.57 -0.43 -3.36 116.94 121.43 1qi9 h PHE 276 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1qi9 h PHE 276 Cb 0.52 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.26 1qi9 h PHE 276 CO 0.00 0.49 0.00 0.25 -2.23 0.00 0.00 178.31 176.82 1qi9 n THR 277 N -3.16 1.44 -2.15 4.41 -2.24 -0.84 -5.04 114.28 106.71 1qi9 n THR 277 Ca 0.00 -1.62 -0.28 0.00 -2.27 0.00 0.00 64.05 59.89 1qi9 n THR 277 Cb 0.74 0.14 0.16 0.00 -2.10 0.00 0.00 70.33 69.27 1qi9 n THR 277 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1qi9 s ASP 278 N -1.90 3.58 -0.38 3.42 1.47 -0.40 -5.05 116.67 117.41 1qi9 s ASP 278 Ca 0.16 0.08 0.03 0.00 1.18 0.00 0.00 52.55 54.00 1qi9 s ASP 278 Cb 0.14 -0.25 0.16 0.00 -0.34 0.00 0.00 42.92 42.62 1qi9 s ASP 278 CO 0.02 -2.41 0.37 0.20 0.68 0.00 0.00 175.17 174.03 1qi9 s ASN 279 N -4.83 1.33 0.00 2.11 0.01 -1.26 -5.01 114.94 107.30 1qi9 s ASN 279 Ca 0.71 -1.87 0.00 0.00 -0.71 0.00 0.00 52.86 50.99 1qi9 s ASN 279 Cb -0.05 0.37 0.00 0.00 0.41 0.00 0.00 41.25 41.99 1qi9 s ASN 279 CO 0.50 -0.24 0.00 -0.38 -1.51 0.00 0.00 177.10 175.47 1qi9 n ILE 280 N 3.96 0.00 -1.52 0.60 2.08 -1.26 -2.91 119.36 120.32 1qi9 n ILE 280 Ca 0.14 0.00 0.06 0.00 0.56 0.00 0.00 62.75 63.51 1qi9 n ILE 280 Cb 0.45 0.00 0.09 0.00 -0.75 0.00 0.00 39.64 39.43 1qi9 n ILE 280 CO 0.00 0.00 0.00 -0.46 0.56 0.00 0.00 176.55 176.65 1qi9 n ASN 281 N 1.46 1.43 -0.23 4.38 0.23 -1.26 -4.85 115.26 116.42 1qi9 n ASN 281 Ca 0.00 -2.74 0.00 0.00 -0.53 0.00 0.00 54.58 51.31 1qi9 n ASN 281 Cb 0.00 -0.36 0.23 0.00 -2.08 0.00 0.00 39.78 37.58 1qi9 n ASN 281 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1qi9 h THR 282 N 2.84 1.20 -0.25 5.53 1.35 -1.92 0.04 112.91 121.69 1qi9 h THR 282 Ca -0.01 -0.37 -0.10 0.00 -0.55 0.00 0.00 66.41 65.37 1qi9 h THR 282 Cb 1.19 0.07 -0.00 0.00 -1.73 0.00 0.00 68.15 67.68 1qi9 h THR 282 CO 0.01 0.19 -0.25 -0.33 -0.25 0.00 0.00 175.52 174.89 1qi9 h GLU 283 N 1.04 0.61 0.00 4.72 3.07 -1.90 -1.47 114.58 120.64 1qi9 h GLU 283 Ca 0.28 -0.32 -0.07 0.00 -0.50 0.00 0.00 59.36 58.75 1qi9 h GLU 283 Cb -0.11 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 27.80 1qi9 h GLU 283 CO -0.06 0.92 -0.31 0.00 -1.40 0.00 0.00 179.01 178.15 1qi9 h ALA 284 N 0.68 1.07 -0.11 3.43 0.00 -1.84 -1.37 119.26 121.11 1qi9 h ALA 284 Ca 0.04 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 1qi9 h ALA 284 Cb 0.81 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1qi9 h ALA 284 CO 0.06 0.39 -0.13 -0.92 0.00 0.00 0.00 179.25 178.65 1qi9 h TYR 285 N 0.00 0.35 -0.35 0.00 3.20 -0.82 0.47 116.97 119.82 1qi9 h TYR 285 Ca -0.00 -0.11 0.06 0.00 3.14 0.00 0.00 58.73 61.82 1qi9 h TYR 285 Cb 0.78 -0.07 -0.06 0.00 1.54 0.00 0.00 36.73 38.92 1qi9 h TYR 285 CO 0.00 0.72 -0.01 0.00 -1.64 0.00 0.00 178.16 177.23 1qi9 h ARG 286 N -0.12 0.08 -0.67 1.82 3.08 -1.09 -0.98 114.38 116.52 1qi9 h ARG 286 Ca 0.02 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1qi9 h ARG 286 Cb 0.67 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.67 1qi9 h ARG 286 CO 0.03 0.05 0.34 0.78 -1.07 0.00 0.00 179.97 180.11 1qi9 h GLY 287 N 0.08 1.01 0.69 0.04 0.00 -1.02 -1.77 103.07 102.11 1qi9 h GLY 287 Ca 0.17 -0.49 0.07 0.00 0.00 0.00 0.00 47.33 47.08 1qi9 h GLY 287 CO -0.30 0.46 0.52 0.00 0.00 0.00 0.00 176.54 177.23 1qi9 h ALA 288 N 1.16 1.18 -0.43 3.60 0.00 0.49 0.13 119.26 125.39 1qi9 h ALA 288 Ca 0.23 -0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.99 1qi9 h ALA 288 Cb 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1qi9 h ALA 288 CO -0.03 0.25 -0.30 -0.07 0.00 0.00 0.00 179.25 179.10 1qi9 h LEU 289 N 0.94 0.99 -0.25 0.00 3.38 -0.75 -1.68 115.31 117.94 1qi9 h LEU 289 Ca 0.38 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1qi9 h LEU 289 Cb 0.20 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1qi9 h LEU 289 CO -0.18 1.21 0.15 0.40 0.09 0.00 0.00 178.44 180.11 1qi9 h ILE 290 N 0.80 1.08 -0.68 1.22 2.04 -0.84 -1.57 117.51 119.56 1qi9 h ILE 290 Ca 0.09 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.73 1qi9 h ILE 290 Cb 0.88 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.69 1qi9 h ILE 290 CO 0.08 0.08 0.29 -0.07 0.00 0.00 0.00 178.15 178.53 1qi9 h LEU 291 N 0.32 0.90 -0.17 1.44 3.38 -0.63 -1.88 115.31 118.67 1qi9 h LEU 291 Ca 0.09 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1qi9 h LEU 291 Cb -0.00 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 1qi9 h LEU 291 CO -0.02 0.79 0.03 0.25 0.09 0.00 0.00 178.44 179.58 1qi9 h LEU 292 N 0.98 0.27 -2.13 1.67 5.85 -1.14 -1.15 115.31 119.66 1qi9 h LEU 292 Ca 0.23 -0.26 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1qi9 h LEU 292 Cb 0.16 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.11 1qi9 h LEU 292 CO -0.02 0.46 -0.05 1.23 -0.34 0.00 0.00 178.44 179.72 1qi9 h GLY 293 N 0.07 0.00 0.09 3.75 0.00 -0.93 -1.33 103.07 104.70 1qi9 h GLY 293 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1qi9 h GLY 293 CO 0.00 0.00 -0.16 1.04 0.00 0.00 0.00 176.54 177.42 1qi9 n LEU 294 N -4.05 1.11 -1.27 3.11 4.77 -0.74 -4.93 117.00 115.00 1qi9 n LEU 294 Ca -0.03 -0.31 -0.11 0.00 -0.03 0.00 0.00 56.01 55.53 1qi9 n LEU 294 Cb 0.14 -0.09 -0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1qi9 n LEU 294 CO 0.31 0.20 -0.14 -0.67 -1.33 0.00 0.00 177.39 175.76 1qi9 n ASP 295 N -0.42 -3.62 0.08 -1.43 2.03 -0.50 -4.88 116.55 107.80 1qi9 n ASP 295 Ca 0.15 -0.01 -0.10 0.00 0.52 0.00 0.00 54.79 55.35 1qi9 n ASP 295 Cb 0.34 -2.85 -0.02 0.00 -0.72 0.00 0.00 41.12 37.87 1qi9 n ASP 295 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1qi9 h ALA 296 N 0.53 0.47 -3.64 -1.67 0.00 -1.46 -3.40 119.26 110.08 1qi9 h ALA 296 Ca -0.26 -0.73 -0.67 0.00 0.00 0.00 0.00 54.91 53.24 1qi9 h ALA 296 Cb 1.20 -0.06 -0.27 0.00 0.00 0.00 0.00 17.79 18.65 1qi9 h ALA 296 CO 0.31 0.90 -0.79 0.12 0.00 0.00 0.00 179.25 179.79 1qi9 s PHE 297 N -3.19 2.70 -0.33 0.00 5.36 -1.22 -4.70 117.98 116.59 1qi9 s PHE 297 Ca -0.03 -0.55 -0.20 0.00 -0.96 0.00 0.00 56.93 55.19 1qi9 s PHE 297 Cb 0.10 -1.73 -0.00 0.00 -0.34 0.00 0.00 43.02 41.04 1qi9 s PHE 297 CO 0.84 -0.11 0.61 1.21 -1.46 0.00 0.00 175.22 176.31 1qi9 s ASN 298 N -0.05 6.44 0.40 6.13 3.84 -1.26 -4.46 114.94 125.98 1qi9 s ASN 298 Ca -0.04 0.25 0.07 0.00 0.21 0.00 0.00 52.86 53.35 1qi9 s ASN 298 Cb -0.14 -2.32 0.83 0.00 -0.55 0.00 0.00 41.25 39.07 1qi9 s ASN 298 CO 0.04 -0.52 2.04 -0.09 -2.79 0.00 0.00 177.10 175.78 1qi9 h ARG 299 N 8.34 0.59 0.00 0.43 2.43 -1.95 -1.57 114.38 122.63 1qi9 h ARG 299 Ca -0.27 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1qi9 h ARG 299 Cb 1.12 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1qi9 h ARG 299 CO 0.81 0.39 0.00 0.00 -1.51 0.00 0.00 179.97 179.66 1qi9 n ALA 300 N -2.47 1.92 -0.12 2.80 0.00 -1.26 -4.65 120.51 116.73 1qi9 n ALA 300 Ca 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1qi9 n ALA 300 Cb 0.08 -1.29 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1qi9 n ALA 300 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1qi9 n GLY 301 N 0.24 0.94 3.38 0.00 0.00 -0.59 -4.60 105.19 104.56 1qi9 n GLY 301 Ca 0.07 -0.01 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 1qi9 n GLY 301 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1qi9 n VAL 302 N -2.12 4.23 -4.08 1.61 0.31 -1.26 0.13 118.33 117.15 1qi9 n VAL 302 Ca 0.00 -4.61 -0.10 0.00 -0.01 0.00 0.00 64.34 59.62 1qi9 n VAL 302 Cb 0.00 -2.44 -0.09 0.00 -0.91 0.00 0.00 33.84 30.40 1qi9 n VAL 302 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1qi9 s ASN 303 N 2.67 0.18 1.25 4.52 0.01 -1.26 -4.59 114.94 117.72 1qi9 s ASN 303 Ca 0.43 -1.10 0.00 0.00 -0.71 0.00 0.00 52.86 51.49 1qi9 s ASN 303 Cb -0.00 0.37 0.00 0.00 0.41 0.00 0.00 41.25 42.03 1qi9 s ASN 303 CO 0.01 -0.82 0.00 0.61 -1.51 0.00 0.00 177.10 175.39 1qi9 n GLY 304 N -0.17 3.11 0.07 0.66 0.00 -1.26 -1.34 105.19 106.26 1qi9 n GLY 304 Ca -0.05 -0.13 0.09 0.00 0.00 0.00 0.00 46.02 45.92 1qi9 n GLY 304 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1qi9 n PRO 305 N 14.00 0.09 0.16 1.61 -0.04 -1.26 -2.80 135.00 146.76 1qi9 n PRO 305 Ca 0.00 0.37 0.12 0.00 -0.04 0.00 0.00 63.50 63.95 1qi9 n PRO 305 Cb 0.00 -1.69 0.25 0.00 -0.04 0.00 0.00 33.50 32.03 1qi9 n PRO 305 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1qi9 h PHE 306 N 0.00 0.00 -0.88 0.54 0.04 -1.53 -3.29 116.94 111.82 1qi9 h PHE 306 Ca 0.00 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.79 1qi9 h PHE 306 Cb 0.26 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.36 1qi9 h PHE 306 CO 0.00 0.00 0.58 0.82 -0.60 0.00 0.00 178.31 179.11 1qi9 h ILE 307 N 0.00 1.19 -0.15 -0.55 2.04 -1.59 -2.84 117.51 115.61 1qi9 h ILE 307 Ca 0.00 -0.40 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1qi9 h ILE 307 Cb 0.89 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.90 1qi9 h ILE 307 CO 0.00 0.21 0.00 0.47 0.00 0.00 0.00 178.15 178.83 1qi9 n ASP 308 N -4.42 1.81 -4.42 1.72 8.00 -1.24 -4.94 116.55 113.05 1qi9 n ASP 308 Ca 0.11 -1.70 -0.23 0.00 0.71 0.00 0.00 54.79 53.69 1qi9 n ASP 308 Cb 0.06 -0.09 -0.10 0.00 -0.02 0.00 0.00 41.12 40.97 1qi9 n ASP 308 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 1qi9 s ILE 309 N -1.82 1.14 -0.07 0.53 -4.36 -1.07 -5.10 121.20 110.45 1qi9 s ILE 309 Ca 0.34 -2.00 0.07 0.00 -0.26 0.00 0.00 60.65 58.80 1qi9 s ILE 309 Cb 0.19 -2.73 -0.10 0.00 1.25 0.00 0.00 42.46 41.07 1qi9 s ILE 309 CO 0.28 0.00 0.04 0.47 0.24 0.00 0.00 174.94 175.98 1qi9 n ASP 310 N -0.79 3.01 0.08 4.36 8.00 -1.26 -4.80 116.55 125.15 1qi9 n ASP 310 Ca -0.03 0.00 -0.06 0.00 0.71 0.00 0.00 54.79 55.41 1qi9 n ASP 310 Cb 0.66 0.77 -0.04 0.00 -0.02 0.00 0.00 41.12 42.50 1qi9 n ASP 310 CO 0.00 0.00 0.00 -0.09 -0.39 0.00 0.00 177.20 176.72 1qi9 h ARG 311 N 0.00 0.01 -6.51 -1.24 9.65 -1.99 -3.47 114.38 110.84 1qi9 h ARG 311 Ca -0.20 -0.02 -0.64 0.00 -1.10 0.00 0.00 59.98 58.02 1qi9 h ARG 311 Cb 1.38 0.01 -0.17 0.00 -1.39 0.00 0.00 29.97 29.80 1qi9 h ARG 311 CO 0.01 0.90 -0.80 -0.65 2.80 0.00 0.00 179.97 182.23 1qi9 s GLN 312 N -2.97 1.60 0.22 0.20 -0.21 -1.26 -5.15 119.66 112.10 1qi9 s GLN 312 Ca 0.00 -1.56 0.11 0.00 0.02 0.00 0.00 55.36 53.93 1qi9 s GLN 312 Cb 0.11 -1.86 -0.05 0.00 1.00 0.00 0.00 33.01 32.21 1qi9 s GLN 312 CO 0.81 0.39 -0.21 0.00 -2.12 0.00 0.00 175.29 174.15 1qi9 s ALA 313 N -1.87 2.50 0.57 6.09 0.00 -1.26 -4.86 121.76 122.93 1qi9 s ALA 313 Ca 0.23 -1.71 -0.04 0.00 0.00 0.00 0.00 51.96 50.45 1qi9 s ALA 313 Cb -0.07 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.80 1qi9 s ALA 313 CO 0.11 0.32 0.85 0.20 0.00 0.00 0.00 175.76 177.25 1qi9 s GLY 314 N -3.01 1.63 0.00 0.00 0.00 0.12 -5.00 107.32 101.06 1qi9 s GLY 314 Ca 0.23 -0.88 0.00 0.00 0.00 0.00 0.00 44.72 44.07 1qi9 s GLY 314 CO 0.11 -0.61 0.00 0.33 0.00 0.00 0.00 173.10 172.93 1qi9 n PHE 315 N -2.49 -1.07 -0.21 1.90 7.35 -1.26 -4.29 117.46 117.39 1qi9 n PHE 315 Ca 0.05 0.00 -0.08 0.00 -0.76 0.00 0.00 57.45 56.65 1qi9 n PHE 315 Cb 0.58 0.24 0.03 0.00 0.35 0.00 0.00 39.48 40.68 1qi9 n PHE 315 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1qi9 h VAL 316 N 0.00 1.25 -3.39 -2.13 2.07 -1.95 -2.84 116.25 109.27 1qi9 h VAL 316 Ca 0.00 -0.94 -0.65 0.00 0.82 0.00 0.00 66.70 65.93 1qi9 h VAL 316 Cb 0.00 0.70 -0.26 0.00 -1.52 0.00 0.00 31.29 30.21 1qi9 h VAL 316 CO 0.00 0.35 -0.71 0.20 0.02 0.00 0.00 177.57 177.43 1qi9 s ASN 317 N -6.32 4.41 -1.07 0.57 0.01 -1.26 -3.34 114.94 107.94 1qi9 s ASN 317 Ca -0.12 -0.32 -0.03 0.00 -0.71 0.00 0.00 52.86 51.68 1qi9 s ASN 317 Cb 0.13 -1.74 0.00 0.00 0.41 0.00 0.00 41.25 40.05 1qi9 s ASN 317 CO 0.82 0.04 0.34 0.49 -1.51 0.00 0.00 177.10 177.29 1qi9 n PHE 318 N 4.38 -1.20 -3.86 2.20 3.72 -1.26 -4.43 117.46 117.00 1qi9 n PHE 318 Ca -0.18 0.29 -0.08 0.00 -0.05 0.00 0.00 57.45 57.43 1qi9 n PHE 318 Cb 0.51 -3.29 -0.02 0.00 -0.94 0.00 0.00 39.48 35.75 1qi9 n PHE 318 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1qi9 n GLY 319 N -1.23 2.73 0.27 1.37 0.00 -1.09 -4.22 105.19 103.02 1qi9 n GLY 319 Ca -0.09 -1.54 0.10 0.00 0.00 0.00 0.00 46.02 44.49 1qi9 n GLY 319 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1qi9 h ILE 320 N 1.52 0.94 0.00 -0.61 3.07 -1.83 -2.43 117.51 118.17 1qi9 h ILE 320 Ca -0.14 0.00 -0.00 0.00 1.55 0.00 0.00 64.86 66.27 1qi9 h ILE 320 Cb 0.60 0.97 0.00 0.00 -0.27 0.00 0.00 36.82 38.13 1qi9 h ILE 320 CO 0.19 0.00 -0.00 -1.28 -1.05 0.00 0.00 178.15 176.00 1qi9 h SER 321 N 0.00 -0.00 -0.26 2.16 0.87 -1.87 0.49 113.55 114.94 1qi9 h SER 321 Ca 0.02 -0.21 0.06 0.00 -1.23 0.00 0.00 61.79 60.44 1qi9 h SER 321 Cb 0.10 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 61.99 1qi9 h SER 321 CO -0.00 0.21 -0.21 -0.74 -0.53 0.00 0.00 176.83 175.55 1qi9 h HIS 322 N -0.21 -0.56 0.82 2.24 -0.00 -1.23 0.11 115.15 116.31 1qi9 h HIS 322 Ca -0.00 0.04 -0.04 0.00 -0.00 0.00 0.00 60.37 60.37 1qi9 h HIS 322 Cb 0.21 0.29 -0.00 0.00 -0.00 0.00 0.00 27.41 27.91 1qi9 h HIS 322 CO -0.00 -0.29 -0.50 -0.92 -0.00 0.00 0.00 177.93 176.22 1qi9 h TYR 323 N -0.21 -1.32 0.00 5.26 3.20 -1.37 -2.11 116.97 120.42 1qi9 h TYR 323 Ca 0.14 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.93 1qi9 h TYR 323 Cb 0.43 0.47 -0.01 0.00 1.54 0.00 0.00 36.73 39.16 1qi9 h TYR 323 CO -0.38 -0.74 -0.33 0.74 -1.64 0.00 0.00 178.16 175.80 1qi9 h PHE 324 N -1.23 0.00 0.11 -3.82 0.04 -0.83 -2.30 116.94 108.91 1qi9 h PHE 324 Ca -0.11 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.66 1qi9 h PHE 324 Cb 0.98 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.13 1qi9 h PHE 324 CO -0.10 0.33 -0.05 -0.09 -0.60 0.00 0.00 178.31 177.80 1qi9 h ARG 325 N 0.00 -0.14 0.00 1.51 2.43 -0.68 -2.96 114.38 114.54 1qi9 h ARG 325 Ca -0.00 0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.10 1qi9 h ARG 325 Cb 0.61 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 1qi9 h ARG 325 CO 0.04 -0.09 -0.36 -0.07 -1.51 0.00 0.00 179.97 177.98 1qi9 h LEU 326 N -0.15 0.00 -1.86 3.80 3.38 -1.25 0.38 115.31 119.61 1qi9 h LEU 326 Ca -0.01 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.94 1qi9 h LEU 326 Cb 0.11 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1qi9 h LEU 326 CO 0.02 0.36 -0.08 0.40 0.09 0.00 0.00 178.44 179.23 1qi9 h ILE 327 N 0.00 1.02 0.02 1.22 2.04 -1.25 0.20 117.51 120.76 1qi9 h ILE 327 Ca -0.00 -0.29 -0.38 0.00 1.00 0.00 0.00 64.86 65.19 1qi9 h ILE 327 Cb 0.85 1.16 -0.05 0.00 -0.74 0.00 0.00 36.82 38.04 1qi9 h ILE 327 CO 0.05 0.08 -2.14 0.61 0.00 0.00 0.00 178.15 176.75 1qi9 n GLY 328 N -1.27 -0.54 0.32 5.37 0.00 -0.90 -4.59 105.19 103.58 1qi9 n GLY 328 Ca -0.03 -0.12 0.07 0.00 0.00 0.00 0.00 46.02 45.95 1qi9 n GLY 328 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qi9 h ALA 329 N -0.43 1.87 0.00 4.61 0.00 -0.57 -2.21 119.26 122.54 1qi9 h ALA 329 Ca -0.54 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1qi9 h ALA 329 Cb 1.70 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1qi9 h ALA 329 CO -0.20 0.08 0.00 0.00 0.00 0.00 0.00 179.25 179.13 1qi9 n ALA 330 N -2.50 1.74 0.32 0.00 0.00 0.03 -2.12 120.51 117.97 1qi9 n ALA 330 Ca 0.04 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.53 1qi9 n ALA 330 Cb 0.17 -1.20 0.47 0.00 0.00 0.00 0.00 19.45 18.90 1qi9 n ALA 330 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1qi9 n GLU 331 N -1.26 0.15 0.21 0.00 4.07 -0.83 -2.73 120.64 120.24 1qi9 n GLU 331 Ca 0.06 0.47 0.15 0.00 -0.06 0.00 0.00 57.16 57.78 1qi9 n GLU 331 Cb 0.09 -1.84 0.79 0.00 -0.06 0.00 0.00 31.44 30.42 1qi9 n GLU 331 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1qi9 h LEU 332 N 0.00 0.00 -1.86 4.31 5.85 -1.66 0.44 115.31 122.39 1qi9 h LEU 332 Ca 0.00 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.77 1qi9 h LEU 332 Cb 0.23 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1qi9 h LEU 332 CO 0.00 0.00 0.44 0.00 -0.34 0.00 0.00 178.44 178.54 1qi9 h ALA 333 N 1.85 1.72 0.00 1.25 0.00 -1.79 -2.01 119.26 120.28 1qi9 h ALA 333 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1qi9 h ALA 333 Cb 0.37 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 1qi9 h ALA 333 CO -0.00 -0.53 -0.03 0.37 0.00 0.00 0.00 179.25 179.05 1qi9 h GLN 334 N 0.00 0.00 -0.32 0.00 5.75 -1.18 -2.04 115.11 117.32 1qi9 h GLN 334 Ca 0.09 0.00 -0.17 0.00 -0.15 0.00 0.00 58.65 58.42 1qi9 h GLN 334 Cb 0.96 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 29.51 1qi9 h GLN 334 CO -0.00 0.03 -0.48 -0.09 -2.65 0.00 0.00 178.83 175.64 1qi9 h ARG 335 N 0.00 0.87 -0.25 1.69 2.43 -1.58 -1.23 114.38 116.30 1qi9 h ARG 335 Ca -0.00 -0.51 -0.10 0.00 -0.81 0.00 0.00 59.98 58.56 1qi9 h ARG 335 Cb 0.15 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1qi9 h ARG 335 CO 0.00 1.15 -0.25 0.77 -1.51 0.00 0.00 179.97 180.13 1qi9 h SER 336 N 0.68 0.66 -0.71 -3.80 0.02 -1.58 -2.13 113.55 106.69 1qi9 h SER 336 Ca 0.03 -0.47 0.10 0.00 -0.84 0.00 0.00 61.79 60.61 1qi9 h SER 336 Cb 1.08 -0.19 -0.07 0.00 0.14 0.00 0.00 62.40 63.35 1qi9 h SER 336 CO 0.11 1.00 0.34 -1.28 -1.14 0.00 0.00 176.83 175.86 1qi9 h SER 337 N 0.34 0.42 -0.81 3.07 0.87 -1.33 -0.34 113.55 115.76 1qi9 h SER 337 Ca 0.04 0.07 -0.03 0.00 -1.23 0.00 0.00 61.79 60.64 1qi9 h SER 337 Cb 0.81 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.73 1qi9 h SER 337 CO 0.06 0.23 0.40 -0.50 -0.53 0.00 0.00 176.83 176.50 1qi9 h TRP 338 N 0.57 1.17 -0.04 2.24 6.55 -0.89 -0.56 115.95 124.98 1qi9 h TRP 338 Ca 0.36 -0.05 -0.00 0.00 0.95 0.00 0.00 58.89 60.14 1qi9 h TRP 338 Cb 0.41 -0.37 -0.00 0.00 -0.86 0.00 0.00 29.16 28.34 1qi9 h TRP 338 CO -0.12 0.84 0.01 -0.92 -1.05 0.00 0.00 178.44 177.21 1qi9 h TYR 339 N 1.17 0.07 -0.83 0.49 3.20 -0.64 -1.84 116.97 118.58 1qi9 h TYR 339 Ca 0.28 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.14 1qi9 h TYR 339 Cb 0.10 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 1qi9 h TYR 339 CO 0.01 0.22 0.49 1.96 -1.64 0.00 0.00 178.16 179.20 1qi9 h GLN 340 N -0.11 1.13 0.61 1.82 1.08 -0.84 -0.03 115.11 118.77 1qi9 h GLN 340 Ca 0.01 -0.11 -0.03 0.00 -1.45 0.00 0.00 58.65 57.08 1qi9 h GLN 340 Cb 0.19 -0.23 0.01 0.00 -0.05 0.00 0.00 27.48 27.39 1qi9 h GLN 340 CO -0.00 0.80 -0.29 0.87 -0.95 0.00 0.00 178.83 179.26 1qi9 h LYS 341 N 1.15 -0.79 0.00 1.46 1.57 -0.91 -0.83 116.57 118.21 1qi9 h LYS 341 Ca 0.30 0.05 -0.20 0.00 -1.87 0.00 0.00 60.65 58.93 1qi9 h LYS 341 Cb -0.03 0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 1qi9 h LYS 341 CO -0.05 -0.49 -1.23 0.91 -0.57 0.00 0.00 179.45 178.02 1qi9 n TRP 342 N -5.39 0.84 0.11 -1.35 7.02 -0.71 -0.88 117.44 117.07 1qi9 n TRP 342 Ca -0.12 0.36 -0.02 0.00 -1.02 0.00 0.00 57.50 56.70 1qi9 n TRP 342 Cb 0.35 -0.99 0.04 0.00 -2.42 0.00 0.00 31.31 28.29 1qi9 n TRP 342 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 1qi9 h GLN 343 N -1.00 0.00 0.00 -0.99 7.50 -1.19 -3.40 115.11 116.03 1qi9 h GLN 343 Ca -0.30 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.85 1qi9 h GLN 343 Cb 1.14 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.67 1qi9 h GLN 343 CO -0.18 0.73 -0.63 0.28 -1.50 0.00 0.00 178.83 177.53 1qi9 n VAL 344 N -3.44 1.15 -0.11 -0.54 0.31 -0.79 -4.94 118.33 109.97 1qi9 n VAL 344 Ca 0.00 0.24 -0.14 0.00 -0.01 0.00 0.00 64.34 64.43 1qi9 n VAL 344 Cb 0.77 -2.03 -0.14 0.00 -0.91 0.00 0.00 33.84 31.53 1qi9 n VAL 344 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1qi9 n HIS 345 N -3.89 0.08 -3.99 3.52 8.25 -0.32 -4.71 115.22 114.15 1qi9 n HIS 345 Ca -0.09 0.02 -0.27 0.00 -0.26 0.00 0.00 57.72 57.12 1qi9 n HIS 345 Cb 0.33 -1.01 -0.02 0.00 1.12 0.00 0.00 29.99 30.41 1qi9 n HIS 345 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1qi9 n ARG 346 N -3.01 -3.50 -3.12 -0.41 1.74 -0.06 -4.90 116.66 103.40 1qi9 n ARG 346 Ca -0.38 0.42 -0.36 0.00 -0.77 0.00 0.00 57.85 56.76 1qi9 n ARG 346 Cb 1.08 -4.72 -0.06 0.00 -1.02 0.00 0.00 32.46 27.74 1qi9 n ARG 346 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 1qi9 s PHE 347 N -3.79 3.64 0.49 -1.55 5.36 -1.26 -1.38 117.98 119.49 1qi9 s PHE 347 Ca 0.17 1.37 -0.23 0.00 -0.96 0.00 0.00 56.93 57.28 1qi9 s PHE 347 Cb -0.09 -2.60 -0.07 0.00 -0.34 0.00 0.00 43.02 39.92 1qi9 s PHE 347 CO 0.89 0.34 1.27 0.00 -1.46 0.00 0.00 175.22 176.25 1qi9 s ALA 348 N -1.53 2.95 0.68 11.12 0.00 -1.12 -1.19 121.76 132.66 1qi9 s ALA 348 Ca 0.43 1.14 -0.11 0.00 0.00 0.00 0.00 51.96 53.42 1qi9 s ALA 348 Cb -0.16 -3.47 -0.00 0.00 0.00 0.00 0.00 23.12 19.48 1qi9 s ALA 348 CO 0.21 -0.98 1.06 1.03 0.00 0.00 0.00 175.76 177.08 1qi9 s ARG 349 N -2.72 3.10 0.29 0.00 1.81 -1.26 -4.65 118.95 115.52 1qi9 s ARG 349 Ca 0.66 0.70 -0.01 0.00 -1.72 0.00 0.00 55.73 55.36 1qi9 s ARG 349 Cb -0.35 -2.03 0.48 0.00 -0.45 0.00 0.00 34.95 32.60 1qi9 s ARG 349 CO 0.42 -0.92 1.92 -1.35 -0.68 0.00 0.00 175.30 174.69 1qi9 h PRO 350 N -0.57 1.06 0.00 3.54 0.11 -1.81 0.40 132.00 134.72 1qi9 h PRO 350 Ca -0.45 -0.06 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 1qi9 h PRO 350 Cb 1.22 -0.24 -0.01 0.00 0.11 0.00 0.00 31.00 32.09 1qi9 h PRO 350 CO 0.61 0.70 -0.18 1.05 -0.21 0.00 0.00 178.00 179.97 1qi9 h GLU 351 N 1.09 0.00 0.03 1.05 4.11 -1.92 0.11 114.58 119.05 1qi9 h GLU 351 Ca 0.38 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.65 1qi9 h GLU 351 Cb 0.11 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.37 1qi9 h GLU 351 CO -0.13 0.18 -0.65 0.00 0.07 0.00 0.00 179.01 178.48 1qi9 h ALA 352 N 1.82 0.04 0.00 1.06 0.00 -0.58 -2.55 119.26 119.04 1qi9 h ALA 352 Ca -0.00 -0.60 -0.05 0.00 0.00 0.00 0.00 54.91 54.26 1qi9 h ALA 352 Cb 0.32 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1qi9 h ALA 352 CO 0.02 0.36 -0.25 -0.07 0.00 0.00 0.00 179.25 179.31 1qi9 h LEU 353 N -0.15 0.00 -0.80 0.00 3.38 -1.19 -1.82 115.31 114.73 1qi9 h LEU 353 Ca -0.09 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1qi9 h LEU 353 Cb 1.38 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.10 1qi9 h LEU 353 CO 0.13 0.25 0.28 1.23 0.09 0.00 0.00 178.44 180.42 1qi9 h GLY 354 N 0.89 1.26 1.17 0.83 0.00 -0.74 0.17 103.07 106.65 1qi9 h GLY 354 Ca -0.00 -0.71 -0.15 0.00 0.00 0.00 0.00 47.33 46.47 1qi9 h GLY 354 CO 0.03 0.67 -0.34 -1.33 0.00 0.00 0.00 176.54 175.56 1qi9 h GLY 355 N 1.15 0.99 1.01 4.60 0.00 -0.91 -0.39 103.07 109.52 1qi9 h GLY 355 Ca 0.26 -0.98 -0.04 0.00 0.00 0.00 0.00 47.33 46.57 1qi9 h GLY 355 CO -0.02 0.88 0.23 -0.84 0.00 0.00 0.00 176.54 176.80 1qi9 h THR 356 N 0.76 1.24 0.33 4.70 2.02 -1.19 -0.79 112.91 119.97 1qi9 h THR 356 Ca 0.07 -0.76 -0.02 0.00 0.77 0.00 0.00 66.41 66.47 1qi9 h THR 356 Cb 0.93 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 67.90 1qi9 h THR 356 CO 0.09 0.30 -0.16 0.25 0.37 0.00 0.00 175.52 176.37 1qi9 h LEU 357 N 0.88 -0.37 -0.41 2.58 6.46 -0.55 -0.94 115.31 122.96 1qi9 h LEU 357 Ca 0.21 -0.01 0.08 0.00 -0.12 0.00 0.00 57.88 58.04 1qi9 h LEU 357 Cb 0.23 0.10 -0.07 0.00 -0.73 0.00 0.00 40.66 40.18 1qi9 h LEU 357 CO -0.01 -0.24 -0.05 -0.74 -0.62 0.00 0.00 178.44 176.78 1qi9 h HIS 358 N -0.48 -0.12 -0.01 1.25 2.76 -0.76 -0.49 115.15 117.30 1qi9 h HIS 358 Ca -0.05 0.03 -0.10 0.00 -2.20 0.00 0.00 60.37 58.06 1qi9 h HIS 358 Cb 0.36 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.42 1qi9 h HIS 358 CO -0.04 -0.13 -0.45 -0.07 -1.30 0.00 0.00 177.93 175.93 1qi9 h LEU 359 N 0.05 0.03 -0.20 0.26 3.38 -1.03 -1.81 115.31 116.00 1qi9 h LEU 359 Ca 0.20 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 58.06 1qi9 h LEU 359 Cb 0.30 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1qi9 h LEU 359 CO -0.38 0.48 -0.24 0.74 0.09 0.00 0.00 178.44 179.14 1qi9 h THR 360 N 0.03 1.33 -0.64 0.22 2.02 -0.60 0.11 112.91 115.38 1qi9 h THR 360 Ca -0.00 -1.42 -0.03 0.00 0.77 0.00 0.00 66.41 65.73 1qi9 h THR 360 Cb 0.81 1.80 -0.03 0.00 -1.74 0.00 0.00 68.15 68.99 1qi9 h THR 360 CO 0.06 0.43 0.29 0.40 0.37 0.00 0.00 175.52 177.07 1qi9 h ILE 361 N 0.18 1.22 0.00 3.11 2.04 -1.00 -1.57 117.51 121.49 1qi9 h ILE 361 Ca 0.03 -0.63 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1qi9 h ILE 361 Cb 0.80 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1qi9 h ILE 361 CO 0.06 0.26 0.00 0.29 0.00 0.00 0.00 178.15 178.76 1qi9 n LYS 362 N -4.33 0.93 -1.01 2.37 5.02 -0.69 -4.89 118.16 115.57 1qi9 n LYS 362 Ca 0.06 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.35 1qi9 n LYS 362 Cb 0.15 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.66 1qi9 n LYS 362 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1qi9 n GLY 363 N 0.93 0.42 0.10 0.72 0.00 -0.59 -4.89 105.19 101.87 1qi9 n GLY 363 Ca 0.23 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.32 1qi9 n GLY 363 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1qi9 h GLU 364 N 0.78 0.00 -4.93 1.61 5.08 -1.04 -3.47 114.58 112.60 1qi9 h GLU 364 Ca -0.00 0.00 -0.44 0.00 -1.00 0.00 0.00 59.36 57.92 1qi9 h GLU 364 Cb 0.19 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 29.30 1qi9 h GLU 364 CO 0.01 0.00 -0.56 -0.51 -1.00 0.00 0.00 179.01 176.95 1qi9 s LEU 365 N -4.89 1.76 -0.31 1.33 1.43 -0.71 -4.94 118.68 112.35 1qi9 s LEU 365 Ca 0.03 -1.55 0.19 0.00 -1.03 0.00 0.00 54.13 51.77 1qi9 s LEU 365 Cb 0.11 0.10 0.47 0.00 0.03 0.00 0.00 46.19 46.90 1qi9 s LEU 365 CO 0.75 -0.86 0.99 -3.20 0.23 0.00 0.00 176.35 174.26 1qi9 n ASN 366 N -0.93 1.60 -4.77 2.29 2.85 -1.26 -4.03 115.26 111.00 1qi9 n ASN 366 Ca -0.00 -2.59 -0.40 0.00 -0.11 0.00 0.00 54.58 51.48 1qi9 n ASN 366 Cb 0.65 -0.51 -0.02 0.00 1.24 0.00 0.00 39.78 41.14 1qi9 n ASN 366 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1qi9 s ALA 367 N -3.30 3.38 0.00 5.20 0.00 -1.26 -4.90 121.76 120.88 1qi9 s ALA 367 Ca 0.28 1.17 -0.04 0.00 0.00 0.00 0.00 51.96 53.37 1qi9 s ALA 367 Cb 0.43 -3.45 -0.16 0.00 0.00 0.00 0.00 23.12 19.94 1qi9 s ALA 367 CO 0.01 -0.61 2.87 -3.47 0.00 0.00 0.00 175.76 174.57 1qi9 n ASP 368 N 0.59 4.95 -4.77 0.00 2.03 -1.26 -4.95 116.55 113.13 1qi9 n ASP 368 Ca 0.01 -2.38 -0.40 0.00 0.52 0.00 0.00 54.79 52.54 1qi9 n ASP 368 Cb 0.43 -1.23 0.00 0.00 -0.72 0.00 0.00 41.12 39.60 1qi9 n ASP 368 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1qi9 s PHE 369 N 0.77 2.57 0.55 -0.67 0.08 -1.26 -4.05 117.98 115.96 1qi9 s PHE 369 Ca 0.40 1.23 -0.20 0.00 0.12 0.00 0.00 56.93 58.48 1qi9 s PHE 369 Cb 0.19 -3.94 -0.06 0.00 -0.57 0.00 0.00 43.02 38.64 1qi9 s PHE 369 CO 0.00 -2.86 1.03 -3.47 -0.10 0.00 0.00 175.22 169.83 1qi9 n ASP 370 N 0.19 1.18 0.29 1.36 2.03 -1.21 -4.69 116.55 115.69 1qi9 n ASP 370 Ca 0.03 0.89 0.16 0.00 0.52 0.00 0.00 54.79 56.39 1qi9 n ASP 370 Cb 0.41 -1.41 0.85 0.00 -0.72 0.00 0.00 41.12 40.25 1qi9 n ASP 370 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1qi9 h LEU 371 N 0.91 0.00 -2.02 -2.67 4.07 -1.91 -2.22 115.31 111.47 1qi9 h LEU 371 Ca -0.48 0.00 0.12 0.00 0.08 0.00 0.00 57.88 57.60 1qi9 h LEU 371 Cb 1.35 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 43.07 1qi9 h LEU 371 CO 0.53 0.06 0.32 0.77 -1.08 0.00 0.00 178.44 179.04 1qi9 h SER 372 N 0.00 0.00 0.00 -0.43 4.64 -1.91 0.56 113.55 116.40 1qi9 h SER 372 Ca -0.00 0.00 -0.37 0.00 -0.47 0.00 0.00 61.79 60.95 1qi9 h SER 372 Cb 0.25 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.29 1qi9 h SER 372 CO 0.01 0.00 -2.12 -0.11 -0.87 0.00 0.00 176.83 173.74 1qi9 n LEU 373 N -4.31 1.93 0.12 5.97 7.94 -0.88 -3.67 117.00 124.10 1qi9 n LEU 373 Ca 0.07 0.36 0.05 0.00 -1.11 0.00 0.00 56.01 55.39 1qi9 n LEU 373 Cb 0.51 -0.85 0.50 0.00 0.53 0.00 0.00 43.42 44.12 1qi9 n LEU 373 CO 0.35 0.43 1.08 0.25 -1.11 0.00 0.00 177.39 178.38 1qi9 h LEU 374 N -1.00 0.25 -3.47 -1.96 5.85 -1.38 -2.31 115.31 111.29 1qi9 h LEU 374 Ca -0.56 -0.01 -0.24 0.00 0.84 0.00 0.00 57.88 57.91 1qi9 h LEU 374 Cb 1.48 -0.06 -0.14 0.00 0.37 0.00 0.00 40.66 42.31 1qi9 h LEU 374 CO -0.34 0.22 0.05 -0.62 -0.34 0.00 0.00 178.44 177.41 1qi9 n GLU 375 N -4.46 1.96 -2.72 1.25 1.02 0.18 -4.91 120.64 112.95 1qi9 n GLU 375 Ca 0.00 -3.15 -0.42 0.00 -0.02 0.00 0.00 57.16 53.57 1qi9 n GLU 375 Cb 0.11 -1.89 -0.03 0.00 -0.02 0.00 0.00 31.44 29.61 1qi9 n GLU 375 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1qi9 s ASN 376 N -2.29 6.48 0.22 1.62 3.84 -0.87 -4.89 114.94 119.04 1qi9 s ASN 376 Ca 0.47 -1.52 -0.09 0.00 0.21 0.00 0.00 52.86 51.94 1qi9 s ASN 376 Cb 0.42 -2.49 0.18 0.00 -0.55 0.00 0.00 41.25 38.80 1qi9 s ASN 376 CO 0.02 -1.38 1.85 0.00 -2.79 0.00 0.00 177.10 174.80 1qi9 h ALA 377 N 9.45 1.05 -0.24 1.71 0.00 -1.91 -1.01 119.26 128.32 1qi9 h ALA 377 Ca 0.09 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1qi9 h ALA 377 Cb 1.03 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1qi9 h ALA 377 CO 1.27 0.54 0.11 1.49 0.00 0.00 0.00 179.25 182.66 1qi9 h GLU 378 N 1.14 0.34 -0.15 0.00 4.57 -2.00 -2.21 114.58 116.27 1qi9 h GLU 378 Ca 0.29 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.38 1qi9 h GLU 378 Cb 0.00 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.53 1qi9 h GLU 378 CO -0.05 0.36 -0.06 1.25 -1.18 0.00 0.00 179.01 179.33 1qi9 h LEU 379 N 0.24 0.31 -0.66 1.64 5.85 -1.94 -3.11 115.31 117.64 1qi9 h LEU 379 Ca 0.08 -0.39 -0.03 0.00 0.84 0.00 0.00 57.88 58.38 1qi9 h LEU 379 Cb 0.14 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1qi9 h LEU 379 CO -0.01 0.63 0.31 -0.07 -0.34 0.00 0.00 178.44 178.97 1qi9 h LEU 380 N -0.02 0.87 -0.82 2.25 3.38 -1.18 -1.41 115.31 118.39 1qi9 h LEU 380 Ca 0.04 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1qi9 h LEU 380 Cb 0.51 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1qi9 h LEU 380 CO 0.02 0.76 0.31 0.07 0.09 0.00 0.00 178.44 179.69 1qi9 h LYS 381 N 0.91 1.19 -0.29 1.13 2.10 -1.46 -1.96 116.57 118.19 1qi9 h LYS 381 Ca 0.23 -0.22 -0.14 0.00 -2.00 0.00 0.00 60.65 58.51 1qi9 h LYS 381 Cb 0.13 -0.19 -0.01 0.00 -0.90 0.00 0.00 32.23 31.26 1qi9 h LYS 381 CO -0.03 0.96 -0.41 0.00 -2.00 0.00 0.00 179.45 177.98 1qi9 h ARG 382 N 1.15 0.70 -0.18 0.07 3.08 -1.39 -2.08 114.38 115.74 1qi9 h ARG 382 Ca 0.26 -0.37 -0.04 0.00 0.07 0.00 0.00 59.98 59.91 1qi9 h ARG 382 Cb 0.22 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 1qi9 h ARG 382 CO -0.02 0.98 -0.03 0.28 -1.07 0.00 0.00 179.97 180.11 1qi9 h VAL 383 N 0.57 1.28 -0.59 2.04 2.07 -1.15 -1.01 116.25 119.46 1qi9 h VAL 383 Ca 0.05 -0.98 0.08 0.00 0.82 0.00 0.00 66.70 66.66 1qi9 h VAL 383 Cb 0.95 1.55 -0.06 0.00 -1.52 0.00 0.00 31.29 32.21 1qi9 h VAL 383 CO 0.09 0.29 0.26 0.00 0.02 0.00 0.00 177.57 178.23 1qi9 h ALA 384 N 0.74 0.77 -0.22 1.67 0.00 -1.32 -1.63 119.26 119.28 1qi9 h ALA 384 Ca 0.05 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 1qi9 h ALA 384 Cb 0.46 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1qi9 h ALA 384 CO 0.02 -0.13 -0.37 0.00 0.00 0.00 0.00 179.25 178.77 1qi9 h ALA 385 N 1.37 0.34 -0.75 0.00 0.00 -1.11 -1.58 119.26 117.52 1qi9 h ALA 385 Ca 0.28 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1qi9 h ALA 385 Cb 0.29 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1qi9 h ALA 385 CO -0.25 0.41 0.28 0.97 0.00 0.00 0.00 179.25 180.67 1qi9 h ILE 386 N 0.32 1.26 -0.11 0.00 2.10 -1.05 -1.28 117.51 118.75 1qi9 h ILE 386 Ca 0.01 -0.84 -0.12 0.00 1.08 0.00 0.00 64.86 65.00 1qi9 h ILE 386 Cb 0.97 0.39 -0.01 0.00 -1.09 0.00 0.00 36.82 37.08 1qi9 h ILE 386 CO 0.08 0.34 -0.46 0.78 -1.08 0.00 0.00 178.15 177.81 1qi9 h ASN 387 N 1.09 0.30 -0.08 2.19 2.35 -1.30 -1.98 115.58 118.15 1qi9 h ASN 387 Ca 0.25 -0.14 -0.14 0.00 -0.55 0.00 0.00 56.30 55.72 1qi9 h ASN 387 Cb 0.24 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 1qi9 h ASN 387 CO -0.02 0.72 -0.42 0.00 -1.65 0.00 0.00 177.43 176.07 1qi9 h ALA 388 N 1.29 0.80 -0.12 -0.83 0.00 -1.13 0.93 119.26 120.19 1qi9 h ALA 388 Ca 0.01 -0.45 -0.11 0.00 0.00 0.00 0.00 54.91 54.37 1qi9 h ALA 388 Cb 0.90 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.57 1qi9 h ALA 388 CO 0.07 0.65 -0.40 0.00 0.00 0.00 0.00 179.25 179.58 1qi9 h ALA 389 N 1.04 1.09 0.01 0.00 0.00 -0.80 -3.23 119.26 117.36 1qi9 h ALA 389 Ca 0.04 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.38 1qi9 h ALA 389 Cb 0.94 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.65 1qi9 h ALA 389 CO 0.08 0.59 -0.63 0.37 0.00 0.00 0.00 179.25 179.66 1qi9 h GLN 390 N 0.23 0.42 -6.92 0.00 5.75 -0.90 -3.46 115.11 110.23 1qi9 h GLN 390 Ca 0.02 -0.46 -0.53 0.00 -0.15 0.00 0.00 58.65 57.54 1qi9 h GLN 390 Cb 0.81 0.13 0.08 0.00 1.07 0.00 0.00 27.48 29.58 1qi9 h GLN 390 CO 0.06 1.12 0.68 -0.80 -2.65 0.00 0.00 178.83 177.24 1qi9 s ASN 391 N -6.78 6.51 0.18 -0.69 0.01 0.28 -4.95 114.94 109.49 1qi9 s ASN 391 Ca -0.13 2.80 -0.23 0.00 -0.71 0.00 0.00 52.86 54.59 1qi9 s ASN 391 Cb 0.03 -2.65 0.08 0.00 0.41 0.00 0.00 41.25 39.12 1qi9 s ASN 391 CO 0.83 -0.73 1.57 1.55 -1.51 0.00 0.00 177.10 178.81 1qi9 h PRO 392 N 3.07 -0.19 -0.79 -0.60 0.13 -1.89 -1.29 132.00 130.45 1qi9 h PRO 392 Ca -0.50 0.01 -0.27 0.00 -0.87 0.00 0.00 66.00 64.37 1qi9 h PRO 392 Cb 1.24 0.04 -0.16 0.00 0.13 0.00 0.00 31.00 32.25 1qi9 h PRO 392 CO 0.64 -0.13 0.34 0.09 -0.23 0.00 0.00 178.00 178.72 1qi9 n ASN 393 N -5.42 4.61 -1.74 1.44 3.02 -1.26 -4.91 115.26 111.00 1qi9 n ASN 393 Ca 0.03 -3.31 -0.20 0.00 -0.03 0.00 0.00 54.58 51.06 1qi9 n ASN 393 Cb 0.35 -0.76 -0.07 0.00 -0.61 0.00 0.00 39.78 38.69 1qi9 n ASN 393 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1qi9 n ASN 394 N -0.36 -5.53 -4.75 6.41 5.03 -0.49 -4.95 115.26 110.63 1qi9 n ASN 394 Ca 0.45 0.38 -0.41 0.00 0.87 0.00 0.00 54.58 55.86 1qi9 n ASN 394 Cb 1.44 -4.76 -0.02 0.00 -1.02 0.00 0.00 39.78 35.42 1qi9 n ASN 394 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1qi9 s GLU 395 N -4.03 4.31 0.17 3.52 2.12 -1.26 -4.67 118.70 118.85 1qi9 s GLU 395 Ca 0.00 2.23 -0.30 0.00 0.36 0.00 0.00 54.97 57.26 1qi9 s GLU 395 Cb 0.00 -3.13 -0.07 0.00 0.26 0.00 0.00 34.13 31.19 1qi9 s GLU 395 CO 0.00 -0.36 0.97 0.08 -0.54 0.00 0.00 175.26 175.41 1qi9 s VAL 396 N -0.08 4.27 0.06 3.70 1.01 -1.26 -3.99 120.40 124.11 1qi9 s VAL 396 Ca 0.58 2.02 -0.01 0.00 0.00 0.00 0.00 61.98 64.57 1qi9 s VAL 396 Cb -0.40 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.65 1qi9 s VAL 396 CO 0.43 0.38 -0.02 0.42 0.00 0.00 0.00 175.10 176.31 1qi9 s THR 397 N -0.46 0.21 -0.73 3.92 -4.23 -1.26 -5.01 115.64 108.08 1qi9 s THR 397 Ca 0.45 -1.79 0.12 0.00 -1.18 0.00 0.00 61.69 59.30 1qi9 s THR 397 Cb -0.25 -1.54 0.38 0.00 1.34 0.00 0.00 72.50 72.42 1qi9 s THR 397 CO 0.31 -0.96 1.31 -1.22 -0.54 0.00 0.00 174.62 173.52 1qi9 n TYR 398 N 0.09 0.61 -1.72 3.99 4.01 -1.26 -4.19 117.16 118.69 1qi9 n TYR 398 Ca -0.14 -0.60 -0.38 0.00 -0.16 0.00 0.00 57.90 56.62 1qi9 n TYR 398 Cb 0.61 -0.11 0.05 0.00 -0.31 0.00 0.00 39.34 39.59 1qi9 n TYR 398 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1qi9 n LEU 399 N 0.26 5.45 -4.63 7.72 4.77 -1.26 -4.59 117.00 124.71 1qi9 n LEU 399 Ca 0.14 0.90 -0.43 0.00 -0.03 0.00 0.00 56.01 56.60 1qi9 n LEU 399 Cb 0.56 -1.54 -0.02 0.00 -2.33 0.00 0.00 43.42 40.09 1qi9 n LEU 399 CO 0.10 -0.90 1.20 -0.22 -1.33 0.00 0.00 177.39 176.24 1qi9 s LEU 400 N -3.54 3.84 0.17 2.23 2.96 -1.26 -4.95 118.68 118.13 1qi9 s LEU 400 Ca 0.76 1.24 -0.32 0.00 -0.22 0.00 0.00 54.13 55.60 1qi9 s LEU 400 Cb -0.41 -3.54 -0.11 0.00 0.50 0.00 0.00 46.19 42.64 1qi9 s LEU 400 CO 0.46 -1.17 1.69 -2.84 -1.32 0.00 0.00 176.35 173.17 1qi9 s PRO 401 N 4.39 4.16 0.04 0.98 0.02 -1.26 -4.85 135.00 138.47 1qi9 s PRO 401 Ca 0.60 2.52 -0.02 0.00 0.02 0.00 0.00 61.00 64.12 1qi9 s PRO 401 Cb -0.18 -3.21 -0.04 0.00 0.02 0.00 0.00 34.50 31.09 1qi9 s PRO 401 CO 0.26 -0.73 0.23 -0.65 -0.33 0.00 0.00 177.00 175.78 1qi9 s GLN 402 N 1.50 3.48 0.00 5.54 -1.52 -0.75 -4.73 119.66 123.18 1qi9 s GLN 402 Ca 0.74 -0.32 0.29 0.00 -1.95 0.00 0.00 55.36 54.13 1qi9 s GLN 402 Cb -0.47 -3.04 1.25 0.00 -0.22 0.00 0.00 33.01 30.53 1qi9 s GLN 402 CO 0.32 0.62 1.87 0.00 -0.25 0.00 0.00 175.29 177.86 1qi9 n ALA 403 N 0.59 2.74 -2.75 6.09 0.00 -0.51 -0.69 120.51 125.97 1qi9 n ALA 403 Ca -0.07 -0.25 -0.16 0.00 0.00 0.00 0.00 53.44 52.95 1qi9 n ALA 403 Cb 0.52 -1.35 -0.14 0.00 0.00 0.00 0.00 19.45 18.48 1qi9 n ALA 403 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1qi9 s ILE 404 N -2.50 0.47 0.45 0.00 -4.36 -1.26 -4.87 121.20 109.13 1qi9 s ILE 404 Ca 0.28 -0.32 0.14 0.00 -0.26 0.00 0.00 60.65 60.49 1qi9 s ILE 404 Cb 0.20 -0.41 0.31 0.00 1.25 0.00 0.00 42.46 43.82 1qi9 s ILE 404 CO 0.48 0.09 2.02 1.56 0.24 0.00 0.00 174.94 179.33 1qi9 h GLN 405 N 5.88 0.34 -0.00 0.37 1.08 -1.86 -2.70 115.11 118.21 1qi9 h GLN 405 Ca -0.29 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.89 1qi9 h GLN 405 Cb 1.19 -0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.54 1qi9 h GLN 405 CO 0.49 0.23 -0.38 -0.85 -0.95 0.00 0.00 178.83 177.37 1qi9 n GLU 406 N -4.47 0.03 0.00 1.46 0.28 -1.26 -4.52 120.64 112.15 1qi9 n GLU 406 Ca 0.07 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.05 1qi9 n GLU 406 Cb 0.29 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.66 1qi9 n GLU 406 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1qi9 n GLY 407 N 1.49 0.43 3.74 -1.84 0.00 -1.02 -4.83 105.19 103.16 1qi9 n GLY 407 Ca 0.06 -0.84 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 1qi9 n GLY 407 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qi9 s SER 408 N -4.00 4.25 1.06 1.61 1.04 -1.26 -4.97 113.70 111.43 1qi9 s SER 408 Ca 0.00 2.04 -0.14 0.00 0.48 0.00 0.00 55.95 58.33 1qi9 s SER 408 Cb 0.00 -2.55 0.15 0.00 0.10 0.00 0.00 66.02 63.72 1qi9 s SER 408 CO 0.00 -2.21 0.61 -2.65 0.98 0.00 0.00 173.24 169.96 1qi9 n PRO 409 N -3.26 -1.33 -2.39 4.02 -0.02 -1.26 -4.87 135.00 125.89 1qi9 n PRO 409 Ca 0.11 -0.35 -0.42 0.00 -2.02 0.00 0.00 63.50 60.81 1qi9 n PRO 409 Cb 0.52 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 32.00 1qi9 n PRO 409 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1qi9 n THR 410 N -4.36 4.67 -3.51 3.45 -1.04 -1.26 -4.86 114.28 107.36 1qi9 n THR 410 Ca 0.05 -4.66 -0.17 0.00 -2.04 0.00 0.00 64.05 57.22 1qi9 n THR 410 Cb 0.56 -2.25 -0.06 0.00 -1.82 0.00 0.00 70.33 66.76 1qi9 n THR 410 CO 0.00 0.00 0.00 -1.38 -0.64 0.00 0.00 175.07 173.05 1qi9 s HIS 411 N -0.45 -0.64 0.97 -1.42 -3.43 -1.26 -1.65 115.29 107.40 1qi9 s HIS 411 Ca 0.40 1.05 -0.13 0.00 -0.80 0.00 0.00 55.06 55.58 1qi9 s HIS 411 Cb 0.10 0.42 0.05 0.00 -1.43 0.00 0.00 32.58 31.73 1qi9 s HIS 411 CO 0.00 -0.62 0.41 -2.30 -2.00 0.00 0.00 174.74 170.24 1qi9 n PRO 412 N 0.80 -0.43 -0.08 -0.38 -0.02 -1.26 -4.97 135.00 128.66 1qi9 n PRO 412 Ca -0.19 -0.08 -0.14 0.00 -2.02 0.00 0.00 63.50 61.07 1qi9 n PRO 412 Cb 0.58 -1.87 -0.05 0.00 -0.02 0.00 0.00 33.50 32.13 1qi9 n PRO 412 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1qi9 h SER 413 N -1.63 0.74 -3.38 2.55 0.87 -1.42 -3.46 113.55 107.83 1qi9 h SER 413 Ca -0.44 -0.51 -0.65 0.00 -1.23 0.00 0.00 61.79 58.95 1qi9 h SER 413 Cb 1.29 -0.21 -0.25 0.00 -0.44 0.00 0.00 62.40 62.79 1qi9 h SER 413 CO 0.35 1.11 -0.70 -0.47 -0.53 0.00 0.00 176.83 176.59 1qi9 s TYR 414 N -4.19 2.97 0.56 2.24 5.04 -1.26 -3.57 117.35 119.13 1qi9 s TYR 414 Ca -0.12 -0.60 -0.04 0.00 -2.44 0.00 0.00 57.07 53.86 1qi9 s TYR 414 Cb 0.08 -2.02 0.12 0.00 0.35 0.00 0.00 41.96 40.49 1qi9 s TYR 414 CO 0.83 -0.29 0.77 -0.35 -1.34 0.00 0.00 175.55 175.18 1qi9 n PRO 415 N 4.14 -0.27 -2.68 4.97 -0.04 -1.26 -3.14 135.00 136.72 1qi9 n PRO 415 Ca -0.18 -1.68 -0.41 0.00 -0.04 0.00 0.00 63.50 61.19 1qi9 n PRO 415 Cb 0.52 -0.64 -0.04 0.00 -0.04 0.00 0.00 33.50 33.30 1qi9 n PRO 415 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1qi9 s SER 416 N -3.98 7.41 0.14 3.54 0.15 -0.71 -4.90 113.70 115.36 1qi9 s SER 416 Ca 0.48 1.80 -0.03 0.00 0.70 0.00 0.00 55.95 58.90 1qi9 s SER 416 Cb -0.02 -2.58 -0.05 0.00 -1.71 0.00 0.00 66.02 61.65 1qi9 s SER 416 CO 0.32 -0.16 1.34 1.23 1.20 0.00 0.00 173.24 177.18 1qi9 h GLY 417 N 5.93 0.45 1.00 9.45 0.00 -1.90 -1.39 103.07 116.61 1qi9 h GLY 417 Ca -0.42 -0.74 0.01 0.00 0.00 0.00 0.00 47.33 46.17 1qi9 h GLY 417 CO 0.73 0.66 0.36 0.45 0.00 0.00 0.00 176.54 178.74 1qi9 h HIS 418 N 0.24 0.68 -0.46 5.60 3.86 -1.96 -1.52 115.15 121.59 1qi9 h HIS 418 Ca -0.06 0.02 -0.08 0.00 -1.16 0.00 0.00 60.37 59.08 1qi9 h HIS 418 Cb 1.49 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 29.72 1qi9 h HIS 418 CO 0.05 0.43 -0.02 0.00 0.86 0.00 0.00 177.93 179.25 1qi9 h ALA 419 N 1.20 0.63 -0.62 2.45 0.00 -1.86 -2.27 119.26 118.79 1qi9 h ALA 419 Ca 0.20 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1qi9 h ALA 419 Cb -0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1qi9 h ALA 419 CO -0.04 0.45 0.33 1.15 0.00 0.00 0.00 179.25 181.14 1qi9 h THR 420 N 0.69 1.20 -0.34 0.00 2.02 -1.02 -0.92 112.91 114.54 1qi9 h THR 420 Ca 0.13 -0.53 -0.13 0.00 0.77 0.00 0.00 66.41 66.65 1qi9 h THR 420 Cb 0.54 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1qi9 h THR 420 CO 0.03 0.23 -0.30 0.06 0.37 0.00 0.00 175.52 175.90 1qi9 h GLN 421 N 0.85 0.73 0.00 6.66 3.07 -1.22 -2.12 115.11 123.07 1qi9 h GLN 421 Ca 0.22 -0.33 -0.06 0.00 0.09 0.00 0.00 58.65 58.57 1qi9 h GLN 421 Cb 0.06 -0.02 -0.01 0.00 0.08 0.00 0.00 27.48 27.60 1qi9 h GLN 421 CO -0.03 0.94 -0.28 -0.91 0.09 0.00 0.00 178.83 178.63 1qi9 h ASN 422 N 0.62 0.00 -0.22 0.06 2.35 -1.39 0.14 115.58 117.14 1qi9 h ASN 422 Ca 0.07 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.71 1qi9 h ASN 422 Cb 0.82 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.19 1qi9 h ASN 422 CO 0.07 0.28 -0.29 1.23 -1.65 0.00 0.00 177.43 177.07 1qi9 h GLY 423 N 2.38 0.63 1.00 2.83 0.00 -0.84 -1.36 103.07 107.70 1qi9 h GLY 423 Ca -0.00 -0.68 -0.00 0.00 0.00 0.00 0.00 47.33 46.64 1qi9 h GLY 423 CO 0.04 0.61 -0.03 0.00 0.00 0.00 0.00 176.54 177.16 1qi9 h ALA 424 N 0.64 -0.09 -0.27 3.60 0.00 -0.89 -2.13 119.26 120.11 1qi9 h ALA 424 Ca 0.03 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1qi9 h ALA 424 Cb 0.86 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1qi9 h ALA 424 CO 0.07 -0.55 -0.07 0.74 0.00 0.00 0.00 179.25 179.44 1qi9 h PHE 425 N -0.09 0.46 -0.55 0.00 0.04 -0.60 -1.65 116.94 114.55 1qi9 h PHE 425 Ca -0.01 -0.05 -0.04 0.00 2.80 0.00 0.00 57.97 60.67 1qi9 h PHE 425 Cb 0.07 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.06 1qi9 h PHE 425 CO -0.08 0.51 0.19 0.00 -0.60 0.00 0.00 178.31 178.33 1qi9 h ALA 426 N 1.52 1.29 -0.33 2.45 0.00 -1.22 0.56 119.26 123.52 1qi9 h ALA 426 Ca 0.09 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 1qi9 h ALA 426 Cb 0.39 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1qi9 h ALA 426 CO 0.02 0.52 -0.42 1.15 0.00 0.00 0.00 179.25 180.51 1qi9 h THR 427 N 0.80 1.28 -0.25 0.00 2.02 -0.90 -1.46 112.91 114.40 1qi9 h THR 427 Ca 0.19 -1.60 -0.01 0.00 0.77 0.00 0.00 66.41 65.75 1qi9 h THR 427 Cb 0.21 1.52 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1qi9 h THR 427 CO -0.01 0.53 0.11 0.58 0.37 0.00 0.00 175.52 177.09 1qi9 h VAL 428 N 0.66 1.16 -0.21 3.16 2.07 -0.63 -2.18 116.25 120.27 1qi9 h VAL 428 Ca 0.04 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 1qi9 h VAL 428 Cb 1.02 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.80 1qi9 h VAL 428 CO 0.10 0.16 0.10 -0.07 0.02 0.00 0.00 177.57 177.88 1qi9 h LEU 429 N 0.25 0.28 -0.88 2.57 3.38 -0.71 -2.22 115.31 117.98 1qi9 h LEU 429 Ca 0.08 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1qi9 h LEU 429 Cb 0.15 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.78 1qi9 h LEU 429 CO -0.01 0.33 0.57 0.11 0.09 0.00 0.00 178.44 179.53 1qi9 h LYS 430 N 0.21 1.10 -0.38 1.13 1.57 -1.30 -0.75 116.57 118.14 1qi9 h LYS 430 Ca 0.07 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1qi9 h LYS 430 Cb 0.13 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 1qi9 h LYS 430 CO -0.01 0.73 0.13 0.00 -0.57 0.00 0.00 179.45 179.72 1qi9 h ALA 431 N 1.35 0.50 -0.22 3.86 0.00 -1.22 0.81 119.26 124.34 1qi9 h ALA 431 Ca 0.34 -0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.92 1qi9 h ALA 431 Cb -0.04 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1qi9 h ALA 431 CO -0.10 0.14 -0.53 -0.07 0.00 0.00 0.00 179.25 178.69 1qi9 h LEU 432 N 0.47 0.85 -0.87 0.00 3.38 -1.23 -3.14 115.31 114.78 1qi9 h LEU 432 Ca 0.12 -0.56 -0.06 0.00 0.09 0.00 0.00 57.88 57.47 1qi9 h LEU 432 Cb 0.24 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1qi9 h LEU 432 CO -0.01 1.26 0.15 0.40 0.09 0.00 0.00 178.44 180.33 1qi9 h ILE 433 N 0.47 1.25 0.00 1.22 2.04 -1.06 -3.42 117.51 118.01 1qi9 h ILE 433 Ca -0.00 -0.90 0.00 0.00 1.00 0.00 0.00 64.86 64.95 1qi9 h ILE 433 Cb 1.14 0.60 0.00 0.00 -0.74 0.00 0.00 36.82 37.83 1qi9 h ILE 433 CO 0.12 0.34 0.00 0.61 0.00 0.00 0.00 178.15 179.22 1qi9 n GLY 434 N -0.76 -0.28 0.19 5.37 0.00 0.27 -4.42 105.19 105.56 1qi9 n GLY 434 Ca 0.05 -1.57 -0.08 0.00 0.00 0.00 0.00 46.02 44.42 1qi9 n GLY 434 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1qi9 h LEU 435 N 0.00 -0.46 -0.10 0.99 5.85 -1.39 -1.34 115.31 118.86 1qi9 h LEU 435 Ca 0.00 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.86 1qi9 h LEU 435 Cb 0.00 0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 1qi9 h LEU 435 CO 0.00 -0.18 -0.18 -0.78 -0.34 0.00 0.00 178.44 176.96 1qi9 h ASP 436 N -0.13 -0.55 1.14 1.25 3.58 -1.88 -2.02 116.42 117.82 1qi9 h ASP 436 Ca 0.12 0.09 -0.05 0.00 0.42 0.00 0.00 57.03 57.62 1qi9 h ASP 436 Cb 0.32 0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.61 1qi9 h ASP 436 CO -0.30 -0.23 -0.22 0.03 -2.88 0.00 0.00 179.24 175.64 1qi9 h ARG 437 N -0.24 0.00 0.00 0.28 3.08 -1.75 -2.59 114.38 113.16 1qi9 h ARG 437 Ca 0.09 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 1qi9 h ARG 437 Cb 0.37 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 1qi9 h ARG 437 CO -0.24 0.22 -0.07 0.78 -1.07 0.00 0.00 179.97 179.59 1qi9 h GLY 438 N 2.51 0.00 1.41 0.04 0.00 -0.51 -1.87 103.07 104.65 1qi9 h GLY 438 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1qi9 h GLY 438 CO 0.03 0.00 -0.12 0.61 0.00 0.00 0.00 176.54 177.06 1qi9 n GLY 439 N -1.31 -1.25 3.77 4.60 0.00 -0.97 -1.32 105.19 108.71 1qi9 n GLY 439 Ca -0.03 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 1qi9 n GLY 439 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qi9 s ASP 440 N -2.76 5.91 0.17 1.61 1.01 -0.71 -4.79 116.67 117.11 1qi9 s ASP 440 Ca 0.21 2.26 -0.26 0.00 0.71 0.00 0.00 52.55 55.47 1qi9 s ASP 440 Cb 0.19 -2.59 -0.08 0.00 1.01 0.00 0.00 42.92 41.45 1qi9 s ASP 440 CO 0.53 -1.09 0.80 0.00 0.21 0.00 0.00 175.17 175.62 1qi9 n TYR 442 N 1.66 2.17 -0.03 0.00 9.36 0.87 -4.88 117.16 126.30 1qi9 n TYR 442 Ca -0.05 0.50 -0.15 0.00 3.32 0.00 0.00 57.90 61.52 1qi9 n TYR 442 Cb 0.48 -2.43 -0.10 0.00 -0.63 0.00 0.00 39.34 36.67 1qi9 n TYR 442 CO 0.00 0.00 0.00 -1.00 0.22 0.00 0.00 176.86 176.08 1qi9 h PRO 443 N 3.40 0.25 -2.11 2.98 0.13 -1.94 -3.38 132.00 131.32 1qi9 h PRO 443 Ca -0.45 -0.21 -0.58 0.00 -0.87 0.00 0.00 66.00 63.89 1qi9 h PRO 443 Cb 1.28 0.04 -0.40 0.00 0.13 0.00 0.00 31.00 32.05 1qi9 h PRO 443 CO 0.69 0.86 -0.86 -0.40 -0.23 0.00 0.00 178.00 178.06 1qi9 n ASP 444 N -4.50 1.83 -4.78 1.44 5.75 -1.26 -5.10 116.55 109.93 1qi9 n ASP 444 Ca -0.09 -3.04 -0.36 0.00 -0.01 0.00 0.00 54.79 51.30 1qi9 n ASP 444 Cb 0.47 -0.65 -0.02 0.00 -1.03 0.00 0.00 41.12 39.88 1qi9 n ASP 444 CO 0.00 0.00 0.00 -2.16 -0.11 0.00 0.00 177.20 174.93 1qi9 s PRO 445 N -1.75 3.81 0.30 0.11 0.04 -1.26 -4.94 135.00 131.31 1qi9 s PRO 445 Ca 0.37 1.60 0.04 0.00 0.04 0.00 0.00 61.00 63.05 1qi9 s PRO 445 Cb 0.16 -2.32 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1qi9 s PRO 445 CO -0.07 -0.47 0.20 0.14 0.04 0.00 0.00 177.00 176.85 1qi9 s VAL 446 N -1.69 0.15 -0.07 -0.36 -7.23 -1.26 -1.16 120.40 108.78 1qi9 s VAL 446 Ca 0.64 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.75 1qi9 s VAL 446 Cb -0.24 -2.49 0.02 0.00 0.56 0.00 0.00 36.38 34.24 1qi9 s VAL 446 CO 0.29 0.00 0.19 -0.72 -0.31 0.00 0.00 175.10 174.54 1qi9 s TYR 447 N -3.61 -0.22 0.45 2.82 -0.85 -0.01 -4.80 117.35 111.13 1qi9 s TYR 447 Ca 0.37 0.53 -0.25 0.00 -0.52 0.00 0.00 57.07 57.21 1qi9 s TYR 447 Cb 0.04 0.05 -0.08 0.00 0.38 0.00 0.00 41.96 42.35 1qi9 s TYR 447 CO 0.20 -0.13 1.34 -2.14 -1.52 0.00 0.00 175.55 173.31 1qi9 s PRO 448 N 0.39 3.70 1.19 -3.49 0.02 -1.26 -0.08 135.00 135.48 1qi9 s PRO 448 Ca -0.02 2.22 -0.17 0.00 0.02 0.00 0.00 61.00 63.04 1qi9 s PRO 448 Cb -0.04 -2.60 0.28 0.00 0.02 0.00 0.00 34.50 32.17 1qi9 s PRO 448 CO -0.02 -0.74 1.06 0.16 -0.33 0.00 0.00 177.00 177.14 1qi9 s ASP 449 N -0.76 0.95 0.51 2.53 1.47 0.15 -4.83 116.67 116.69 1qi9 s ASP 449 Ca 0.62 0.89 0.24 0.00 1.18 0.00 0.00 52.55 55.48 1qi9 s ASP 449 Cb -0.39 -1.32 1.37 0.00 -0.34 0.00 0.00 42.92 42.24 1qi9 s ASP 449 CO 0.50 -4.14 2.07 0.44 0.68 0.00 0.00 175.17 174.72 1qi9 h ASP 450 N -2.59 0.00 0.53 2.11 3.32 -1.94 -1.20 116.42 116.66 1qi9 h ASP 450 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1qi9 h ASP 450 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1qi9 h ASP 450 CO 0.41 0.12 -0.26 0.47 -1.72 0.00 0.00 179.24 178.26 1qi9 n ASP 451 N -3.86 0.46 -1.35 6.45 8.00 -1.26 -4.87 116.55 120.12 1qi9 n ASP 451 Ca -0.02 -0.27 -0.12 0.00 0.71 0.00 0.00 54.79 55.09 1qi9 n ASP 451 Cb 0.22 -0.01 -0.01 0.00 -0.02 0.00 0.00 41.12 41.30 1qi9 n ASP 451 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qi9 n GLY 452 N 1.42 -0.12 0.00 0.44 0.00 -0.45 -4.81 105.19 101.67 1qi9 n GLY 452 Ca 0.09 -0.39 0.06 0.00 0.00 0.00 0.00 46.02 45.78 1qi9 n GLY 452 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qi9 n LEU 453 N -1.69 0.11 -3.97 0.99 4.77 -1.26 -0.39 117.00 115.56 1qi9 n LEU 453 Ca -0.14 -0.10 -0.09 0.00 -0.03 0.00 0.00 56.01 55.65 1qi9 n LEU 453 Cb 0.61 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.60 1qi9 n LEU 453 CO 0.16 0.03 -0.28 -0.54 -1.33 0.00 0.00 177.39 175.43 1qi9 s LYS 454 N -2.73 0.50 -0.19 3.23 1.02 -1.26 -5.00 119.74 115.31 1qi9 s LYS 454 Ca -0.03 -0.77 -0.09 0.00 0.02 0.00 0.00 55.97 55.10 1qi9 s LYS 454 Cb 0.08 0.19 -0.05 0.00 -0.52 0.00 0.00 37.83 37.54 1qi9 s LYS 454 CO 0.52 -0.11 0.10 -0.51 -0.92 0.00 0.00 175.35 174.43 1qi9 s LEU 455 N -2.01 4.04 -0.16 3.17 1.43 -1.26 -0.67 118.68 123.21 1qi9 s LEU 455 Ca -0.07 0.16 -0.06 0.00 -1.03 0.00 0.00 54.13 53.13 1qi9 s LEU 455 Cb -0.03 -2.04 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 1qi9 s LEU 455 CO -0.04 0.17 0.03 -0.63 0.23 0.00 0.00 176.35 176.11 1qi9 s ILE 456 N 0.40 4.53 0.36 -0.59 -1.09 0.89 -4.91 121.20 120.79 1qi9 s ILE 456 Ca 0.06 -0.13 -0.28 0.00 -2.23 0.00 0.00 60.65 58.06 1qi9 s ILE 456 Cb -0.12 -3.01 -0.11 0.00 -1.58 0.00 0.00 42.46 37.65 1qi9 s ILE 456 CO -0.01 0.49 1.41 -1.81 -1.23 0.00 0.00 174.94 173.80 1qi9 s ASP 457 N 0.20 6.48 0.02 3.58 1.01 -1.26 -0.83 116.67 125.87 1qi9 s ASP 457 Ca 0.02 2.91 0.00 0.00 0.71 0.00 0.00 52.55 56.19 1qi9 s ASP 457 Cb -0.13 -2.66 -0.04 0.00 1.01 0.00 0.00 42.92 41.10 1qi9 s ASP 457 CO 0.01 -0.76 0.10 0.12 0.21 0.00 0.00 175.17 174.85 1qi9 s PHE 458 N -1.14 3.31 0.14 4.23 5.36 -0.30 -4.84 117.98 124.75 1qi9 s PHE 458 Ca 0.52 0.19 -0.10 0.00 -0.96 0.00 0.00 56.93 56.58 1qi9 s PHE 458 Cb -0.44 -1.72 -0.00 0.00 -0.34 0.00 0.00 43.02 40.52 1qi9 s PHE 458 CO 0.59 0.56 0.28 -0.98 -1.46 0.00 0.00 175.22 174.20 1qi9 s ARG 459 N -2.01 1.07 0.00 10.12 1.70 -1.26 -4.72 118.95 123.85 1qi9 s ARG 459 Ca 0.26 -1.06 0.00 0.00 -0.47 0.00 0.00 55.73 54.46 1qi9 s ARG 459 Cb -0.12 0.38 0.00 0.00 -0.57 0.00 0.00 34.95 34.64 1qi9 s ARG 459 CO 0.18 -0.39 0.00 0.41 -1.08 0.00 0.00 175.30 174.42 1qi9 n GLY 460 N -0.18 0.43 3.07 3.88 0.00 -1.26 -5.06 105.19 106.07 1qi9 n GLY 460 Ca -0.10 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.80 1qi9 n GLY 460 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qi9 s SER 461 N -2.01 -0.07 -0.46 1.61 0.01 -1.26 -5.10 113.70 106.42 1qi9 s SER 461 Ca 0.00 0.07 -0.29 0.00 1.31 0.00 0.00 55.95 57.04 1qi9 s SER 461 Cb 0.00 0.27 0.02 0.00 0.21 0.00 0.00 66.02 66.52 1qi9 s SER 461 CO 0.00 -0.20 1.22 0.00 0.41 0.00 0.00 173.24 174.67 1qi9 s LEU 463 N 4.76 4.42 0.77 0.00 1.43 -1.26 -4.92 118.68 123.88 1qi9 s LEU 463 Ca 0.52 -1.37 -0.14 0.00 -1.03 0.00 0.00 54.13 52.10 1qi9 s LEU 463 Cb -0.09 -2.44 0.06 0.00 0.03 0.00 0.00 46.19 43.75 1qi9 s LEU 463 CO 0.32 -1.35 1.22 0.35 0.23 0.00 0.00 176.35 177.12 1qi9 n THR 464 N 5.92 2.72 -0.06 5.49 -2.24 -1.26 -0.09 114.28 124.76 1qi9 n THR 464 Ca 0.11 -0.28 -0.10 0.00 -2.27 0.00 0.00 64.05 61.51 1qi9 n THR 464 Cb 0.48 -1.26 -0.03 0.00 -2.10 0.00 0.00 70.33 67.41 1qi9 n THR 464 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1qi9 h PHE 465 N -0.57 0.31 -0.77 4.78 0.04 -1.04 -0.54 116.94 119.15 1qi9 h PHE 465 Ca -0.47 0.00 0.07 0.00 2.80 0.00 0.00 57.97 60.37 1qi9 h PHE 465 Cb 1.31 -0.10 -0.05 0.00 2.20 0.00 0.00 35.95 39.31 1qi9 h PHE 465 CO 0.45 0.23 0.50 1.05 -0.60 0.00 0.00 178.31 179.94 1qi9 h GLU 466 N 0.29 0.79 -0.52 1.51 4.11 -1.50 0.66 114.58 119.92 1qi9 h GLU 466 Ca 0.08 -0.05 -0.11 0.00 0.07 0.00 0.00 59.36 59.36 1qi9 h GLU 466 Cb 0.01 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 1qi9 h GLU 466 CO -0.02 0.52 -0.11 0.78 0.07 0.00 0.00 179.01 180.25 1qi9 h GLY 467 N 0.81 1.06 2.00 1.06 0.00 -1.66 0.09 103.07 106.42 1qi9 h GLY 467 Ca 0.33 -0.84 -0.08 0.00 0.00 0.00 0.00 47.33 46.74 1qi9 h GLY 467 CO -0.12 0.77 -0.39 0.83 0.00 0.00 0.00 176.54 177.64 1qi9 h GLU 468 N 0.87 0.00 -0.06 4.80 4.39 -0.22 0.20 114.58 124.55 1qi9 h GLU 468 Ca 0.14 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.80 1qi9 h GLU 468 Cb 0.66 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 1qi9 h GLU 468 CO 0.05 0.39 -0.11 0.82 -1.16 0.00 0.00 179.01 179.00 1qi9 h ILE 469 N 0.00 1.41 -0.89 3.13 2.04 -0.72 -2.26 117.51 120.22 1qi9 h ILE 469 Ca -0.00 -1.40 0.04 0.00 1.00 0.00 0.00 64.86 64.50 1qi9 h ILE 469 Cb 1.17 2.19 -0.06 0.00 -0.74 0.00 0.00 36.82 39.38 1qi9 h ILE 469 CO 0.05 0.39 0.57 0.78 0.00 0.00 0.00 178.15 179.94 1qi9 h ASN 470 N -0.30 0.94 -0.67 1.72 2.35 -0.83 -2.58 115.58 116.21 1qi9 h ASN 470 Ca 0.00 -0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.72 1qi9 h ASN 470 Cb 0.68 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.81 1qi9 h ASN 470 CO 0.02 0.64 0.31 0.50 -1.65 0.00 0.00 177.43 177.25 1qi9 h LYS 471 N 1.10 0.97 -0.53 0.81 3.64 -0.55 -1.19 116.57 120.81 1qi9 h LYS 471 Ca 0.36 -0.15 0.03 0.00 -1.27 0.00 0.00 60.65 59.63 1qi9 h LYS 471 Cb 0.04 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.65 1qi9 h LYS 471 CO -0.13 0.78 0.30 1.25 -2.27 0.00 0.00 179.45 179.38 1qi9 h LEU 472 N 0.93 0.47 -0.57 5.20 5.85 -1.09 0.43 115.31 126.52 1qi9 h LEU 472 Ca 0.23 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 1qi9 h LEU 472 Cb 0.14 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.06 1qi9 h LEU 472 CO -0.03 0.33 0.29 0.00 -0.34 0.00 0.00 178.44 178.69 1qi9 h ALA 473 N 1.26 0.74 -0.11 1.25 0.00 -1.08 0.73 119.26 122.04 1qi9 h ALA 473 Ca 0.22 -0.12 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 1qi9 h ALA 473 Cb 0.07 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1qi9 h ALA 473 CO -0.12 0.28 -0.48 0.28 0.00 0.00 0.00 179.25 179.21 1qi9 h VAL 474 N 0.77 1.33 -0.63 0.00 2.07 -1.02 -0.82 116.25 117.97 1qi9 h VAL 474 Ca 0.20 -1.68 -0.06 0.00 0.82 0.00 0.00 66.70 65.98 1qi9 h VAL 474 Cb 0.09 1.77 -0.03 0.00 -1.52 0.00 0.00 31.29 31.61 1qi9 h VAL 474 CO -0.03 0.50 0.16 0.78 0.02 0.00 0.00 177.57 179.01 1qi9 h ASN 475 N 0.23 0.91 -0.20 0.57 -0.26 0.23 0.17 115.58 117.23 1qi9 h ASN 475 Ca 0.01 -0.17 -0.13 0.00 -0.56 0.00 0.00 56.30 55.45 1qi9 h ASN 475 Cb 0.93 -0.24 0.00 0.00 -1.06 0.00 0.00 38.32 37.95 1qi9 h ASN 475 CO 0.08 0.87 -0.38 0.58 -1.06 0.00 0.00 177.43 177.52 1qi9 h VAL 476 N 0.93 1.33 -0.24 2.81 2.07 -0.19 0.66 116.25 123.63 1qi9 h VAL 476 Ca 0.20 -1.61 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 1qi9 h VAL 476 Cb 0.31 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 31.93 1qi9 h VAL 476 CO -0.00 0.50 0.14 0.00 0.02 0.00 0.00 177.57 178.23 1qi9 h ALA 477 N 0.60 0.30 0.00 1.67 0.00 -0.96 -2.84 119.26 118.03 1qi9 h ALA 477 Ca 0.01 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1qi9 h ALA 477 Cb 0.98 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1qi9 h ALA 477 CO 0.09 -0.19 -0.20 0.74 0.00 0.00 0.00 179.25 179.68 1qi9 h PHE 478 N 0.29 0.00 -0.25 0.00 -1.00 -0.67 -1.95 116.94 113.37 1qi9 h PHE 478 Ca 0.08 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.80 1qi9 h PHE 478 Cb 0.02 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.57 1qi9 h PHE 478 CO -0.05 0.20 -0.12 0.78 -1.61 0.00 0.00 178.31 177.51 1qi9 h GLY 479 N 2.62 0.44 1.02 -1.45 0.00 -0.62 0.18 103.07 105.26 1qi9 h GLY 479 Ca -0.00 -0.29 -0.07 0.00 0.00 0.00 0.00 47.33 46.96 1qi9 h GLY 479 CO 0.03 0.27 0.04 3.21 0.00 0.00 0.00 176.54 180.09 1qi9 h ARG 480 N 0.38 0.91 -0.93 4.80 2.47 -1.24 -1.62 114.38 119.16 1qi9 h ARG 480 Ca 0.07 -0.27 0.02 0.00 -1.26 0.00 0.00 59.98 58.55 1qi9 h ARG 480 Cb 0.45 -0.09 -0.05 0.00 -1.65 0.00 0.00 29.97 28.62 1qi9 h ARG 480 CO 0.03 0.91 0.61 1.96 0.56 0.00 0.00 179.97 184.04 1qi9 h GLN 481 N 0.79 1.17 0.00 0.04 4.20 -1.34 -1.02 115.11 118.95 1qi9 h GLN 481 Ca 0.16 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1qi9 h GLN 481 Cb 0.47 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.98 1qi9 h GLN 481 CO 0.02 0.77 0.00 0.52 -0.67 0.00 0.00 178.83 179.47 1qi9 h MET 482 N 1.20 0.00 0.00 1.46 2.86 -0.17 -0.54 114.93 119.75 1qi9 h MET 482 Ca 0.36 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.95 1qi9 h MET 482 Cb -0.05 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 1qi9 h MET 482 CO -0.10 0.00 -0.24 -0.07 1.06 0.00 0.00 176.91 177.56 1qi9 h LEU 483 N 0.00 0.00 0.00 1.22 3.38 -0.23 -3.44 115.31 116.24 1qi9 h LEU 483 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1qi9 h LEU 483 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 1qi9 h LEU 483 CO 0.00 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.38 1qi9 n GLY 484 N 0.09 1.05 0.41 0.83 0.00 -0.21 -1.43 105.19 105.93 1qi9 n GLY 484 Ca -0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 1qi9 n GLY 484 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1qi9 n ILE 485 N -1.04 0.62 -3.74 -0.61 -5.35 -1.18 -4.19 119.36 103.88 1qi9 n ILE 485 Ca 0.00 -0.81 -0.10 0.00 -0.27 0.00 0.00 62.75 61.57 1qi9 n ILE 485 Cb 0.00 0.75 -0.06 0.00 -1.74 0.00 0.00 39.64 38.59 1qi9 n ILE 485 CO 0.00 0.00 0.00 -1.00 -1.76 0.00 0.00 176.55 173.79 1qi9 s HIS 486 N -0.88 -0.06 0.30 4.28 3.76 -1.26 -4.58 115.29 116.86 1qi9 s HIS 486 Ca 0.14 -0.25 0.07 0.00 -0.15 0.00 0.00 55.06 54.88 1qi9 s HIS 486 Cb 0.08 0.10 -0.03 0.00 1.11 0.00 0.00 32.58 33.85 1qi9 s HIS 486 CO 0.11 -0.59 0.30 0.71 -0.85 0.00 0.00 174.74 174.42 1qi9 s TYR 487 N -3.46 3.05 0.35 1.40 1.51 -1.26 -4.40 117.35 114.54 1qi9 s TYR 487 Ca 0.01 -0.20 0.10 0.00 -1.01 0.00 0.00 57.07 55.97 1qi9 s TYR 487 Cb 0.02 -1.69 0.84 0.00 -0.11 0.00 0.00 41.96 41.02 1qi9 s TYR 487 CO -0.09 0.28 1.84 -0.09 -1.11 0.00 0.00 175.55 176.37 1qi9 h ARG 488 N 1.25 0.65 -0.14 -0.62 2.43 -1.99 -0.30 114.38 115.66 1qi9 h ARG 488 Ca -0.47 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 58.58 1qi9 h ARG 488 Cb 1.25 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 30.64 1qi9 h ARG 488 CO 0.58 0.43 -0.30 0.27 -1.51 0.00 0.00 179.97 179.44 1qi9 h PHE 489 N 0.67 0.29 -0.78 2.20 -5.15 -1.95 -0.44 116.94 111.77 1qi9 h PHE 489 Ca 0.50 -0.06 0.04 0.00 -0.20 0.00 0.00 57.97 58.25 1qi9 h PHE 489 Cb 0.87 -0.07 -0.05 0.00 0.22 0.00 0.00 35.95 36.92 1qi9 h PHE 489 CO -0.00 0.54 0.49 -0.44 -2.00 0.00 0.00 178.31 176.89 1qi9 h ASP 490 N 0.23 0.79 0.01 -0.68 3.32 -1.39 -1.82 116.42 116.88 1qi9 h ASP 490 Ca 0.03 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 1qi9 h ASP 490 Cb 0.65 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.03 1qi9 h ASP 490 CO 0.05 0.54 -0.00 1.23 -1.72 0.00 0.00 179.24 179.33 1qi9 h GLY 491 N 0.94 -0.01 1.24 2.75 0.00 -1.04 -1.77 103.07 105.18 1qi9 h GLY 491 Ca 0.32 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.46 1qi9 h GLY 491 CO -0.13 -0.00 -0.62 -2.22 0.00 0.00 0.00 176.54 173.56 1qi9 h ILE 492 N -0.81 1.29 -0.21 2.60 1.08 -1.15 -1.05 117.51 119.26 1qi9 h ILE 492 Ca -0.00 -1.83 -0.15 0.00 -0.39 0.00 0.00 64.86 62.49 1qi9 h ILE 492 Cb 0.78 1.77 -0.01 0.00 -3.07 0.00 0.00 36.82 36.29 1qi9 h ILE 492 CO 0.00 0.59 -0.48 1.56 -0.69 0.00 0.00 178.15 179.13 1qi9 h GLN 493 N 0.57 0.55 -0.01 2.37 1.08 -1.47 -1.88 115.11 116.33 1qi9 h GLN 493 Ca -0.01 -0.31 -0.00 0.00 -1.45 0.00 0.00 58.65 56.88 1qi9 h GLN 493 Cb 1.23 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 28.68 1qi9 h GLN 493 CO 0.13 0.91 0.00 0.78 -0.95 0.00 0.00 178.83 179.71 1qi9 h GLY 494 N 1.07 0.01 0.78 3.46 0.00 -1.42 0.37 103.07 107.33 1qi9 h GLY 494 Ca 0.02 -0.01 0.05 0.00 0.00 0.00 0.00 47.33 47.39 1qi9 h GLY 494 CO 0.09 0.01 0.47 1.41 0.00 0.00 0.00 176.54 178.52 1qi9 h LEU 495 N -0.09 0.75 -0.47 3.11 3.38 -1.05 -0.85 115.31 120.09 1qi9 h LEU 495 Ca 0.00 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 1qi9 h LEU 495 Cb 0.10 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 1qi9 h LEU 495 CO -0.00 0.50 -0.55 -0.07 0.09 0.00 0.00 178.44 178.40 1qi9 h LEU 496 N 0.88 0.69 -0.16 1.67 3.38 -1.09 -2.13 115.31 118.56 1qi9 h LEU 496 Ca 0.32 -0.37 -0.00 0.00 0.09 0.00 0.00 57.88 57.92 1qi9 h LEU 496 Cb 0.10 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 1qi9 h LEU 496 CO -0.15 1.10 0.10 0.25 0.09 0.00 0.00 178.44 179.83 1qi9 h LEU 497 N 0.47 0.19 -1.27 1.67 5.85 -0.14 -1.33 115.31 120.75 1qi9 h LEU 497 Ca 0.01 -0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.74 1qi9 h LEU 497 Cb 1.11 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.05 1qi9 h LEU 497 CO 0.11 0.17 0.52 1.23 -0.34 0.00 0.00 178.44 180.12 1qi9 h GLY 498 N 0.19 1.11 0.82 3.75 0.00 -1.08 -2.56 103.07 105.28 1qi9 h GLY 498 Ca 0.06 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 46.98 1qi9 h GLY 498 CO -0.01 0.30 -0.02 -2.09 0.00 0.00 0.00 176.54 174.72 1qi9 h GLU 499 N 0.92 0.38 -0.54 4.80 4.81 -1.11 -1.70 114.58 122.15 1qi9 h GLU 499 Ca 0.33 -0.13 -0.04 0.00 -0.13 0.00 0.00 59.36 59.39 1qi9 h GLU 499 Cb 0.13 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1qi9 h GLU 499 CO -0.11 0.59 0.18 1.15 -0.73 0.00 0.00 179.01 180.10 1qi9 h THR 500 N 0.13 1.23 -0.32 0.32 2.02 -0.92 -0.54 112.91 114.82 1qi9 h THR 500 Ca 0.06 -0.76 -0.01 0.00 0.77 0.00 0.00 66.41 66.46 1qi9 h THR 500 Cb 0.43 0.72 -0.01 0.00 -1.74 0.00 0.00 68.15 67.55 1qi9 h THR 500 CO 0.01 0.29 0.17 0.40 0.37 0.00 0.00 175.52 176.76 1qi9 h ILE 501 N 0.74 1.14 -0.58 3.11 2.04 -1.50 -1.42 117.51 121.04 1qi9 h ILE 501 Ca 0.17 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.57 1qi9 h ILE 501 Cb 0.26 0.82 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1qi9 h ILE 501 CO -0.01 0.14 0.03 0.74 0.00 0.00 0.00 178.15 179.06 1qi9 h THR 502 N 0.39 1.26 -0.55 -0.27 2.02 -1.13 -1.71 112.91 112.92 1qi9 h THR 502 Ca 0.11 -1.09 0.06 0.00 0.77 0.00 0.00 66.41 66.25 1qi9 h THR 502 Cb 0.08 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.25 1qi9 h THR 502 CO -0.02 0.40 0.27 0.58 0.37 0.00 0.00 175.52 177.12 1qi9 h VAL 503 N 0.91 0.93 -0.66 3.16 2.07 -0.85 0.52 116.25 122.32 1qi9 h VAL 503 Ca 0.17 -0.18 0.06 0.00 0.82 0.00 0.00 66.70 67.58 1qi9 h VAL 503 Cb 0.51 0.36 -0.06 0.00 -1.52 0.00 0.00 31.29 30.59 1qi9 h VAL 503 CO 0.02 0.09 0.36 0.03 0.02 0.00 0.00 177.57 178.10 1qi9 h ARG 504 N 0.52 0.64 -0.31 1.57 2.47 -0.73 -1.27 114.38 117.28 1qi9 h ARG 504 Ca 0.25 -0.04 -0.13 0.00 -1.26 0.00 0.00 59.98 58.80 1qi9 h ARG 504 Cb 0.19 -0.14 -0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1qi9 h ARG 504 CO -0.19 0.42 -0.33 1.15 0.56 0.00 0.00 179.97 181.58 1qi9 h THR 505 N 0.66 1.29 -0.58 2.04 2.02 -0.87 -2.16 112.91 115.32 1qi9 h THR 505 Ca 0.30 -1.51 0.04 0.00 0.77 0.00 0.00 66.41 66.01 1qi9 h THR 505 Cb 0.22 1.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 1qi9 h THR 505 CO -0.20 0.49 0.33 -0.07 0.37 0.00 0.00 175.52 176.44 1qi9 h LEU 506 N 0.53 0.52 -0.28 2.58 3.38 -0.78 -0.69 115.31 120.56 1qi9 h LEU 506 Ca 0.05 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.97 1qi9 h LEU 506 Cb 0.91 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 1qi9 h LEU 506 CO 0.08 0.36 -0.05 -0.74 0.09 0.00 0.00 178.44 178.18 1qi9 h HIS 507 N 0.65 0.59 -0.48 1.13 2.76 -1.17 -0.41 115.15 118.21 1qi9 h HIS 507 Ca 0.24 -0.12 0.06 0.00 -2.20 0.00 0.00 60.37 58.35 1qi9 h HIS 507 Cb 0.08 -0.15 -0.05 0.00 1.55 0.00 0.00 27.41 28.84 1qi9 h HIS 507 CO -0.07 0.72 0.18 0.37 -1.30 0.00 0.00 177.93 177.83 1qi9 h GLN 508 N 0.29 0.36 -0.49 5.26 4.15 -0.93 -2.43 115.11 121.32 1qi9 h GLN 508 Ca 0.07 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.38 1qi9 h GLN 508 Cb 0.52 -0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 1qi9 h GLN 508 CO 0.02 0.24 -0.04 0.93 -1.93 0.00 0.00 178.83 178.05 1qi9 h GLU 509 N 0.37 0.89 -0.88 1.69 5.08 -1.06 -3.14 114.58 117.53 1qi9 h GLU 509 Ca 0.22 -0.31 0.10 0.00 -1.00 0.00 0.00 59.36 58.38 1qi9 h GLU 509 Cb 0.21 -0.07 -0.08 0.00 0.50 0.00 0.00 28.75 29.32 1qi9 h GLU 509 CO -0.21 0.95 0.52 1.25 -1.00 0.00 0.00 179.01 180.51 1qi9 h LEU 510 N 0.75 0.74 -2.46 1.33 5.85 -0.82 0.15 115.31 120.84 1qi9 h LEU 510 Ca 0.13 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 1qi9 h LEU 510 Cb 0.58 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.51 1qi9 h LEU 510 CO 0.03 0.42 -0.02 0.24 -0.34 0.00 0.00 178.44 178.76 1qi9 h MET 511 N 0.85 0.00 0.00 1.25 2.86 -1.39 -2.83 114.93 115.67 1qi9 h MET 511 Ca 0.43 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 58.04 1qi9 h MET 511 Cb 0.40 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.05 1qi9 h MET 511 CO -0.25 0.02 -0.31 1.79 1.06 0.00 0.00 176.91 179.22 1qi9 h THR 512 N 0.00 0.20 -3.57 2.22 1.35 -1.03 -3.48 112.91 108.60 1qi9 h THR 512 Ca -0.00 -1.30 -0.53 0.00 -0.55 0.00 0.00 66.41 64.04 1qi9 h THR 512 Cb 0.09 2.02 0.06 0.00 -1.73 0.00 0.00 68.15 68.59 1qi9 h THR 512 CO 0.00 0.11 0.71 -0.36 -0.25 0.00 0.00 175.52 175.74 1qi9 s PHE 513 N -3.17 3.04 0.13 4.73 0.08 -1.07 -4.92 117.98 116.80 1qi9 s PHE 513 Ca 0.05 1.18 -0.14 0.00 0.12 0.00 0.00 56.93 58.14 1qi9 s PHE 513 Cb 0.06 -3.76 -0.01 0.00 -0.57 0.00 0.00 43.02 38.75 1qi9 s PHE 513 CO 0.71 -2.33 1.58 0.00 -0.10 0.00 0.00 175.22 175.09 1qi9 h ALA 514 N 4.45 0.59 -2.74 5.36 0.00 -1.92 -3.44 119.26 121.56 1qi9 h ALA 514 Ca -0.47 -0.27 -0.50 0.00 0.00 0.00 0.00 54.91 53.67 1qi9 h ALA 514 Cb 1.22 -0.16 0.02 0.00 0.00 0.00 0.00 17.79 18.87 1qi9 h ALA 514 CO 0.73 0.38 0.45 -1.83 0.00 0.00 0.00 179.25 178.98 1qi9 s GLU 515 N -5.01 4.54 0.16 0.00 1.03 -1.26 -4.95 118.70 113.21 1qi9 s GLU 515 Ca -0.13 1.72 -0.31 0.00 0.03 0.00 0.00 54.97 56.28 1qi9 s GLU 515 Cb 0.11 -3.05 -0.11 0.00 -0.80 0.00 0.00 34.13 30.28 1qi9 s GLU 515 CO 0.80 0.14 1.77 -1.21 -1.33 0.00 0.00 175.26 175.44 1qi9 s GLU 516 N -1.67 4.13 0.05 -4.83 2.02 -1.26 -4.94 118.70 112.20 1qi9 s GLU 516 Ca 0.47 2.59 -0.28 0.00 0.02 0.00 0.00 54.97 57.78 1qi9 s GLU 516 Cb -0.29 -3.35 0.09 0.00 0.10 0.00 0.00 34.13 30.68 1qi9 s GLU 516 CO 0.38 -0.79 0.98 -1.54 0.02 0.00 0.00 175.26 174.31 1qi9 s SER 517 N 1.98 -0.24 0.24 -0.19 1.04 -1.26 -4.77 113.70 110.50 1qi9 s SER 517 Ca 0.78 -0.18 -0.03 0.00 0.48 0.00 0.00 55.95 57.00 1qi9 s SER 517 Cb -0.47 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.00 1qi9 s SER 517 CO 0.34 -0.67 0.26 0.42 0.98 0.00 0.00 173.24 174.56 1qi9 s THR 518 N -3.06 0.00 0.03 2.02 -4.23 -1.26 -4.39 115.64 104.75 1qi9 s THR 518 Ca 0.09 -1.83 0.09 0.00 -1.18 0.00 0.00 61.69 58.86 1qi9 s THR 518 Cb -0.01 -2.44 -0.03 0.00 1.34 0.00 0.00 72.50 71.36 1qi9 s THR 518 CO -0.03 0.00 -0.25 -0.36 -0.54 0.00 0.00 174.62 173.44 1qi9 s PHE 519 N -3.95 2.37 -0.22 3.99 0.08 -1.01 -4.89 117.98 114.35 1qi9 s PHE 519 Ca 0.35 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.95 1qi9 s PHE 519 Cb 0.04 -1.44 0.11 0.00 -0.57 0.00 0.00 43.02 41.16 1qi9 s PHE 519 CO 0.14 0.10 0.42 -2.00 -0.10 0.00 0.00 175.22 173.78 1qi9 s GLU 520 N -1.09 0.35 0.32 0.44 2.12 -1.26 -0.12 118.70 119.45 1qi9 s GLU 520 Ca 0.12 0.92 -0.18 0.00 0.36 0.00 0.00 54.97 56.18 1qi9 s GLU 520 Cb -0.10 0.15 0.03 0.00 0.26 0.00 0.00 34.13 34.47 1qi9 s GLU 520 CO 0.02 -0.37 0.72 -0.59 -0.54 0.00 0.00 175.26 174.50 1qi9 s PHE 521 N 2.61 -0.00 -0.23 5.30 -0.71 -0.82 -1.22 117.98 122.91 1qi9 s PHE 521 Ca 0.03 -0.53 -0.09 0.00 -1.04 0.00 0.00 56.93 55.30 1qi9 s PHE 521 Cb -0.13 0.70 -0.04 0.00 -1.21 0.00 0.00 43.02 42.34 1qi9 s PHE 521 CO -0.14 -1.35 0.13 0.50 -1.34 0.00 0.00 175.22 173.02 1qi9 s ARG 522 N -3.30 3.98 0.94 1.99 3.52 -1.26 -0.90 118.95 123.91 1qi9 s ARG 522 Ca 0.14 -0.32 -0.12 0.00 -0.13 0.00 0.00 55.73 55.30 1qi9 s ARG 522 Cb -0.05 -3.44 0.15 0.00 -1.56 0.00 0.00 34.95 30.05 1qi9 s ARG 522 CO 0.09 0.06 1.09 -0.51 -0.81 0.00 0.00 175.30 175.22 1qi9 s LEU 523 N 1.02 2.03 0.28 -0.88 1.43 -0.13 -4.90 118.68 117.52 1qi9 s LEU 523 Ca 0.06 1.41 0.02 0.00 -1.03 0.00 0.00 54.13 54.59 1qi9 s LEU 523 Cb -0.14 -3.75 0.64 0.00 0.03 0.00 0.00 46.19 42.98 1qi9 s LEU 523 CO 0.04 -2.85 1.74 -0.26 0.23 0.00 0.00 176.35 175.25 1qi9 h PHE 524 N -1.69 0.76 -0.18 0.29 0.04 -1.98 -1.05 116.94 113.13 1qi9 h PHE 524 Ca -0.51 0.04 0.00 0.00 2.80 0.00 0.00 57.97 60.29 1qi9 h PHE 524 Cb 1.30 -0.20 0.00 0.00 2.20 0.00 0.00 35.95 39.25 1qi9 h PHE 524 CO 0.38 0.09 0.00 0.25 -0.60 0.00 0.00 178.31 178.43 1qi9 n THR 525 N -4.93 0.23 0.00 -1.55 -2.24 -1.26 -1.61 114.28 102.93 1qi9 n THR 525 Ca 0.20 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1qi9 n THR 525 Cb 0.55 0.23 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1qi9 n THR 525 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qi9 n GLY 526 N 1.04 2.42 3.79 3.38 0.00 -0.40 -4.90 105.19 110.51 1qi9 n GLY 526 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 1qi9 n GLY 526 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qi9 s GLU 527 N -0.73 3.58 -0.31 1.61 8.01 -1.26 -4.75 118.70 124.85 1qi9 s GLU 527 Ca 0.00 1.48 -0.17 0.00 0.01 0.00 0.00 54.97 56.28 1qi9 s GLU 527 Cb 0.00 -2.05 -0.02 0.00 -4.31 0.00 0.00 34.13 27.75 1qi9 s GLU 527 CO 0.00 -0.64 0.48 0.08 0.01 0.00 0.00 175.26 175.19 1qi9 s VAL 528 N -1.89 5.06 -0.04 2.63 1.01 -1.26 -0.96 120.40 124.95 1qi9 s VAL 528 Ca 0.70 0.51 -0.09 0.00 0.00 0.00 0.00 61.98 63.10 1qi9 s VAL 528 Cb -0.20 -3.87 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 1qi9 s VAL 528 CO 0.24 -0.06 0.26 -0.51 0.00 0.00 0.00 175.10 175.02 1qi9 s ILE 529 N 2.30 5.31 -0.08 2.22 2.07 -0.08 -0.34 121.20 132.61 1qi9 s ILE 529 Ca 0.18 0.36 0.01 0.00 -1.41 0.00 0.00 60.65 59.80 1qi9 s ILE 529 Cb -0.16 -3.54 0.02 0.00 0.13 0.00 0.00 42.46 38.91 1qi9 s ILE 529 CO 0.12 0.52 -0.10 -0.75 -1.91 0.00 0.00 174.94 172.81 1qi9 s LYS 530 N -1.29 1.59 -0.12 3.50 2.20 -0.91 -1.95 119.74 122.75 1qi9 s LYS 530 Ca 0.22 -0.35 -0.02 0.00 -0.36 0.00 0.00 55.97 55.46 1qi9 s LYS 530 Cb -0.14 -1.42 -0.03 0.00 -1.51 0.00 0.00 37.83 34.74 1qi9 s LYS 530 CO 0.11 -0.06 -0.06 -0.51 -0.36 0.00 0.00 175.35 174.47 1qi9 s LEU 531 N 0.97 3.17 0.15 5.43 1.43 0.83 -1.83 118.68 128.83 1qi9 s LEU 531 Ca -0.09 -0.11 0.08 0.00 -1.03 0.00 0.00 54.13 52.98 1qi9 s LEU 531 Cb -0.15 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1qi9 s LEU 531 CO 0.00 0.23 -0.10 -0.36 0.23 0.00 0.00 176.35 176.35 1qi9 s PHE 532 N -0.04 2.67 -0.18 0.29 0.08 -0.89 -2.41 117.98 117.51 1qi9 s PHE 532 Ca 0.00 -0.20 0.29 0.00 0.12 0.00 0.00 56.93 57.15 1qi9 s PHE 532 Cb -0.13 -1.35 1.15 0.00 -0.57 0.00 0.00 43.02 42.11 1qi9 s PHE 532 CO 0.03 0.47 1.86 1.96 -0.10 0.00 0.00 175.22 179.43 1qi9 h GLN 533 N 3.24 0.00 -0.14 0.44 4.20 -1.86 -2.13 115.11 118.86 1qi9 h GLN 533 Ca -0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.23 1qi9 h GLN 533 Cb 1.19 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1qi9 h GLN 533 CO 0.53 0.00 0.00 -0.40 -0.67 0.00 0.00 178.83 178.29 1qi9 n ASP 534 N -2.75 0.86 0.00 1.46 5.68 -1.26 -4.59 116.55 115.95 1qi9 n ASP 534 Ca 0.02 -1.88 0.00 0.00 -0.50 0.00 0.00 54.79 52.42 1qi9 n ASP 534 Cb 0.30 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 1qi9 n ASP 534 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qi9 n GLY 535 N 0.82 1.28 3.90 6.12 0.00 -0.80 -5.06 105.19 111.45 1qi9 n GLY 535 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.82 1qi9 n GLY 535 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qi9 s THR 536 N -2.51 3.05 0.06 2.61 -4.23 -1.26 -4.77 115.64 108.59 1qi9 s THR 536 Ca 0.00 0.15 -0.25 0.00 -1.18 0.00 0.00 61.69 60.41 1qi9 s THR 536 Cb 0.00 -3.30 0.06 0.00 1.34 0.00 0.00 72.50 70.60 1qi9 s THR 536 CO 0.00 -0.37 0.60 0.72 -0.54 0.00 0.00 174.62 175.03 1qi9 s PHE 537 N -3.29 -0.54 0.09 3.99 -0.71 -1.26 -2.08 117.98 114.17 1qi9 s PHE 537 Ca 0.58 0.61 0.04 0.00 -1.04 0.00 0.00 56.93 57.13 1qi9 s PHE 537 Cb -0.11 0.44 -0.03 0.00 -1.21 0.00 0.00 43.02 42.11 1qi9 s PHE 537 CO 0.48 -0.71 -0.12 0.95 -1.34 0.00 0.00 175.22 174.48 1qi9 s THR 538 N -2.57 1.04 -0.19 -4.49 -4.23 -0.76 -1.67 115.64 102.77 1qi9 s THR 538 Ca -0.05 -1.50 0.01 0.00 -1.18 0.00 0.00 61.69 58.97 1qi9 s THR 538 Cb -0.01 -1.23 0.04 0.00 1.34 0.00 0.00 72.50 72.64 1qi9 s THR 538 CO -0.02 -0.40 -0.10 -0.63 -0.54 0.00 0.00 174.62 172.92 1qi9 s ILE 539 N -1.90 1.52 -1.56 2.99 -1.09 -0.37 -2.15 121.20 118.64 1qi9 s ILE 539 Ca 0.02 -0.89 -0.10 0.00 -2.23 0.00 0.00 60.65 57.44 1qi9 s ILE 539 Cb -0.06 -1.61 0.08 0.00 -1.58 0.00 0.00 42.46 39.30 1qi9 s ILE 539 CO 0.01 0.19 0.68 0.47 -1.23 0.00 0.00 174.94 175.06 1qi9 n ASP 540 N 4.73 -2.36 0.00 3.58 8.00 0.54 -0.35 116.55 130.69 1qi9 n ASP 540 Ca -0.14 -0.97 0.00 0.00 0.71 0.00 0.00 54.79 54.39 1qi9 n ASP 540 Cb 0.47 -3.08 0.00 0.00 -0.02 0.00 0.00 41.12 38.49 1qi9 n ASP 540 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qi9 n GLY 541 N -1.67 1.93 3.66 0.44 0.00 -1.26 -5.01 105.19 103.28 1qi9 n GLY 541 Ca -0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.55 1qi9 n GLY 541 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1qi9 s PHE 542 N -3.28 3.37 -0.01 1.61 5.36 0.53 -4.99 117.98 120.57 1qi9 s PHE 542 Ca 0.00 0.72 -0.30 0.00 -0.96 0.00 0.00 56.93 56.39 1qi9 s PHE 542 Cb 0.00 -2.62 -0.07 0.00 -0.34 0.00 0.00 43.02 39.99 1qi9 s PHE 542 CO 0.00 -0.07 1.71 0.21 -1.46 0.00 0.00 175.22 175.61 1qi9 s LYS 543 N 1.53 4.18 0.37 10.12 2.20 -1.26 -1.24 119.74 135.64 1qi9 s LYS 543 Ca 0.22 2.30 -0.25 0.00 -0.36 0.00 0.00 55.97 57.89 1qi9 s LYS 543 Cb -0.15 -3.93 -0.09 0.00 -1.51 0.00 0.00 37.83 32.14 1qi9 s LYS 543 CO 0.09 -0.84 1.03 0.00 -0.36 0.00 0.00 175.35 175.27 1qi9 h PRO 545 N 2.72 0.00 -7.33 0.00 0.13 -1.84 -3.45 132.00 122.23 1qi9 h PRO 545 Ca -0.48 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.19 1qi9 h PRO 545 Cb 1.21 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.50 1qi9 h PRO 545 CO 0.63 0.86 0.21 0.20 -0.23 0.00 0.00 178.00 179.66 1qi9 s GLY 546 N -4.63 1.59 0.05 1.56 0.00 -1.26 -4.94 107.32 99.68 1qi9 s GLY 546 Ca 0.01 -0.20 -0.20 0.00 0.00 0.00 0.00 44.72 44.33 1qi9 s GLY 546 CO 0.80 0.36 1.42 1.41 0.00 0.00 0.00 173.10 177.09 1qi9 h LEU 547 N -1.79 0.34 -8.85 0.66 3.38 -1.91 -3.47 115.31 103.68 1qi9 h LEU 547 Ca -0.53 -0.39 -0.42 0.00 0.09 0.00 0.00 57.88 56.63 1qi9 h LEU 547 Cb 1.31 -0.09 -0.14 0.00 0.09 0.00 0.00 40.66 41.82 1qi9 h LEU 547 CO 0.55 0.66 -0.73 0.68 0.09 0.00 0.00 178.44 179.70 1qi9 s VAL 548 N -4.64 1.61 0.12 1.22 -7.23 -1.26 -4.80 120.40 105.42 1qi9 s VAL 548 Ca -0.14 -2.18 -0.31 0.00 -1.81 0.00 0.00 61.98 57.55 1qi9 s VAL 548 Cb 0.06 -2.02 -0.07 0.00 0.56 0.00 0.00 36.38 34.91 1qi9 s VAL 548 CO 0.74 -0.62 1.26 -0.47 -0.31 0.00 0.00 175.10 175.70 1qi9 s TYR 549 N -3.05 3.36 -0.06 2.82 5.04 -1.26 -4.91 117.35 119.29 1qi9 s TYR 549 Ca 0.22 1.23 0.11 0.00 -2.44 0.00 0.00 57.07 56.18 1qi9 s TYR 549 Cb 0.00 -3.51 0.20 0.00 0.35 0.00 0.00 41.96 39.00 1qi9 s TYR 549 CO 0.06 -1.63 1.09 0.25 -1.34 0.00 0.00 175.55 173.99 1qi9 n THR 550 N 3.45 0.77 0.00 4.34 -2.24 -1.26 -4.84 114.28 114.50 1qi9 n THR 550 Ca 0.08 -1.16 0.00 0.00 -2.27 0.00 0.00 64.05 60.70 1qi9 n THR 550 Cb 0.44 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 68.97 1qi9 n THR 550 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qi9 n GLY 551 N -0.44 3.13 0.32 3.38 0.00 -1.26 -4.75 105.19 105.57 1qi9 n GLY 551 Ca 0.08 -1.80 0.07 0.00 0.00 0.00 0.00 46.02 44.37 1qi9 n GLY 551 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1qi9 h VAL 552 N 0.00 0.79 0.00 1.61 2.07 -1.99 -2.31 116.25 116.41 1qi9 h VAL 552 Ca 0.00 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1qi9 h VAL 552 Cb 0.00 -0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 29.77 1qi9 h VAL 552 CO 0.00 0.13 -0.06 -0.33 0.02 0.00 0.00 177.57 177.34 1qi9 h GLU 553 N 0.73 0.00 -0.01 1.57 4.39 -2.05 -2.08 114.58 117.14 1qi9 h GLU 553 Ca 0.47 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.17 1qi9 h GLU 553 Cb 0.61 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1qi9 h GLU 553 CO -0.33 0.06 -0.11 0.09 -1.16 0.00 0.00 179.01 177.56 1qi9 n ASN 554 N -3.77 0.85 -4.35 1.42 3.02 -0.87 -4.55 115.26 107.01 1qi9 n ASN 554 Ca -0.02 -0.95 -0.45 0.00 -0.03 0.00 0.00 54.58 53.12 1qi9 n ASN 554 Cb 0.15 0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.33 1qi9 n ASN 554 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64