#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 -5.17 -2.08 -0.32 0.00 3.41 -1.26 -4.95 113.62 103.25 1qi9 n SER 4 Ca 0.07 0.48 0.10 0.00 -0.26 0.00 0.00 58.87 59.26 1qi9 n SER 4 Cb 0.57 2.13 -0.04 0.00 -0.26 0.00 0.00 64.21 66.61 1qi9 n SER 4 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1qi9 n THR 5 N -3.04 0.00 -3.88 6.66 -2.24 -1.26 -0.86 114.28 109.66 1qi9 n THR 5 Ca 0.00 -0.19 -0.09 0.00 -2.27 0.00 0.00 64.05 61.49 1qi9 n THR 5 Cb 0.00 1.16 -0.08 0.00 -2.10 0.00 0.00 70.33 69.31 1qi9 n THR 5 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1qi9 s SER 6 N -2.53 0.12 0.00 3.42 0.15 -1.26 -4.48 113.70 109.12 1qi9 s SER 6 Ca 0.14 -0.53 0.00 0.00 0.70 0.00 0.00 55.95 56.26 1qi9 s SER 6 Cb 0.16 0.29 0.00 0.00 -1.71 0.00 0.00 66.02 64.76 1qi9 s SER 6 CO 0.63 -0.60 0.00 -0.90 1.20 0.00 0.00 173.24 173.57 1qi9 n ASP 7 N 0.44 0.00 -0.38 5.45 5.68 -1.26 -4.74 116.55 121.74 1qi9 n ASP 7 Ca -0.17 -0.39 0.13 0.00 -0.50 0.00 0.00 54.79 53.86 1qi9 n ASP 7 Cb 0.60 0.00 0.45 0.00 -1.14 0.00 0.00 41.12 41.03 1qi9 n ASP 7 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1qi9 n ASP 8 N -0.39 1.29 -4.79 -1.12 8.00 -1.26 -4.90 116.55 113.39 1qi9 n ASP 8 Ca 0.00 -1.22 -0.35 0.00 0.71 0.00 0.00 54.79 53.92 1qi9 n ASP 8 Cb 0.00 0.06 -0.04 0.00 -0.02 0.00 0.00 41.12 41.12 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 -2.23 3.03 -1.32 2.24 0.00 -1.26 -4.94 121.76 117.28 1qi9 s ALA 9 Ca 0.32 0.63 -0.12 0.00 0.00 0.00 0.00 51.96 52.79 1qi9 s ALA 9 Cb 0.20 -3.25 0.13 0.00 0.00 0.00 0.00 23.12 20.20 1qi9 s ALA 9 CO 0.42 -0.17 1.91 -0.25 0.00 0.00 0.00 175.76 177.67 1qi9 n ASP 10 N -0.32 4.77 -3.73 0.00 8.00 -1.26 -4.87 116.55 119.15 1qi9 n ASP 10 Ca 0.06 -3.01 -0.22 0.00 0.71 0.00 0.00 54.79 52.33 1qi9 n ASP 10 Cb 0.51 -1.55 -0.18 0.00 -0.02 0.00 0.00 41.12 39.88 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 1.93 1.51 0.47 -2.24 -1.08 -1.26 -5.05 116.67 110.96 1qi9 s ASP 11 Ca 0.43 -0.08 0.17 0.00 -0.52 0.00 0.00 52.55 52.55 1qi9 s ASP 11 Cb 0.09 -0.33 1.16 0.00 -1.46 0.00 0.00 42.92 42.38 1qi9 s ASP 11 CO -0.02 -0.23 2.02 -0.65 0.52 0.00 0.00 175.17 176.82 1qi9 h PRO 12 N 8.37 0.23 -6.43 4.34 0.11 -2.04 -3.41 132.00 133.16 1qi9 h PRO 12 Ca -0.16 -0.01 -0.53 0.00 0.11 0.00 0.00 66.00 65.40 1qi9 h PRO 12 Cb 1.12 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 1qi9 h PRO 12 CO 0.22 0.15 0.35 0.99 -0.21 0.00 0.00 178.00 179.50 1qi9 s THR 13 N -5.24 4.78 0.58 -1.15 2.01 -1.26 -5.02 115.64 110.33 1qi9 s THR 13 Ca -0.06 2.02 -0.19 0.00 0.31 0.00 0.00 61.69 63.76 1qi9 s THR 13 Cb 0.19 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.36 1qi9 s THR 13 CO 0.73 0.21 1.22 -2.84 -0.69 0.00 0.00 174.62 173.25 1qi9 s PRO 14 N 0.70 3.05 0.23 4.92 0.02 -1.26 -4.83 135.00 137.83 1qi9 s PRO 14 Ca 0.50 1.88 -0.11 0.00 0.02 0.00 0.00 61.00 63.29 1qi9 s PRO 14 Cb -0.21 -2.01 0.34 0.00 0.02 0.00 0.00 34.50 32.64 1qi9 s PRO 14 CO 0.28 -1.16 1.61 -1.35 -0.33 0.00 0.00 177.00 176.06 1qi9 h PRO 15 N 1.05 0.02 0.00 5.54 0.11 -1.78 0.21 132.00 137.16 1qi9 h PRO 15 Ca -0.50 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1qi9 h PRO 15 Cb 1.30 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1qi9 h PRO 15 CO 0.56 0.02 0.00 0.27 -0.21 0.00 0.00 178.00 178.63 1qi9 n ASN 16 N -5.45 0.00 -0.06 -2.05 6.94 -0.04 -2.53 115.26 112.07 1qi9 n ASN 16 Ca 0.11 -1.14 0.03 0.00 -0.02 0.00 0.00 54.58 53.55 1qi9 n ASN 16 Cb 0.41 0.00 -0.02 0.00 -2.36 0.00 0.00 39.78 37.81 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 -0.76 3.98 -0.01 -3.83 1.02 0.69 -4.73 120.64 117.00 1qi9 n GLU 17 Ca 0.10 -0.20 -0.03 0.00 -0.02 0.00 0.00 57.16 57.02 1qi9 n GLU 17 Cb 0.05 -0.84 0.22 0.00 -0.02 0.00 0.00 31.44 30.84 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 0.28 0.54 -0.19 3.49 3.08 -1.16 -1.21 114.38 119.21 1qi9 h ARG 18 Ca 0.00 -0.17 -0.04 0.00 0.07 0.00 0.00 59.98 59.83 1qi9 h ARG 18 Cb 0.16 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.16 1qi9 h ARG 18 CO 0.00 0.68 -0.06 0.38 -1.07 0.00 0.00 179.97 179.90 1qi9 h ASP 19 N 0.49 0.37 -0.68 7.04 2.03 -1.85 -2.38 116.42 121.45 1qi9 h ASP 19 Ca 0.09 -0.38 -0.08 0.00 -0.73 0.00 0.00 57.03 55.93 1qi9 h ASP 19 Cb 0.56 -0.10 -0.03 0.00 -0.83 0.00 0.00 39.33 38.93 1qi9 h ASP 19 CO 0.04 0.67 0.13 0.44 -1.03 0.00 0.00 179.24 179.48 1qi9 h ASP 20 N 0.07 1.06 -0.10 4.15 3.32 -1.78 -1.94 116.42 121.19 1qi9 h ASP 20 Ca 0.05 -0.25 -0.08 0.00 0.02 0.00 0.00 57.03 56.77 1qi9 h ASP 20 Cb 0.51 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.76 1qi9 h ASP 20 CO 0.02 1.04 -0.16 -0.33 -1.72 0.00 0.00 179.24 178.09 1qi9 h GLU 21 N 1.03 0.48 -0.25 3.56 5.08 -1.23 -0.52 114.58 122.73 1qi9 h GLU 21 Ca 0.21 -0.15 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 1qi9 h GLU 21 Cb 0.42 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 1qi9 h GLU 21 CO 0.01 0.62 -0.27 0.00 -1.00 0.00 0.00 179.01 178.37 1qi9 h ALA 22 N 1.40 0.36 -0.14 3.43 0.00 -1.17 -2.19 119.26 120.96 1qi9 h ALA 22 Ca 0.08 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.61 1qi9 h ALA 22 Cb 0.53 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1qi9 h ALA 22 CO 0.03 0.36 0.05 0.35 0.00 0.00 0.00 179.25 180.04 1qi9 h PHE 23 N 0.33 0.08 -0.55 0.00 3.57 -1.18 -2.44 116.94 116.75 1qi9 h PHE 23 Ca 0.04 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.58 1qi9 h PHE 23 Cb 0.83 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.52 1qi9 h PHE 23 CO 0.08 0.04 0.31 0.00 -2.23 0.00 0.00 178.31 176.51 1qi9 h ALA 24 N 1.09 0.71 -0.89 2.41 0.00 -1.03 0.12 119.26 121.67 1qi9 h ALA 24 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.00 1qi9 h ALA 24 Cb 0.04 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 1qi9 h ALA 24 CO -0.06 0.00 0.58 1.03 0.00 0.00 0.00 179.25 180.80 1qi9 h SER 25 N 0.61 0.98 -0.14 0.00 0.87 -1.21 -1.45 113.55 113.21 1qi9 h SER 25 Ca 0.23 -0.01 -0.23 0.00 -1.23 0.00 0.00 61.79 60.55 1qi9 h SER 25 Cb 0.08 -0.23 0.01 0.00 -0.44 0.00 0.00 62.40 61.82 1qi9 h SER 25 CO -0.13 0.69 -0.80 0.03 -0.53 0.00 0.00 176.83 176.09 1qi9 h ARG 26 N 1.15 0.79 -0.12 2.24 3.08 -0.91 -1.67 114.38 118.94 1qi9 h ARG 26 Ca 0.34 -0.66 -0.00 0.00 0.07 0.00 0.00 59.98 59.72 1qi9 h ARG 26 Cb -0.05 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1qi9 h ARG 26 CO -0.10 1.27 0.06 0.28 -1.07 0.00 0.00 179.97 180.41 1qi9 h VAL 27 N 0.54 1.11 -0.68 2.04 2.07 -0.86 -1.60 116.25 118.86 1qi9 h VAL 27 Ca -0.06 -0.33 0.05 0.00 0.82 0.00 0.00 66.70 67.19 1qi9 h VAL 27 Cb 1.44 1.12 -0.05 0.00 -1.52 0.00 0.00 31.29 32.27 1qi9 h VAL 27 CO 0.17 0.10 0.40 0.00 0.02 0.00 0.00 177.57 178.25 1qi9 h ALA 28 N 0.93 0.91 -0.41 1.67 0.00 -1.23 0.17 119.26 121.31 1qi9 h ALA 28 Ca 0.04 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1qi9 h ALA 28 Cb 0.11 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1qi9 h ALA 28 CO -0.01 0.10 0.23 0.00 0.00 0.00 0.00 179.25 179.58 1qi9 h ALA 29 N 1.34 0.52 -0.52 0.00 0.00 -0.93 -1.36 119.26 118.32 1qi9 h ALA 29 Ca 0.30 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 1qi9 h ALA 29 Cb 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1qi9 h ALA 29 CO -0.16 0.03 0.10 0.00 0.00 0.00 0.00 179.25 179.21 1qi9 h ALA 30 N 1.09 1.20 -0.48 0.00 0.00 -1.00 -2.16 119.26 117.91 1qi9 h ALA 30 Ca 0.14 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 1qi9 h ALA 30 Cb 0.03 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1qi9 h ALA 30 CO -0.03 0.54 -0.08 -0.22 0.00 0.00 0.00 179.25 179.47 1qi9 h LYS 31 N 0.77 0.86 -0.65 0.00 3.64 -0.13 0.13 116.57 121.20 1qi9 h LYS 31 Ca 0.17 -0.28 -0.06 0.00 -1.27 0.00 0.00 60.65 59.20 1qi9 h LYS 31 Cb 0.33 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 1qi9 h LYS 31 CO 0.00 0.91 0.15 -0.09 -2.27 0.00 0.00 179.45 178.15 1qi9 h ARG 32 N 0.78 1.02 -0.24 1.90 2.43 -0.98 -0.16 114.38 119.13 1qi9 h ARG 32 Ca 0.13 -0.24 -0.19 0.00 -0.81 0.00 0.00 59.98 58.88 1qi9 h ARG 32 Cb 0.58 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1qi9 h ARG 32 CO 0.04 0.91 -0.59 0.93 -1.51 0.00 0.00 179.97 179.75 1qi9 h GLU 33 N 0.97 0.80 0.39 0.20 4.39 -0.94 -0.42 114.58 119.97 1qi9 h GLU 33 Ca 0.20 -0.54 -0.01 0.00 0.34 0.00 0.00 59.36 59.36 1qi9 h GLU 33 Cb 0.36 0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 29.05 1qi9 h GLU 33 CO 0.00 1.16 -0.51 1.25 -1.16 0.00 0.00 179.01 179.75 1qi9 h LEU 34 N 0.60 -1.45 -0.95 1.33 5.85 -0.35 -1.36 115.31 118.98 1qi9 h LEU 34 Ca 0.00 0.13 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 1qi9 h LEU 34 Cb 1.20 0.50 -0.02 0.00 0.37 0.00 0.00 40.66 42.71 1qi9 h LEU 34 CO 0.13 -0.64 -0.04 -0.33 -0.34 0.00 0.00 178.44 177.22 1qi9 h GLU 35 N -0.93 0.72 0.00 1.25 5.08 -1.06 -2.62 114.58 117.01 1qi9 h GLU 35 Ca -0.04 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.05 1qi9 h GLU 35 Cb 0.84 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.00 1qi9 h GLU 35 CO -0.13 0.76 -0.33 0.78 -1.00 0.00 0.00 179.01 179.09 1qi9 h GLY 36 N 0.96 0.00 0.00 -3.84 0.00 -0.97 -3.35 103.07 95.87 1qi9 h GLY 36 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1qi9 h GLY 36 CO 0.02 0.00 -0.13 -0.84 0.00 0.00 0.00 176.54 175.59 1qi9 h THR 37 N 0.00 0.00 0.00 4.70 2.02 -1.16 -3.43 112.91 115.04 1qi9 h THR 37 Ca -0.00 -0.81 0.00 0.00 0.77 0.00 0.00 66.41 66.37 1qi9 h THR 37 Cb 0.96 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1qi9 h THR 37 CO 0.04 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.54 1qi9 n GLY 38 N 1.76 1.95 3.60 2.16 0.00 -1.00 -4.53 105.19 109.13 1qi9 n GLY 38 Ca -0.02 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.06 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 5.04 -0.16 2.61 2.01 -1.26 -5.05 115.64 118.83 1qi9 s THR 39 Ca 0.00 0.74 -0.01 0.00 0.31 0.00 0.00 61.69 62.73 1qi9 s THR 39 Cb 0.00 -3.88 -0.01 0.00 0.01 0.00 0.00 72.50 68.62 1qi9 s THR 39 CO 0.00 -0.02 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.12 1qi9 s VAL 40 N 2.37 3.20 -0.36 3.82 1.01 -1.26 -5.10 120.40 124.08 1qi9 s VAL 40 Ca 0.21 -0.59 -0.12 0.00 0.00 0.00 0.00 61.98 61.48 1qi9 s VAL 40 Cb -0.15 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.85 1qi9 s VAL 40 CO 0.11 0.50 0.21 0.00 0.00 0.00 0.00 175.10 175.92 1qi9 s GLN 42 N 1.62 4.28 -0.11 0.00 -1.52 -1.26 -5.00 119.66 117.68 1qi9 s GLN 42 Ca 0.04 1.04 0.02 0.00 -1.95 0.00 0.00 55.36 54.51 1qi9 s GLN 42 Cb -0.18 -3.59 0.01 0.00 -0.22 0.00 0.00 33.01 29.03 1qi9 s GLN 42 CO 0.08 -0.39 -0.16 0.42 -0.25 0.00 0.00 175.29 174.99 1qi9 s ILE 43 N 2.36 1.53 0.30 1.08 -1.09 -1.26 -5.13 121.20 118.99 1qi9 s ILE 43 Ca 0.38 -0.67 0.03 0.00 -2.23 0.00 0.00 60.65 58.17 1qi9 s ILE 43 Cb -0.16 -1.39 0.03 0.00 -1.58 0.00 0.00 42.46 39.36 1qi9 s ILE 43 CO 0.11 0.45 0.26 -0.46 -1.23 0.00 0.00 174.94 174.07 1qi9 n ASN 44 N 4.12 1.78 0.00 3.58 0.23 -1.26 -3.99 115.26 119.72 1qi9 n ASN 44 Ca -0.19 -1.98 0.12 0.00 -0.53 0.00 0.00 54.58 52.00 1qi9 n ASN 44 Cb 0.51 -0.06 0.67 0.00 -2.08 0.00 0.00 39.78 38.82 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 -2.06 0.00 0.00 0.53 0.23 -1.26 -4.84 115.26 107.86 1qi9 n ASN 45 Ca 0.01 -0.46 0.00 0.00 -0.53 0.00 0.00 54.58 53.60 1qi9 n ASN 45 Cb 0.33 -0.12 0.00 0.00 -2.08 0.00 0.00 39.78 37.91 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 0.60 0.46 3.77 4.83 0.00 -1.26 -4.96 105.19 108.64 1qi9 n GLY 46 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.57 4.17 -0.00 1.61 -1.05 -1.26 -4.95 118.70 116.65 1qi9 s GLU 47 Ca 0.00 1.85 0.21 0.00 -0.15 0.00 0.00 54.97 56.88 1qi9 s GLU 47 Cb 0.00 -2.78 -0.22 0.00 -0.44 0.00 0.00 34.13 30.69 1qi9 s GLU 47 CO 0.00 -0.22 0.83 0.25 0.95 0.00 0.00 175.26 177.07 1qi9 n THR 48 N 0.29 0.01 -1.67 1.83 -2.24 -1.26 -4.99 114.28 106.25 1qi9 n THR 48 Ca 0.03 -0.12 -0.47 0.00 -2.27 0.00 0.00 64.05 61.23 1qi9 n THR 48 Cb 0.46 0.74 -0.04 0.00 -2.10 0.00 0.00 70.33 69.38 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 -1.68 3.30 0.24 3.42 2.03 -1.26 -4.86 116.55 117.74 1qi9 n ASP 49 Ca 0.02 1.03 0.16 0.00 0.52 0.00 0.00 54.79 56.52 1qi9 n ASP 49 Cb 0.38 -1.41 0.64 0.00 -0.72 0.00 0.00 41.12 40.02 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 7.49 0.00 -1.83 -2.67 3.38 -1.96 -1.98 115.31 117.74 1qi9 h LEU 50 Ca -0.47 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 1qi9 h LEU 50 Cb 1.26 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.01 1qi9 h LEU 50 CO 0.92 0.00 -0.14 0.00 0.09 0.00 0.00 178.44 179.30 1qi9 h ALA 51 N 2.08 1.40 -0.50 1.53 0.00 -1.98 -2.25 119.26 119.54 1qi9 h ALA 51 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1qi9 h ALA 51 Cb 0.46 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1qi9 h ALA 51 CO 0.00 0.18 0.00 0.00 0.00 0.00 0.00 179.25 179.43 1qi9 n ALA 52 N -2.35 2.65 -2.66 0.00 0.00 -0.74 -4.78 120.51 112.63 1qi9 n ALA 52 Ca -0.02 -1.01 -0.25 0.00 0.00 0.00 0.00 53.44 52.17 1qi9 n ALA 52 Cb 0.24 -0.99 -0.07 0.00 0.00 0.00 0.00 19.45 18.63 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 -1.51 2.35 -0.03 0.00 -0.14 -0.85 -2.39 119.74 117.18 1qi9 s LYS 53 Ca 0.36 -1.27 -0.30 0.00 -1.36 0.00 0.00 55.97 53.40 1qi9 s LYS 53 Cb 0.21 -2.26 -0.03 0.00 -1.68 0.00 0.00 37.83 34.07 1qi9 s LYS 53 CO 0.21 0.41 1.05 0.12 -0.76 0.00 0.00 175.35 176.37 1qi9 s PHE 54 N -2.04 3.52 0.00 3.18 5.36 0.32 -4.09 117.98 124.24 1qi9 s PHE 54 Ca 0.29 1.55 0.06 0.00 -0.96 0.00 0.00 56.93 57.88 1qi9 s PHE 54 Cb -0.08 -3.22 0.11 0.00 -0.34 0.00 0.00 43.02 39.49 1qi9 s PHE 54 CO 0.19 -0.43 1.02 -2.39 -1.46 0.00 0.00 175.22 172.15 1qi9 n HIS 55 N 4.41 0.00 -1.72 10.12 1.44 -1.26 -4.98 115.22 123.22 1qi9 n HIS 55 Ca 0.08 -0.47 -0.43 0.00 -2.01 0.00 0.00 57.72 54.90 1qi9 n HIS 55 Cb 0.49 0.32 -0.02 0.00 0.12 0.00 0.00 29.99 30.89 1qi9 n HIS 55 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 1qi9 n LYS 56 N 0.12 2.58 0.00 -1.40 4.81 -1.26 -2.33 118.16 120.68 1qi9 n LYS 56 Ca -0.18 0.92 0.00 0.00 -0.87 0.00 0.00 58.31 58.19 1qi9 n LYS 56 Cb 0.80 -2.70 0.00 0.00 0.02 0.00 0.00 35.03 33.15 1qi9 n LYS 56 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 1qi9 n SER 57 N 2.63 0.00 -4.75 3.14 3.41 0.20 -4.91 113.62 113.33 1qi9 n SER 57 Ca 0.11 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.44 1qi9 n SER 57 Cb 0.35 0.00 0.10 0.00 -0.26 0.00 0.00 64.21 64.40 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 2.68 0.15 1.04 1.02 -0.99 -0.77 118.68 121.82 1qi9 s LEU 58 Ca 0.00 0.50 -0.31 0.00 0.02 0.00 0.00 54.13 54.34 1qi9 s LEU 58 Cb 0.00 -2.95 -0.08 0.00 0.02 0.00 0.00 46.19 43.18 1qi9 s LEU 58 CO 0.00 -1.95 1.35 -2.84 0.02 0.00 0.00 176.35 172.93 1qi9 s PRO 59 N -5.49 4.35 0.21 1.29 0.02 -1.26 -3.76 135.00 130.36 1qi9 s PRO 59 Ca 0.64 2.06 0.08 0.00 0.02 0.00 0.00 61.00 63.80 1qi9 s PRO 59 Cb -0.09 -3.23 -0.05 0.00 0.02 0.00 0.00 34.50 31.15 1qi9 s PRO 59 CO 0.48 -0.36 -0.15 -1.01 -0.33 0.00 0.00 177.00 175.62 1qi9 s HIS 60 N 0.71 1.80 0.31 6.54 3.76 -1.26 -1.66 115.29 125.49 1qi9 s HIS 60 Ca 0.61 -0.53 -0.05 0.00 -0.15 0.00 0.00 55.06 54.94 1qi9 s HIS 60 Cb -0.37 -0.83 0.07 0.00 1.11 0.00 0.00 32.58 32.57 1qi9 s HIS 60 CO 0.33 0.41 0.37 -0.40 -0.85 0.00 0.00 174.74 174.61 1qi9 n ASP 61 N -0.39 -0.37 0.00 1.40 5.68 -0.17 -4.87 116.55 117.83 1qi9 n ASP 61 Ca -0.08 -1.01 0.14 0.00 -0.50 0.00 0.00 54.79 53.34 1qi9 n ASP 61 Cb 0.60 -0.30 0.82 0.00 -1.14 0.00 0.00 41.12 41.10 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 -3.34 0.00 -1.30 -1.12 8.00 -1.26 -1.72 116.55 115.81 1qi9 n ASP 62 Ca 0.05 -0.74 0.09 0.00 0.71 0.00 0.00 54.79 54.89 1qi9 n ASP 62 Cb 0.17 -0.05 0.31 0.00 -0.02 0.00 0.00 41.12 41.52 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 -1.05 4.24 -0.59 0.64 4.77 -1.26 -4.93 117.00 118.81 1qi9 n LEU 63 Ca 0.20 -2.39 -0.08 0.00 -0.03 0.00 0.00 56.01 53.71 1qi9 n LEU 63 Cb 0.12 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.68 1qi9 n LEU 63 CO 0.17 0.80 -0.07 0.61 -1.33 0.00 0.00 177.39 177.57 1qi9 n GLY 64 N 0.86 0.94 3.68 -0.72 0.00 -0.70 -4.90 105.19 104.36 1qi9 n GLY 64 Ca 0.23 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.41 4.27 0.58 1.61 -0.21 -1.26 -4.80 119.66 117.44 1qi9 s GLN 65 Ca 0.00 0.56 -0.20 0.00 0.02 0.00 0.00 55.36 55.74 1qi9 s GLN 65 Cb 0.00 -3.52 -0.04 0.00 1.00 0.00 0.00 33.01 30.45 1qi9 s GLN 65 CO 0.00 -0.08 1.31 0.54 -2.12 0.00 0.00 175.29 174.94 1qi9 s VAL 66 N 1.39 2.18 0.06 1.09 0.11 -1.26 -1.00 120.40 122.96 1qi9 s VAL 66 Ca 0.28 0.12 -0.31 0.00 -2.93 0.00 0.00 61.98 59.15 1qi9 s VAL 66 Cb -0.16 -3.06 -0.06 0.00 -1.53 0.00 0.00 36.38 31.58 1qi9 s VAL 66 CO 0.11 -0.01 1.27 -0.62 -3.33 0.00 0.00 175.10 172.52 1qi9 s ASP 67 N -1.18 6.99 0.11 3.54 2.15 -0.66 -4.85 116.67 122.76 1qi9 s ASP 67 Ca 0.75 2.08 -0.27 0.00 0.43 0.00 0.00 52.55 55.55 1qi9 s ASP 67 Cb -0.38 -2.58 -0.10 0.00 -0.30 0.00 0.00 42.92 39.57 1qi9 s ASP 67 CO 0.43 -0.56 1.65 0.00 -0.17 0.00 0.00 175.17 176.52 1qi9 h ALA 68 N 6.99 -0.43 -0.45 3.66 0.00 -1.93 -0.86 119.26 126.24 1qi9 h ALA 68 Ca -0.41 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.49 1qi9 h ALA 68 Cb 1.20 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 19.31 1qi9 h ALA 68 CO 0.84 -0.78 0.23 -0.44 0.00 0.00 0.00 179.25 179.10 1qi9 h ASP 69 N -0.46 0.33 -0.59 0.00 3.32 -2.00 -2.14 116.42 114.89 1qi9 h ASP 69 Ca 0.02 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1qi9 h ASP 69 Cb 0.46 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 39.94 1qi9 h ASP 69 CO -0.10 0.24 0.38 0.00 -1.72 0.00 0.00 179.24 178.04 1qi9 h ALA 70 N 1.24 0.75 -0.77 3.45 0.00 -1.87 -1.46 119.26 120.60 1qi9 h ALA 70 Ca 0.20 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1qi9 h ALA 70 Cb 0.10 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 1qi9 h ALA 70 CO -0.14 0.20 0.36 0.35 0.00 0.00 0.00 179.25 180.02 1qi9 h PHE 71 N 0.80 1.12 -0.24 0.00 3.57 -0.77 -0.70 116.94 120.72 1qi9 h PHE 71 Ca 0.22 -0.06 -0.06 0.00 3.53 0.00 0.00 57.97 61.60 1qi9 h PHE 71 Cb -0.07 -0.35 -0.01 0.00 2.79 0.00 0.00 35.95 38.31 1qi9 h PHE 71 CO -0.03 0.82 -0.13 0.00 -2.23 0.00 0.00 178.31 176.74 1qi9 h ALA 72 N 1.29 1.33 -0.02 2.41 0.00 -1.13 -0.79 119.26 122.35 1qi9 h ALA 72 Ca 0.27 -0.25 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1qi9 h ALA 72 Cb 0.13 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1qi9 h ALA 72 CO -0.03 0.45 -0.58 0.00 0.00 0.00 0.00 179.25 179.09 1qi9 h ALA 73 N 1.49 1.01 -0.41 0.00 0.00 -0.62 -1.96 119.26 118.77 1qi9 h ALA 73 Ca 0.07 -0.53 -0.12 0.00 0.00 0.00 0.00 54.91 54.34 1qi9 h ALA 73 Cb 0.46 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1qi9 h ALA 73 CO 0.03 0.72 -0.21 1.25 0.00 0.00 0.00 179.25 181.04 1qi9 h LEU 74 N 0.04 0.89 -1.02 0.00 5.85 -0.05 -1.79 115.31 119.23 1qi9 h LEU 74 Ca -0.01 -0.41 -0.04 0.00 0.84 0.00 0.00 57.88 58.27 1qi9 h LEU 74 Cb 1.04 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.79 1qi9 h LEU 74 CO 0.08 1.10 0.21 -0.33 -0.34 0.00 0.00 178.44 179.17 1qi9 h GLU 75 N 0.68 0.92 -0.27 1.25 5.08 -0.99 0.65 114.58 121.89 1qi9 h GLU 75 Ca 0.09 -0.16 0.04 0.00 -1.00 0.00 0.00 59.36 58.33 1qi9 h GLU 75 Cb 0.77 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.83 1qi9 h GLU 75 CO 0.06 0.78 0.02 0.22 -1.00 0.00 0.00 179.01 179.09 1qi9 h ASP 76 N 0.90 -0.05 -0.13 1.42 3.58 -1.09 -2.17 116.42 118.87 1qi9 h ASP 76 Ca 0.21 0.05 -0.00 0.00 0.42 0.00 0.00 57.03 57.71 1qi9 h ASP 76 Cb 0.22 0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.35 1qi9 h ASP 76 CO -0.01 0.01 0.08 0.00 -2.88 0.00 0.00 179.24 176.43 1qi9 h ILE 78 N 0.14 1.21 -0.27 0.00 2.04 -0.64 -3.24 117.51 116.76 1qi9 h ILE 78 Ca 0.05 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.40 1qi9 h ILE 78 Cb 0.03 0.14 -0.01 0.00 -0.74 0.00 0.00 36.82 36.24 1qi9 h ILE 78 CO -0.01 0.22 -0.02 0.25 0.00 0.00 0.00 178.15 178.60 1qi9 h LEU 79 N 1.05 0.48 -0.39 1.44 5.85 -1.34 -3.39 115.31 119.01 1qi9 h LEU 79 Ca 0.28 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.67 1qi9 h LEU 79 Cb -0.05 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.85 1qi9 h LEU 79 CO -0.05 0.68 -0.18 0.59 -0.34 0.00 0.00 178.44 179.14 1qi9 n ASN 80 N -4.59 0.78 -4.11 1.25 3.02 -0.98 -4.97 115.26 105.66 1qi9 n ASN 80 Ca -0.03 -0.76 -0.32 0.00 -0.03 0.00 0.00 54.58 53.43 1qi9 n ASN 80 Cb 0.26 0.03 -0.02 0.00 -0.61 0.00 0.00 39.78 39.44 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 1.31 -0.37 2.96 7.41 0.00 -1.25 -4.94 105.19 110.30 1qi9 n GLY 81 Ca 0.13 0.15 -0.28 0.00 0.00 0.00 0.00 46.02 46.02 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 -3.66 2.34 0.15 1.61 -1.08 -1.26 -5.03 116.67 109.74 1qi9 s ASP 82 Ca 0.48 -0.37 -0.16 0.00 -0.52 0.00 0.00 52.55 51.98 1qi9 s ASP 82 Cb -0.26 -0.96 0.06 0.00 -1.46 0.00 0.00 42.92 40.29 1qi9 s ASP 82 CO 0.91 -0.08 1.76 -0.07 0.52 0.00 0.00 175.17 178.20 1qi9 h LEU 83 N 8.04 0.16 -0.92 -1.34 3.38 -1.96 -2.43 115.31 120.24 1qi9 h LEU 83 Ca -0.33 0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.70 1qi9 h LEU 83 Cb 1.14 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 41.85 1qi9 h LEU 83 CO 0.45 0.13 0.61 -1.28 0.09 0.00 0.00 178.44 178.44 1qi9 h SER 84 N 0.30 1.03 -0.41 -0.43 0.87 -1.99 -1.40 113.55 111.51 1qi9 h SER 84 Ca 0.16 -0.02 -0.11 0.00 -1.23 0.00 0.00 61.79 60.60 1qi9 h SER 84 Cb 0.12 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.82 1qi9 h SER 84 CO -0.15 0.73 -0.13 0.40 -0.53 0.00 0.00 176.83 177.15 1qi9 h ILE 85 N 1.21 1.26 0.00 2.23 2.04 -1.91 -2.52 117.51 119.82 1qi9 h ILE 85 Ca 0.35 -1.24 -0.04 0.00 1.00 0.00 0.00 64.86 64.94 1qi9 h ILE 85 Cb -0.08 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.03 1qi9 h ILE 85 CO -0.10 0.43 -0.18 0.00 0.00 0.00 0.00 178.15 178.30 1qi9 n GLU 87 N -4.07 0.16 0.00 0.00 -0.58 -0.58 -2.69 120.64 112.88 1qi9 n GLU 87 Ca -0.02 0.32 0.13 0.00 -0.42 0.00 0.00 57.16 57.17 1qi9 n GLU 87 Cb 0.26 -1.76 0.46 0.00 -0.57 0.00 0.00 31.44 29.83 1qi9 n GLU 87 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 1qi9 n ASP 88 N -2.05 0.76 -4.69 1.62 8.00 -0.23 -4.86 116.55 115.11 1qi9 n ASP 88 Ca 0.03 -0.70 -0.42 0.00 0.71 0.00 0.00 54.79 54.41 1qi9 n ASP 88 Cb 0.26 0.05 -0.03 0.00 -0.02 0.00 0.00 41.12 41.38 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 -2.53 3.99 0.61 2.53 1.01 -1.09 -4.97 120.40 119.95 1qi9 s VAL 89 Ca 0.25 1.34 -0.19 0.00 0.00 0.00 0.00 61.98 63.38 1qi9 s VAL 89 Cb 0.19 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.68 1qi9 s VAL 89 CO 0.51 -0.01 1.24 -2.65 0.00 0.00 0.00 175.10 174.20 1qi9 n PRO 90 N 5.35 1.23 -4.51 2.72 -0.02 -1.26 -5.03 135.00 133.47 1qi9 n PRO 90 Ca 0.12 0.47 -0.31 0.00 -2.02 0.00 0.00 63.50 61.76 1qi9 n PRO 90 Cb 0.45 -2.46 -0.11 0.00 -0.02 0.00 0.00 33.50 31.35 1qi9 n PRO 90 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1qi9 s VAL 91 N -1.38 3.27 -1.93 -1.45 0.11 -1.26 -4.46 120.40 113.30 1qi9 s VAL 91 Ca 0.78 -1.00 0.28 0.00 -2.93 0.00 0.00 61.98 59.11 1qi9 s VAL 91 Cb -0.40 -2.42 0.44 0.00 -1.53 0.00 0.00 36.38 32.47 1qi9 s VAL 91 CO 0.44 0.34 1.74 0.61 -3.33 0.00 0.00 175.10 174.90 1qi9 n GLY 92 N 1.45 -0.58 3.00 6.54 0.00 0.05 -4.38 105.19 111.27 1qi9 n GLY 92 Ca -0.15 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.38 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 -2.33 -0.13 -0.20 1.61 3.84 -0.61 -4.78 114.94 112.34 1qi9 s ASN 93 Ca 0.31 0.44 0.12 0.00 0.21 0.00 0.00 52.86 53.94 1qi9 s ASN 93 Cb 0.20 0.34 0.70 0.00 -0.55 0.00 0.00 41.25 41.94 1qi9 s ASN 93 CO 0.45 -0.17 1.56 -1.54 -2.79 0.00 0.00 177.10 174.61 1qi9 n SER 94 N 4.33 5.02 0.00 -4.21 3.41 -1.26 -4.48 113.62 116.43 1qi9 n SER 94 Ca -0.24 -2.78 0.14 0.00 -0.26 0.00 0.00 58.87 55.73 1qi9 n SER 94 Cb 0.52 -0.66 0.75 0.00 -0.26 0.00 0.00 64.21 64.57 1qi9 n SER 94 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1qi9 n GLU 95 N 0.55 0.51 -1.31 4.33 1.02 -1.26 -4.92 120.64 119.56 1qi9 n GLU 95 Ca 0.24 0.01 -0.11 0.00 -0.02 0.00 0.00 57.16 57.28 1qi9 n GLU 95 Cb 1.05 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.93 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 1.10 1.18 3.77 0.62 0.00 -1.26 -4.99 105.19 105.61 1qi9 n GLY 96 Ca 0.15 -0.48 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.83 6.71 0.57 1.61 -1.08 -1.26 -4.91 116.67 115.48 1qi9 s ASP 97 Ca 0.00 2.30 0.31 0.00 -0.52 0.00 0.00 52.55 54.64 1qi9 s ASP 97 Cb 0.00 -2.61 1.74 0.00 -1.46 0.00 0.00 42.92 40.59 1qi9 s ASP 97 CO 0.00 -0.54 2.19 -0.65 0.52 0.00 0.00 175.17 176.69 1qi9 h PRO 98 N 2.87 0.00 0.00 4.34 0.11 -1.94 -2.48 132.00 134.91 1qi9 h PRO 98 Ca -0.48 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1qi9 h PRO 98 Cb 1.23 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 1qi9 h PRO 98 CO 0.63 0.05 -0.03 -0.39 -0.21 0.00 0.00 178.00 178.06 1qi9 h VAL 99 N 0.00 0.11 0.00 3.15 -1.51 -1.91 -2.58 116.25 113.51 1qi9 h VAL 99 Ca -0.00 -0.40 0.00 0.00 -1.23 0.00 0.00 66.70 65.06 1qi9 h VAL 99 Cb 0.16 1.36 0.00 0.00 -2.13 0.00 0.00 31.29 30.68 1qi9 h VAL 99 CO 0.01 0.03 0.00 0.61 -1.23 0.00 0.00 177.57 176.98 1qi9 n GLY 100 N -0.37 -1.49 3.76 5.19 0.00 -0.93 -4.57 105.19 106.78 1qi9 n GLY 100 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 1qi9 n GLY 100 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qi9 s ARG 101 N -3.15 4.50 0.11 1.61 0.52 -0.98 -4.85 118.95 116.71 1qi9 s ARG 101 Ca 0.09 1.75 -0.31 0.00 -0.52 0.00 0.00 55.73 56.73 1qi9 s ARG 101 Cb 0.12 -3.02 -0.09 0.00 0.52 0.00 0.00 34.95 32.48 1qi9 s ARG 101 CO 0.50 0.10 1.65 -0.51 0.02 0.00 0.00 175.30 177.06 1qi9 s LEU 102 N -1.78 4.37 -0.94 2.53 1.43 -1.26 -4.61 118.68 118.42 1qi9 s LEU 102 Ca 0.48 2.58 -0.22 0.00 -1.03 0.00 0.00 54.13 55.94 1qi9 s LEU 102 Cb -0.30 -3.58 0.07 0.00 0.03 0.00 0.00 46.19 42.42 1qi9 s LEU 102 CO 0.38 -0.89 1.30 -0.69 0.23 0.00 0.00 176.35 176.69 1qi9 s VAL 103 N 2.10 4.17 -1.20 -1.59 1.01 -0.50 -4.62 120.40 119.76 1qi9 s VAL 103 Ca 0.74 -0.86 -0.21 0.00 0.00 0.00 0.00 61.98 61.64 1qi9 s VAL 103 Cb -0.42 -4.94 0.01 0.00 0.00 0.00 0.00 36.38 31.02 1qi9 s VAL 103 CO 0.32 -1.77 0.70 -3.20 0.00 0.00 0.00 175.10 171.16 1qi9 n ASN 104 N 8.16 -4.27 0.30 3.32 4.05 -1.26 -4.87 115.26 120.70 1qi9 n ASN 104 Ca 0.25 -1.09 0.17 0.00 0.45 0.00 0.00 54.58 54.35 1qi9 n ASN 104 Cb 0.50 -2.89 0.96 0.00 1.23 0.00 0.00 39.78 39.57 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 -2.07 0.00 -0.05 1.20 0.13 -1.96 -1.52 132.00 127.72 1qi9 h PRO 105 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1qi9 h PRO 105 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1qi9 h PRO 105 CO 0.51 0.02 0.00 0.25 -0.23 0.00 0.00 178.00 178.55 1qi9 n THR 106 N -3.64 0.06 -0.37 1.56 -2.24 -1.26 -4.44 114.28 103.95 1qi9 n THR 106 Ca -0.03 -0.26 0.04 0.00 -2.27 0.00 0.00 64.05 61.53 1qi9 n THR 106 Cb 0.10 0.41 0.19 0.00 -2.10 0.00 0.00 70.33 68.93 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 4.25 1.41 -0.84 6.98 0.00 -1.64 -3.03 119.26 126.38 1qi9 h ALA 107 Ca 0.00 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.05 1qi9 h ALA 107 Cb 0.47 -0.28 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 1qi9 h ALA 107 CO 0.00 0.38 0.55 0.00 0.00 0.00 0.00 179.25 180.18 1qi9 h ALA 108 N 1.47 1.98 0.00 0.00 0.00 -1.80 -3.32 119.26 117.60 1qi9 h ALA 108 Ca 0.45 0.01 -0.61 0.00 0.00 0.00 0.00 54.91 54.75 1qi9 h ALA 108 Cb 0.25 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.96 1qi9 h ALA 108 CO -0.20 -0.22 3.34 1.19 0.00 0.00 0.00 179.25 183.36 1qi9 n PHE 109 N -4.53 2.37 -3.67 0.00 3.72 -1.15 -4.76 117.46 109.45 1qi9 n PHE 109 Ca 0.17 -2.73 -0.17 0.00 -0.05 0.00 0.00 57.45 54.67 1qi9 n PHE 109 Cb 0.52 -2.27 -0.16 0.00 -0.94 0.00 0.00 39.48 36.64 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 2.85 -0.17 -0.61 4.37 0.00 -1.25 -5.10 121.76 121.84 1qi9 s ALA 110 Ca 0.58 0.57 -0.25 0.00 0.00 0.00 0.00 51.96 52.86 1qi9 s ALA 110 Cb 0.15 -0.83 0.04 0.00 0.00 0.00 0.00 23.12 22.49 1qi9 s ALA 110 CO -0.05 -0.57 1.05 0.42 0.00 0.00 0.00 175.76 176.61 1qi9 s ILE 111 N 2.30 4.20 0.38 0.00 1.01 -1.26 -4.74 121.20 123.08 1qi9 s ILE 111 Ca 0.03 0.31 -0.25 0.00 0.00 0.00 0.00 60.65 60.74 1qi9 s ILE 111 Cb -0.12 -4.66 -0.09 0.00 0.01 0.00 0.00 42.46 37.60 1qi9 s ILE 111 CO -0.06 -1.34 1.07 -1.81 0.00 0.00 0.00 174.94 172.80 1qi9 s ASP 112 N 3.16 6.80 0.24 3.58 1.01 -1.26 -4.93 116.67 125.27 1qi9 s ASP 112 Ca 0.32 2.11 0.03 0.00 0.71 0.00 0.00 52.55 55.72 1qi9 s ASP 112 Cb -0.12 -2.60 0.27 0.00 1.01 0.00 0.00 42.92 41.49 1qi9 s ASP 112 CO 0.18 -0.46 1.58 -0.29 0.21 0.00 0.00 175.17 176.39 1qi9 h ILE 113 N 2.34 1.36 -2.72 0.77 2.10 -1.99 -3.44 117.51 115.92 1qi9 h ILE 113 Ca -0.48 -1.83 -0.46 0.00 1.08 0.00 0.00 64.86 63.16 1qi9 h ILE 113 Cb 1.22 1.88 0.03 0.00 -1.09 0.00 0.00 36.82 38.85 1qi9 h ILE 113 CO 0.63 0.55 -0.11 -0.94 -1.08 0.00 0.00 178.15 177.20 1qi9 s SER 114 N -6.89 5.89 0.75 2.19 1.04 -1.26 -4.99 113.70 110.43 1qi9 s SER 114 Ca -0.05 0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.67 1qi9 s SER 114 Cb 0.12 -1.58 0.00 0.00 0.10 0.00 0.00 66.02 64.67 1qi9 s SER 114 CO 0.80 -0.65 0.00 0.61 0.98 0.00 0.00 173.24 174.98 1qi9 n GLY 115 N -2.04 -1.26 3.75 7.32 0.00 -1.26 -4.82 105.19 106.88 1qi9 n GLY 115 Ca 0.01 -1.08 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 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 -0.45 4.58 0.95 1.61 0.04 -1.26 -5.00 135.00 135.47 1qi9 s PRO 116 Ca 0.00 1.80 -0.11 0.00 0.04 0.00 0.00 61.00 62.73 1qi9 s PRO 116 Cb 0.00 -3.23 0.16 0.00 0.04 0.00 0.00 34.50 31.47 1qi9 s PRO 116 CO 0.00 0.08 1.11 0.00 0.04 0.00 0.00 177.00 178.23 1qi9 s ALA 117 N -0.56 1.17 0.42 8.56 0.00 -1.26 -4.89 121.76 125.20 1qi9 s ALA 117 Ca 0.48 0.34 0.11 0.00 0.00 0.00 0.00 51.96 52.89 1qi9 s ALA 117 Cb -0.31 -3.36 0.96 0.00 0.00 0.00 0.00 23.12 20.41 1qi9 s ALA 117 CO 0.38 -2.83 2.01 0.27 0.00 0.00 0.00 175.76 175.59 1qi9 h PHE 118 N -1.91 0.47 -0.59 0.00 -5.15 -1.89 -1.75 116.94 106.12 1qi9 h PHE 118 Ca -0.48 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.31 1qi9 h PHE 118 Cb 1.28 -0.15 0.00 0.00 0.22 0.00 0.00 35.95 37.29 1qi9 h PHE 118 CO 0.46 0.25 0.00 -1.13 -2.00 0.00 0.00 178.31 175.89 1qi9 n SER 119 N -4.47 4.33 -0.03 -0.68 3.41 -1.26 -4.43 113.62 110.48 1qi9 n SER 119 Ca 0.07 -2.39 0.13 0.00 -0.26 0.00 0.00 58.87 56.43 1qi9 n SER 119 Cb 0.25 -0.55 0.43 0.00 -0.26 0.00 0.00 64.21 64.08 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 1.03 3.02 -2.42 7.33 0.00 -0.66 -4.81 120.51 124.00 1qi9 n ALA 120 Ca 0.23 -0.26 -0.21 0.00 0.00 0.00 0.00 53.44 53.20 1qi9 n ALA 120 Cb 0.81 -1.26 -0.10 0.00 0.00 0.00 0.00 19.45 18.89 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 -2.91 1.84 0.08 0.00 -4.23 -1.26 -4.99 115.64 104.17 1qi9 s THR 121 Ca 0.15 -2.20 -0.01 0.00 -1.18 0.00 0.00 61.69 58.46 1qi9 s THR 121 Cb 0.18 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.66 1qi9 s THR 121 CO 0.61 -0.40 -0.01 0.42 -0.54 0.00 0.00 174.62 174.70 1qi9 s THR 122 N -2.90 0.24 0.07 3.99 -4.23 -1.26 -4.99 115.64 106.57 1qi9 s THR 122 Ca 0.28 -1.85 0.03 0.00 -1.18 0.00 0.00 61.69 58.96 1qi9 s THR 122 Cb 0.01 -1.69 -0.03 0.00 1.34 0.00 0.00 72.50 72.13 1qi9 s THR 122 CO 0.11 -0.83 -0.09 0.27 -0.54 0.00 0.00 174.62 173.54 1qi9 s ILE 123 N -3.92 0.75 0.76 2.99 -4.36 -1.26 -4.93 121.20 111.24 1qi9 s ILE 123 Ca 0.12 -1.46 -0.13 0.00 -0.26 0.00 0.00 60.65 58.93 1qi9 s ILE 123 Cb 0.08 -1.11 0.06 0.00 1.25 0.00 0.00 42.46 42.73 1qi9 s ILE 123 CO -0.06 -0.52 1.14 -2.84 0.24 0.00 0.00 174.94 172.90 1qi9 s PRO 124 N -2.44 2.08 0.68 0.37 0.02 -1.26 -4.79 135.00 129.65 1qi9 s PRO 124 Ca 0.00 1.48 -0.17 0.00 0.02 0.00 0.00 61.00 62.34 1qi9 s PRO 124 Cb -0.05 -1.85 0.00 0.00 0.02 0.00 0.00 34.50 32.62 1qi9 s PRO 124 CO -0.01 -1.83 1.21 -2.30 -0.33 0.00 0.00 177.00 173.75 1qi9 n PRO 125 N -3.17 0.87 -2.94 5.54 -0.02 -1.26 -4.98 135.00 129.05 1qi9 n PRO 125 Ca 0.11 0.36 -0.33 0.00 -2.02 0.00 0.00 63.50 61.63 1qi9 n PRO 125 Cb 0.52 -2.45 -0.06 0.00 -0.02 0.00 0.00 33.50 31.49 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 -1.56 4.56 0.27 -1.45 1.01 -1.26 -4.90 120.40 117.06 1qi9 s VAL 126 Ca 0.80 1.17 -0.30 0.00 0.00 0.00 0.00 61.98 63.64 1qi9 s VAL 126 Cb -0.37 -3.62 -0.13 0.00 0.00 0.00 0.00 36.38 32.27 1qi9 s VAL 126 CO 0.43 -0.30 1.46 -2.65 0.00 0.00 0.00 175.10 174.05 1qi9 n PRO 127 N -0.62 2.29 -1.25 2.72 -0.02 -1.26 -4.52 135.00 132.34 1qi9 n PRO 127 Ca 0.05 0.81 -0.29 0.00 -2.02 0.00 0.00 63.50 62.05 1qi9 n PRO 127 Cb 0.54 -2.51 0.15 0.00 -0.02 0.00 0.00 33.50 31.66 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 -0.16 2.36 0.27 3.45 -4.23 -1.26 -4.78 115.64 111.28 1qi9 s THR 128 Ca 0.65 0.12 -0.03 0.00 -1.18 0.00 0.00 61.69 61.24 1qi9 s THR 128 Cb -0.58 -2.65 0.27 0.00 1.34 0.00 0.00 72.50 70.87 1qi9 s THR 128 CO 0.51 -0.15 1.91 0.25 -0.54 0.00 0.00 174.62 176.60 1qi9 h LEU 129 N -1.66 1.07 0.00 4.79 6.46 -1.96 -2.26 115.31 121.75 1qi9 h LEU 129 Ca -0.52 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.23 1qi9 h LEU 129 Cb 1.31 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 41.00 1qi9 h LEU 129 CO 0.57 0.73 0.00 -2.65 -0.62 0.00 0.00 178.44 176.47 1qi9 n PRO 130 N -4.45 0.30 -2.15 5.25 -0.02 -1.26 -4.46 135.00 128.21 1qi9 n PRO 130 Ca 0.14 0.02 -0.33 0.00 -2.02 0.00 0.00 63.50 61.31 1qi9 n PRO 130 Cb 0.11 -1.50 -0.00 0.00 -0.02 0.00 0.00 33.50 32.09 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 -2.68 5.95 0.35 2.55 1.04 -0.85 -3.48 113.70 116.57 1qi9 s SER 131 Ca 0.23 1.81 0.05 0.00 0.48 0.00 0.00 55.95 58.52 1qi9 s SER 131 Cb 0.19 -2.53 0.64 0.00 0.10 0.00 0.00 66.02 64.41 1qi9 s SER 131 CO 0.45 -1.05 1.90 1.55 0.98 0.00 0.00 173.24 177.07 1qi9 h PRO 132 N 0.64 0.53 -0.08 4.02 0.13 -1.90 -2.40 132.00 132.95 1qi9 h PRO 132 Ca -0.47 -0.10 -0.01 0.00 -0.87 0.00 0.00 66.00 64.55 1qi9 h PRO 132 Cb 1.22 -0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 1qi9 h PRO 132 CO 0.58 0.53 0.01 0.93 -0.23 0.00 0.00 178.00 179.81 1qi9 h GLU 133 N 0.52 0.14 -0.79 0.86 3.07 -1.92 -2.20 114.58 114.27 1qi9 h GLU 133 Ca 0.12 -0.04 0.06 0.00 -0.50 0.00 0.00 59.36 59.00 1qi9 h GLU 133 Cb 0.27 -0.01 -0.06 0.00 -0.84 0.00 0.00 28.75 28.10 1qi9 h GLU 133 CO 0.00 0.39 0.47 1.25 -1.40 0.00 0.00 179.01 179.72 1qi9 h LEU 134 N -0.12 0.73 -0.38 1.33 5.85 -1.74 -0.92 115.31 120.06 1qi9 h LEU 134 Ca 0.02 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.82 1qi9 h LEU 134 Cb 0.32 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 1qi9 h LEU 134 CO 0.00 0.47 0.12 0.00 -0.34 0.00 0.00 178.44 178.68 1qi9 h ALA 135 N 1.39 0.43 -0.20 1.25 0.00 -1.33 0.80 119.26 121.60 1qi9 h ALA 135 Ca 0.35 0.05 -0.15 0.00 0.00 0.00 0.00 54.91 55.17 1qi9 h ALA 135 Cb 0.18 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1qi9 h ALA 135 CO -0.18 -0.28 -0.49 0.00 0.00 0.00 0.00 179.25 178.30 1qi9 h ALA 136 N 1.26 0.78 -0.04 0.00 0.00 -0.99 0.33 119.26 120.60 1qi9 h ALA 136 Ca 0.18 -0.48 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 1qi9 h ALA 136 Cb 0.17 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 1qi9 h ALA 136 CO -0.20 0.67 0.02 1.96 0.00 0.00 0.00 179.25 181.70 1qi9 h GLN 137 N 0.42 0.05 -0.36 0.00 1.08 -0.73 -1.27 115.11 114.30 1qi9 h GLN 137 Ca 0.02 -0.01 -0.02 0.00 -1.45 0.00 0.00 58.65 57.20 1qi9 h GLN 137 Cb 1.01 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.42 1qi9 h GLN 137 CO 0.09 0.15 0.16 1.25 -0.95 0.00 0.00 178.83 179.53 1qi9 h LEU 138 N -0.06 0.49 -0.96 1.46 5.85 -0.81 -2.39 115.31 118.88 1qi9 h LEU 138 Ca 0.01 -0.15 0.05 0.00 0.84 0.00 0.00 57.88 58.64 1qi9 h LEU 138 Cb 0.12 -0.13 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 1qi9 h LEU 138 CO -0.00 0.50 0.62 0.00 -0.34 0.00 0.00 178.44 179.21 1qi9 h ALA 139 N 1.01 1.30 -0.90 1.25 0.00 -0.90 -1.44 119.26 119.57 1qi9 h ALA 139 Ca 0.12 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1qi9 h ALA 139 Cb 0.15 -0.31 -0.04 0.00 0.00 0.00 0.00 17.79 17.59 1qi9 h ALA 139 CO -0.01 0.44 0.57 1.49 0.00 0.00 0.00 179.25 181.74 1qi9 h GLU 140 N 1.16 1.21 -0.64 0.00 4.81 -0.73 0.15 114.58 120.54 1qi9 h GLU 140 Ca 0.40 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 59.48 1qi9 h GLU 140 Cb 0.09 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 29.18 1qi9 h GLU 140 CO -0.15 0.83 0.20 0.28 -0.73 0.00 0.00 179.01 179.44 1qi9 h VAL 141 N 1.24 1.25 -0.38 0.32 2.07 -1.03 -0.82 116.25 118.90 1qi9 h VAL 141 Ca 0.33 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.99 1qi9 h VAL 141 Cb -0.09 0.59 -0.02 0.00 -1.52 0.00 0.00 31.29 30.26 1qi9 h VAL 141 CO -0.07 0.32 0.19 1.88 0.02 0.00 0.00 177.57 179.92 1qi9 h TYR 142 N 0.91 0.54 -0.21 1.57 0.05 -0.47 -2.33 116.97 117.04 1qi9 h TYR 142 Ca 0.21 -0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.88 1qi9 h TYR 142 Cb 0.29 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.85 1qi9 h TYR 142 CO 0.02 0.45 -0.21 -1.49 -1.05 0.00 0.00 178.16 175.87 1qi9 h TRP 143 N 0.48 0.41 -0.68 4.88 4.06 -0.52 -1.36 115.95 123.21 1qi9 h TRP 143 Ca 0.13 -0.07 -0.01 0.00 2.06 0.00 0.00 58.89 61.00 1qi9 h TRP 143 Cb 0.10 -0.10 -0.03 0.00 -1.00 0.00 0.00 29.16 28.13 1qi9 h TRP 143 CO -0.02 0.57 0.38 0.52 -3.56 0.00 0.00 178.44 176.32 1qi9 h MET 144 N 0.34 0.95 -0.29 0.49 2.86 -0.87 0.12 114.93 118.53 1qi9 h MET 144 Ca 0.06 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.58 1qi9 h MET 144 Cb 0.57 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1qi9 h MET 144 CO 0.04 0.71 0.16 0.00 1.06 0.00 0.00 176.91 178.88 1qi9 h ALA 145 N 1.19 0.37 -0.06 6.32 0.00 -0.87 -1.17 119.26 125.03 1qi9 h ALA 145 Ca 0.24 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1qi9 h ALA 145 Cb 0.04 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1qi9 h ALA 145 CO -0.04 -0.11 -0.15 -0.07 0.00 0.00 0.00 179.25 178.89 1qi9 h LEU 146 N 0.35 0.09 -1.59 0.00 3.38 -1.01 -2.88 115.31 113.65 1qi9 h LEU 146 Ca 0.10 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1qi9 h LEU 146 Cb 0.05 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1qi9 h LEU 146 CO -0.02 0.25 0.00 0.00 0.09 0.00 0.00 178.44 178.77 1qi9 n ALA 147 N -2.50 2.48 -0.33 1.53 0.00 0.39 -4.61 120.51 117.47 1qi9 n ALA 147 Ca -0.02 -0.71 0.20 0.00 0.00 0.00 0.00 53.44 52.91 1qi9 n ALA 147 Cb 0.24 -1.00 0.42 0.00 0.00 0.00 0.00 19.45 19.11 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 3.08 0.34 -0.65 0.00 3.08 -1.02 -1.09 114.38 118.11 1qi9 h ARG 148 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1qi9 h ARG 148 Cb 0.68 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.65 1qi9 h ARG 148 CO 0.00 0.22 0.00 -0.25 -1.07 0.00 0.00 179.97 178.87 1qi9 n ASP 149 N -5.06 4.43 -4.68 7.04 8.00 -1.26 -1.39 116.55 123.63 1qi9 n ASP 149 Ca 0.29 -2.40 -0.40 0.00 0.71 0.00 0.00 54.79 52.98 1qi9 n ASP 149 Cb 0.87 -0.56 -0.06 0.00 -0.02 0.00 0.00 41.12 41.36 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 -1.82 5.04 0.31 2.53 1.01 -0.42 -5.01 120.40 122.05 1qi9 s VAL 150 Ca 0.47 1.22 -0.29 0.00 0.00 0.00 0.00 61.98 63.38 1qi9 s VAL 150 Cb 0.30 -3.95 -0.11 0.00 0.00 0.00 0.00 36.38 32.62 1qi9 s VAL 150 CO 0.23 0.17 1.48 -2.84 0.00 0.00 0.00 175.10 174.13 1qi9 s PRO 151 N 1.52 4.19 0.38 2.72 0.02 -1.26 -4.34 135.00 138.23 1qi9 s PRO 151 Ca 0.30 2.45 0.14 0.00 0.02 0.00 0.00 61.00 63.91 1qi9 s PRO 151 Cb -0.16 -3.03 0.97 0.00 0.02 0.00 0.00 34.50 32.30 1qi9 s PRO 151 CO 0.12 -0.48 1.83 0.74 -0.33 0.00 0.00 177.00 178.88 1qi9 h PHE 152 N 4.09 0.70 0.00 6.54 0.04 -1.63 0.18 116.94 126.86 1qi9 h PHE 152 Ca -0.48 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.31 1qi9 h PHE 152 Cb 1.23 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 39.16 1qi9 h PHE 152 CO 0.57 0.18 0.00 -1.33 -0.60 0.00 0.00 178.31 177.13 1qi9 n MET 153 N -4.58 0.32 -0.29 1.51 2.81 -1.26 -2.23 117.12 113.40 1qi9 n MET 153 Ca 0.20 0.07 0.09 0.00 -1.81 0.00 0.00 57.70 56.25 1qi9 n MET 153 Cb 0.65 -1.50 0.24 0.00 -0.71 0.00 0.00 33.22 31.90 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 -1.29 2.85 -0.15 0.03 6.02 0.64 -4.61 117.38 120.88 1qi9 n GLN 154 Ca 0.11 -2.38 0.01 0.00 -0.01 0.00 0.00 57.00 54.73 1qi9 n GLN 154 Cb 0.19 -1.44 0.28 0.00 1.02 0.00 0.00 30.24 30.29 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 3.10 0.82 0.00 1.08 -1.99 -1.45 -0.38 116.97 118.15 1qi9 h TYR 155 Ca 0.00 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.74 1qi9 h TYR 155 Cb 0.89 -0.27 0.00 0.00 2.00 0.00 0.00 36.73 39.35 1qi9 h TYR 155 CO 0.37 0.54 0.00 0.41 -0.00 0.00 0.00 178.16 179.49 1qi9 n GLY 156 N -1.35 -1.41 0.00 3.88 0.00 -1.26 -3.89 105.19 101.15 1qi9 n GLY 156 Ca 0.06 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1qi9 n GLY 156 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1qi9 n THR 157 N -2.17 0.00 -2.71 2.61 -2.24 -0.56 -4.86 114.28 104.35 1qi9 n THR 157 Ca 0.04 -0.31 -0.40 0.00 -2.27 0.00 0.00 64.05 61.10 1qi9 n THR 157 Cb 0.30 0.83 -0.05 0.00 -2.10 0.00 0.00 70.33 69.30 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 -1.21 7.57 0.23 3.42 -1.08 -0.26 -4.95 116.67 120.39 1qi9 s ASP 158 Ca 0.00 1.95 -0.06 0.00 -0.52 0.00 0.00 52.55 53.92 1qi9 s ASP 158 Cb 0.00 -2.61 0.37 0.00 -1.46 0.00 0.00 42.92 39.22 1qi9 s ASP 158 CO 0.00 0.07 1.76 -0.78 0.52 0.00 0.00 175.17 176.74 1qi9 h ASP 159 N 4.46 0.39 -0.40 -0.34 3.58 -1.91 -0.29 116.42 121.90 1qi9 h ASP 159 Ca -0.45 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.07 1qi9 h ASP 159 Cb 1.20 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 42.25 1qi9 h ASP 159 CO 0.69 0.20 0.20 0.40 -2.88 0.00 0.00 179.24 177.86 1qi9 h ILE 160 N 0.54 1.16 0.01 2.25 2.04 -1.95 -1.03 117.51 120.53 1qi9 h ILE 160 Ca 0.37 -0.45 -0.23 0.00 1.00 0.00 0.00 64.86 65.55 1qi9 h ILE 160 Cb 0.45 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.23 1qi9 h ILE 160 CO -0.31 0.17 -1.18 0.71 0.00 0.00 0.00 178.15 177.54 1qi9 h THR 161 N 0.51 1.51 -0.69 -0.27 1.35 -1.74 -0.39 112.91 113.18 1qi9 h THR 161 Ca 0.14 -3.24 -0.07 0.00 -0.55 0.00 0.00 66.41 62.69 1qi9 h THR 161 Cb 0.09 2.76 -0.03 0.00 -1.73 0.00 0.00 68.15 69.24 1qi9 h THR 161 CO -0.02 0.87 0.15 0.58 -0.25 0.00 0.00 175.52 176.85 1qi9 h VAL 162 N 0.01 1.26 -0.23 6.82 2.07 -1.06 -2.04 116.25 123.08 1qi9 h VAL 162 Ca -0.08 -0.99 -0.09 0.00 0.82 0.00 0.00 66.70 66.36 1qi9 h VAL 162 Cb 1.84 0.57 -0.00 0.00 -1.52 0.00 0.00 31.29 32.17 1qi9 h VAL 162 CO 0.12 0.38 -0.21 0.74 0.02 0.00 0.00 177.57 178.62 1qi9 h THR 163 N 1.06 1.32 -0.86 2.57 2.02 -1.20 -2.92 112.91 114.90 1qi9 h THR 163 Ca 0.22 -1.36 0.13 0.00 0.77 0.00 0.00 66.41 66.16 1qi9 h THR 163 Cb 0.39 1.69 -0.09 0.00 -1.74 0.00 0.00 68.15 68.41 1qi9 h THR 163 CO 0.01 0.42 0.47 0.00 0.37 0.00 0.00 175.52 176.79 1qi9 h ALA 164 N 0.67 1.27 -0.45 6.16 0.00 -0.93 0.25 119.26 126.24 1qi9 h ALA 164 Ca 0.04 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 1qi9 h ALA 164 Cb 0.75 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1qi9 h ALA 164 CO 0.05 0.01 -0.05 0.00 0.00 0.00 0.00 179.25 179.26 1qi9 h ALA 165 N 1.52 0.61 -0.46 0.00 0.00 -1.27 0.37 119.26 120.03 1qi9 h ALA 165 Ca 0.45 -0.30 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 1qi9 h ALA 165 Cb 0.54 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1qi9 h ALA 165 CO -0.31 0.45 -0.19 0.00 0.00 0.00 0.00 179.25 179.20 1qi9 h ALA 166 N 0.89 0.64 -0.23 0.00 0.00 -1.24 -2.43 119.26 116.88 1qi9 h ALA 166 Ca 0.12 -0.38 -0.19 0.00 0.00 0.00 0.00 54.91 54.46 1qi9 h ALA 166 Cb 0.57 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1qi9 h ALA 166 CO 0.03 0.60 -0.62 -0.97 0.00 0.00 0.00 179.25 178.30 1qi9 h ASN 167 N 0.78 0.91 -0.26 0.00 -0.73 -0.32 -2.67 115.58 113.29 1qi9 h ASN 167 Ca 0.11 -0.52 -0.14 0.00 1.87 0.00 0.00 56.30 57.62 1qi9 h ASN 167 Cb 0.76 -0.26 -0.00 0.00 0.27 0.00 0.00 38.32 39.09 1qi9 h ASN 167 CO 0.06 1.31 -0.37 -0.07 -0.37 0.00 0.00 177.43 177.99 1qi9 h LEU 168 N 0.59 0.77 -2.21 0.34 3.38 -0.99 -3.02 115.31 114.18 1qi9 h LEU 168 Ca -0.01 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.44 1qi9 h LEU 168 Cb 1.22 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 1qi9 h LEU 168 CO 0.13 1.13 -0.05 0.00 0.09 0.00 0.00 178.44 179.74 1qi9 h ALA 169 N 0.66 1.48 0.00 1.53 0.00 -1.40 -0.89 119.26 120.63 1qi9 h ALA 169 Ca 0.03 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1qi9 h ALA 169 Cb 0.96 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1qi9 h ALA 169 CO 0.09 0.07 -0.09 0.41 0.00 0.00 0.00 179.25 179.72 1qi9 n GLY 170 N -1.10 -1.48 3.73 0.00 0.00 -1.01 -4.84 105.19 100.49 1qi9 n GLY 170 Ca -0.03 -0.14 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.01 4.63 0.21 1.61 1.00 -0.34 -4.95 119.30 118.44 1qi9 s MET 171 Ca 0.13 1.60 -0.12 0.00 0.00 0.00 0.00 55.69 57.31 1qi9 s MET 171 Cb 0.18 -3.33 0.28 0.00 0.00 0.00 0.00 34.83 31.96 1qi9 s MET 171 CO 0.57 0.11 1.65 1.49 0.00 0.00 0.00 175.02 178.84 1qi9 h GLU 172 N 5.45 0.07 0.00 2.03 4.81 -1.88 -1.96 114.58 123.09 1qi9 h GLU 172 Ca -0.43 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.79 1qi9 h GLU 172 Cb 1.21 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.58 1qi9 h GLU 172 CO 0.73 0.04 0.00 0.41 -0.73 0.00 0.00 179.01 179.46 1qi9 n GLY 173 N -1.39 -1.30 0.18 1.92 0.00 -1.25 -4.40 105.19 98.96 1qi9 n GLY 173 Ca 0.09 -0.06 -0.04 0.00 0.00 0.00 0.00 46.02 46.01 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 0.00 0.26 0.00 1.61 3.57 -1.61 -1.65 116.94 119.12 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 0.41 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.10 1qi9 h PHE 174 CO 0.00 0.08 0.00 -1.35 -2.23 0.00 0.00 178.31 174.81 1qi9 h PRO 175 N 0.31 0.00 -0.33 6.41 0.11 -1.80 -1.46 132.00 135.24 1qi9 h PRO 175 Ca 0.21 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.32 1qi9 h PRO 175 Cb 0.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.33 1qi9 h PRO 175 CO -0.23 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 177.65 1qi9 n ASN 176 N -2.66 1.98 -4.78 -2.05 3.02 -0.62 -4.88 115.26 105.28 1qi9 n ASN 176 Ca -0.01 -1.92 -0.37 0.00 -0.03 0.00 0.00 54.58 52.25 1qi9 n ASN 176 Cb 0.14 -0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 39.06 1qi9 n ASN 176 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1qi9 s LEU 177 N -1.16 4.15 -0.20 3.41 1.43 -0.55 -4.91 118.68 120.84 1qi9 s LEU 177 Ca 0.28 2.12 -0.38 0.00 -1.03 0.00 0.00 54.13 55.11 1qi9 s LEU 177 Cb 0.15 -4.14 -0.14 0.00 0.03 0.00 0.00 46.19 42.08 1qi9 s LEU 177 CO 0.20 -0.54 1.78 0.47 0.23 0.00 0.00 176.35 178.49 1qi9 n ASP 178 N -0.03 2.74 -4.25 2.29 9.92 -1.26 -1.99 116.55 123.96 1qi9 n ASP 178 Ca 0.05 1.04 -0.37 0.00 -0.53 0.00 0.00 54.79 54.98 1qi9 n ASP 178 Cb 0.49 -1.22 -0.04 0.00 -0.64 0.00 0.00 41.12 39.71 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 5.71 -1.22 -1.90 2.24 0.00 -1.26 -4.86 120.51 119.21 1qi9 n ALA 179 Ca 0.25 -0.05 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 1qi9 n ALA 179 Cb 0.19 -3.20 -0.03 0.00 0.00 0.00 0.00 19.45 16.42 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 -3.23 2.63 -0.10 0.00 0.11 -0.84 -1.08 120.40 117.88 1qi9 s VAL 180 Ca 0.75 0.49 -0.30 0.00 -2.93 0.00 0.00 61.98 60.00 1qi9 s VAL 180 Cb -0.42 -3.31 -0.02 0.00 -1.53 0.00 0.00 36.38 31.10 1qi9 s VAL 180 CO 0.92 0.06 1.08 -0.55 -3.33 0.00 0.00 175.10 173.28 1qi9 s SER 181 N 0.69 7.16 -0.19 3.54 0.15 -1.23 -4.66 113.70 119.17 1qi9 s SER 181 Ca 0.64 1.62 -0.28 0.00 0.70 0.00 0.00 55.95 58.62 1qi9 s SER 181 Cb -0.43 -2.56 0.11 0.00 -1.71 0.00 0.00 66.02 61.43 1qi9 s SER 181 CO 0.39 -0.52 0.91 -0.51 1.20 0.00 0.00 173.24 174.71 1qi9 s ILE 182 N 2.21 0.00 0.84 6.45 2.07 -1.26 -4.80 121.20 126.71 1qi9 s ILE 182 Ca 0.51 0.00 -0.11 0.00 -1.41 0.00 0.00 60.65 59.63 1qi9 s ILE 182 Cb -0.20 -1.00 0.09 0.00 0.13 0.00 0.00 42.46 41.48 1qi9 s ILE 182 CO 0.18 0.00 1.10 -0.83 -1.91 0.00 0.00 174.94 173.48 1qi9 s GLY 183 N -0.50 1.62 0.43 1.50 0.00 0.09 -4.91 107.32 105.55 1qi9 s GLY 183 Ca -0.02 -0.15 0.19 0.00 0.00 0.00 0.00 44.72 44.75 1qi9 s GLY 183 CO 0.01 0.31 1.90 1.48 0.00 0.00 0.00 173.10 176.79 1qi9 h SER 184 N -1.28 0.00 -0.05 1.64 4.64 -2.02 -0.05 113.55 116.44 1qi9 h SER 184 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1qi9 h SER 184 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1qi9 h SER 184 CO 0.57 0.27 0.00 -0.90 -0.87 0.00 0.00 176.83 175.91 1qi9 n ASP 185 N -3.83 0.49 0.00 4.97 5.68 -1.26 -4.89 116.55 117.71 1qi9 n ASP 185 Ca -0.01 -1.49 0.00 0.00 -0.50 0.00 0.00 54.79 52.79 1qi9 n ASP 185 Cb 0.36 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.31 1qi9 n ASP 185 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qi9 n GLY 186 N 0.90 0.69 3.93 6.12 0.00 -0.03 -5.04 105.19 111.75 1qi9 n GLY 186 Ca 0.15 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.48 4.09 -0.16 2.61 -4.23 -1.26 -4.72 115.64 109.50 1qi9 s THR 187 Ca 0.00 -0.18 0.01 0.00 -1.18 0.00 0.00 61.69 60.34 1qi9 s THR 187 Cb 0.00 -3.56 0.02 0.00 1.34 0.00 0.00 72.50 70.30 1qi9 s THR 187 CO 0.00 -0.49 -0.16 -0.69 -0.54 0.00 0.00 174.62 172.74 1qi9 s VAL 188 N -2.74 1.70 -0.28 2.29 1.01 -1.26 -0.73 120.40 120.39 1qi9 s VAL 188 Ca 0.50 -0.71 -0.26 0.00 0.00 0.00 0.00 61.98 61.50 1qi9 s VAL 188 Cb -0.10 -1.57 0.00 0.00 0.00 0.00 0.00 36.38 34.71 1qi9 s VAL 188 CO 0.42 0.48 0.91 -0.62 0.00 0.00 0.00 175.10 176.29 1qi9 s ASP 189 N 1.42 6.86 0.13 3.32 2.15 -1.26 -4.73 116.67 124.56 1qi9 s ASP 189 Ca 0.05 1.00 -0.22 0.00 0.43 0.00 0.00 52.55 53.81 1qi9 s ASP 189 Cb -0.13 -2.47 -0.03 0.00 -0.30 0.00 0.00 42.92 39.99 1qi9 s ASP 189 CO -0.11 -0.66 1.68 -0.65 -0.17 0.00 0.00 175.17 175.27 1qi9 h PRO 190 N 7.85 -0.13 -0.42 4.34 0.11 -1.87 0.66 132.00 142.55 1qi9 h PRO 190 Ca -0.22 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.89 1qi9 h PRO 190 Cb 1.08 0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1qi9 h PRO 190 CO 0.93 -0.09 0.21 1.25 -0.21 0.00 0.00 178.00 180.10 1qi9 h LEU 191 N -0.13 0.53 -1.43 2.35 5.85 -1.92 -3.17 115.31 117.39 1qi9 h LEU 191 Ca 0.09 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1qi9 h LEU 191 Cb 0.26 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.16 1qi9 h LEU 191 CO -0.21 0.49 -0.08 -1.54 -0.34 0.00 0.00 178.44 176.75 1qi9 n SER 192 N -4.70 2.15 0.00 1.25 3.41 -1.20 -4.75 113.62 109.78 1qi9 n SER 192 Ca 0.00 -1.57 0.00 0.00 -0.26 0.00 0.00 58.87 57.04 1qi9 n SER 192 Cb 0.10 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 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 0.64 0.94 -1.81 4.33 6.02 0.16 -4.82 117.38 122.84 1qi9 n GLN 193 Ca 0.09 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.66 1qi9 n GLN 193 Cb 0.38 -0.66 -0.02 0.00 1.02 0.00 0.00 30.24 30.96 1qi9 n GLN 193 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1qi9 s LEU 194 N -2.46 4.35 -1.55 1.08 2.96 -0.82 -1.51 118.68 120.73 1qi9 s LEU 194 Ca 0.00 2.91 -0.02 0.00 -0.22 0.00 0.00 54.13 56.80 1qi9 s LEU 194 Cb 0.00 -3.63 0.01 0.00 0.50 0.00 0.00 46.19 43.06 1qi9 s LEU 194 CO 0.00 -0.89 0.19 0.49 -1.32 0.00 0.00 176.35 174.83 1qi9 n PHE 195 N 2.21 -1.40 -4.67 5.38 3.72 -1.26 -4.98 117.46 116.46 1qi9 n PHE 195 Ca 0.08 0.17 -0.32 0.00 -0.05 0.00 0.00 57.45 57.33 1qi9 n PHE 195 Cb 0.38 -3.80 -0.07 0.00 -0.94 0.00 0.00 39.48 35.05 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 -5.29 2.20 0.09 -1.08 0.52 -0.57 -5.08 118.95 109.75 1qi9 s ARG 196 Ca 0.11 -2.36 -0.03 0.00 -0.52 0.00 0.00 55.73 52.92 1qi9 s ARG 196 Cb -0.05 -1.59 -0.03 0.00 0.52 0.00 0.00 34.95 33.80 1qi9 s ARG 196 CO 0.13 -0.39 0.07 0.00 0.02 0.00 0.00 175.30 175.14 1qi9 s ALA 197 N -2.87 0.42 -2.40 2.13 0.00 -1.26 -3.51 121.76 114.27 1qi9 s ALA 197 Ca 0.09 -1.14 0.28 0.00 0.00 0.00 0.00 51.96 51.19 1qi9 s ALA 197 Cb 0.01 0.56 1.14 0.00 0.00 0.00 0.00 23.12 24.83 1qi9 s ALA 197 CO 0.05 -0.46 1.79 0.25 0.00 0.00 0.00 175.76 177.39 1qi9 n THR 198 N -0.02 0.02 -1.53 0.00 -2.24 -0.24 -4.09 114.28 106.17 1qi9 n THR 198 Ca -0.11 -0.22 -0.37 0.00 -2.27 0.00 0.00 64.05 61.08 1qi9 n THR 198 Cb 0.62 0.34 0.06 0.00 -2.10 0.00 0.00 70.33 69.25 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 0.02 0.39 -1.65 4.78 3.72 -1.26 -4.78 117.46 118.67 1qi9 n PHE 199 Ca 0.19 0.42 -0.53 0.00 -0.05 0.00 0.00 57.45 57.49 1qi9 n PHE 199 Cb 0.31 -2.08 -0.06 0.00 -0.94 0.00 0.00 39.48 36.72 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 -1.91 0.18 -0.10 -4.37 0.31 -0.62 -2.00 118.33 109.82 1qi9 n VAL 200 Ca 0.13 -0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1qi9 n VAL 200 Cb 0.48 -1.17 0.00 0.00 -0.91 0.00 0.00 33.84 32.24 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 3.44 2.49 0.21 2.92 0.00 -1.26 -4.45 105.19 108.54 1qi9 n GLY 201 Ca 0.22 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.21 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 1.29 -0.00 1.61 2.07 -1.63 -2.87 116.25 116.71 1qi9 h VAL 202 Ca 0.00 -1.39 0.00 0.00 0.82 0.00 0.00 66.70 66.13 1qi9 h VAL 202 Cb 0.00 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1qi9 h VAL 202 CO 0.00 0.43 -0.30 -0.62 0.02 0.00 0.00 177.57 177.10 1qi9 n GLU 203 N -4.07 0.19 -2.97 1.57 1.02 -1.26 -4.85 120.64 110.26 1qi9 n GLU 203 Ca -0.01 -0.08 -0.40 0.00 -0.02 0.00 0.00 57.16 56.64 1qi9 n GLU 203 Cb 0.44 -1.50 -0.05 0.00 -0.02 0.00 0.00 31.44 30.32 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 -2.87 4.77 0.00 2.62 2.01 -1.09 -4.95 115.64 116.14 1qi9 s THR 204 Ca 0.16 1.63 0.00 0.00 0.31 0.00 0.00 61.69 63.79 1qi9 s THR 204 Cb 0.18 -4.12 0.00 0.00 0.01 0.00 0.00 72.50 68.58 1qi9 s THR 204 CO 0.61 0.34 0.00 0.61 -0.69 0.00 0.00 174.62 175.49 1qi9 n GLY 205 N 2.50 0.02 3.65 4.40 0.00 -1.26 -4.86 105.19 109.64 1qi9 n GLY 205 Ca -0.02 -1.01 -0.37 0.00 0.00 0.00 0.00 46.02 44.62 1qi9 n GLY 205 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1qi9 n PRO 206 N -0.02 0.94 -0.21 1.61 -0.02 -1.26 -4.93 135.00 131.11 1qi9 n PRO 206 Ca 0.00 0.37 -0.05 0.00 -2.02 0.00 0.00 63.50 61.80 1qi9 n PRO 206 Cb 0.00 -2.27 0.05 0.00 -0.02 0.00 0.00 33.50 31.25 1qi9 n PRO 206 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1qi9 h PHE 207 N 0.47 0.71 -3.21 6.00 3.04 -1.90 -3.42 116.94 118.63 1qi9 h PHE 207 Ca -0.49 0.02 -0.59 0.00 3.98 0.00 0.00 57.97 60.89 1qi9 h PHE 207 Cb 1.36 -0.24 -0.06 0.00 2.56 0.00 0.00 35.95 39.57 1qi9 h PHE 207 CO 0.38 0.42 -0.13 0.42 -2.02 0.00 0.00 178.31 177.39 1qi9 s ILE 208 N -6.14 5.02 0.40 1.41 -1.09 -1.26 -4.94 121.20 114.60 1qi9 s ILE 208 Ca -0.13 1.00 -0.25 0.00 -2.23 0.00 0.00 60.65 59.04 1qi9 s ILE 208 Cb 0.14 -3.81 -0.11 0.00 -1.58 0.00 0.00 42.46 37.10 1qi9 s ILE 208 CO 0.75 0.46 1.09 -0.24 -1.23 0.00 0.00 174.94 175.77 1qi9 n SER 209 N 2.60 1.67 0.09 3.58 2.88 -1.26 -4.85 113.62 118.33 1qi9 n SER 209 Ca -0.10 1.08 0.19 0.00 -1.33 0.00 0.00 58.87 58.71 1qi9 n SER 209 Cb 0.52 -1.39 0.74 0.00 -0.75 0.00 0.00 64.21 63.33 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 1.78 0.00 0.00 -1.46 1.08 -1.90 -1.30 115.11 113.32 1qi9 h GLN 210 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1qi9 h GLN 210 Cb 1.32 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.75 1qi9 h GLN 210 CO 0.58 0.00 0.00 1.28 -0.95 0.00 0.00 178.83 179.74 1qi9 n LEU 211 N -4.08 0.41 -0.01 1.46 4.77 -1.26 -2.22 117.00 116.07 1qi9 n LEU 211 Ca 0.06 0.57 0.10 0.00 -0.03 0.00 0.00 56.01 56.71 1qi9 n LEU 211 Cb 0.50 -0.47 -0.14 0.00 -2.33 0.00 0.00 43.42 40.97 1qi9 n LEU 211 CO 0.32 -0.26 -0.41 0.18 -1.33 0.00 0.00 177.39 175.89 1qi9 n LEU 212 N -1.92 0.47 -0.00 2.23 4.32 -0.49 -4.49 117.00 117.12 1qi9 n LEU 212 Ca 0.04 -0.24 0.02 0.00 -0.02 0.00 0.00 56.01 55.81 1qi9 n LEU 212 Cb 0.30 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.07 1qi9 n LEU 212 CO 0.23 0.12 -0.06 1.33 -1.22 0.00 0.00 177.39 177.79 1qi9 n VAL 213 N -1.88 0.00 -3.26 4.08 0.24 -1.17 -4.83 118.33 111.52 1qi9 n VAL 213 Ca -0.00 -0.37 -0.27 0.00 -2.04 0.00 0.00 64.34 61.66 1qi9 n VAL 213 Cb 0.44 0.94 -0.02 0.00 -1.47 0.00 0.00 33.84 33.73 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 -1.51 6.39 0.65 -1.34 0.01 -0.94 -4.63 114.94 113.56 1qi9 s ASN 214 Ca 0.01 0.68 -0.16 0.00 -0.71 0.00 0.00 52.86 52.68 1qi9 s ASN 214 Cb 0.03 -2.13 -0.01 0.00 0.41 0.00 0.00 41.25 39.56 1qi9 s ASN 214 CO 0.18 -0.27 1.14 -0.44 -1.51 0.00 0.00 177.10 176.20 1qi9 s SER 215 N -3.49 5.04 0.06 -1.22 0.01 -1.26 -4.60 113.70 108.24 1qi9 s SER 215 Ca 0.43 2.13 0.05 0.00 1.31 0.00 0.00 55.95 59.87 1qi9 s SER 215 Cb -0.10 -2.57 -0.03 0.00 0.21 0.00 0.00 66.02 63.53 1qi9 s SER 215 CO 0.33 -1.68 -0.14 0.72 0.41 0.00 0.00 173.24 172.88 1qi9 s PHE 216 N -2.11 1.22 -0.11 2.43 -0.71 -0.84 -4.88 117.98 112.97 1qi9 s PHE 216 Ca 0.70 -0.41 -0.01 0.00 -1.04 0.00 0.00 56.93 56.18 1qi9 s PHE 216 Cb -0.23 -0.70 -0.02 0.00 -1.21 0.00 0.00 43.02 40.85 1qi9 s PHE 216 CO 0.39 0.05 -0.09 0.99 -1.34 0.00 0.00 175.22 175.22 1qi9 s THR 217 N -1.08 3.49 -0.14 -4.49 2.01 -1.26 0.14 115.64 114.31 1qi9 s THR 217 Ca -0.00 -0.53 -0.01 0.00 0.31 0.00 0.00 61.69 61.46 1qi9 s THR 217 Cb -0.09 -2.46 0.04 0.00 0.01 0.00 0.00 72.50 70.00 1qi9 s THR 217 CO 0.02 0.54 -0.01 -0.51 -0.69 0.00 0.00 174.62 173.97 1qi9 s ILE 218 N -0.10 0.71 -1.31 1.82 2.07 -0.41 -4.83 121.20 119.16 1qi9 s ILE 218 Ca 0.00 -0.35 -0.02 0.00 -1.41 0.00 0.00 60.65 58.87 1qi9 s ILE 218 Cb -0.13 -0.97 0.01 0.00 0.13 0.00 0.00 42.46 41.50 1qi9 s ILE 218 CO 0.03 0.09 0.85 0.47 -1.91 0.00 0.00 174.94 174.48 1qi9 n ASP 219 N 5.01 -2.22 -0.40 4.50 8.00 -1.26 -1.42 116.55 128.78 1qi9 n ASP 219 Ca -0.10 -0.74 -0.05 0.00 0.71 0.00 0.00 54.79 54.61 1qi9 n ASP 219 Cb 0.48 -4.41 -0.02 0.00 -0.02 0.00 0.00 41.12 37.15 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 -3.05 -5.00 -4.38 -2.24 7.64 -1.26 -4.98 113.62 100.35 1qi9 n SER 220 Ca -0.24 0.13 -0.38 0.00 1.01 0.00 0.00 58.87 59.40 1qi9 n SER 220 Cb 0.65 -2.96 -0.12 0.00 -1.01 0.00 0.00 64.21 60.77 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 -1.73 4.19 -0.17 0.44 1.01 -0.50 -5.08 121.20 119.35 1qi9 s ILE 221 Ca 0.00 -0.61 -0.19 0.00 0.00 0.00 0.00 60.65 59.86 1qi9 s ILE 221 Cb 0.00 -3.16 -0.03 0.00 0.01 0.00 0.00 42.46 39.28 1qi9 s ILE 221 CO 0.00 0.07 0.52 -0.89 0.00 0.00 0.00 174.94 174.64 1qi9 s THR 222 N 1.54 5.12 -0.19 2.92 2.01 -1.26 -1.29 115.64 124.50 1qi9 s THR 222 Ca 0.03 0.98 0.00 0.00 0.31 0.00 0.00 61.69 63.01 1qi9 s THR 222 Cb -0.17 -3.84 0.01 0.00 0.01 0.00 0.00 72.50 68.51 1qi9 s THR 222 CO 0.04 0.22 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.33 1qi9 s VAL 223 N 1.35 2.32 -0.14 3.82 1.01 0.12 -4.99 120.40 123.89 1qi9 s VAL 223 Ca 0.25 -0.85 -0.22 0.00 0.00 0.00 0.00 61.98 61.15 1qi9 s VAL 223 Cb -0.15 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.20 1qi9 s VAL 223 CO 0.10 0.51 0.69 -0.70 0.00 0.00 0.00 175.10 175.70 1qi9 s GLU 224 N 1.33 4.32 -0.24 2.72 2.12 -1.26 -2.00 118.70 125.69 1qi9 s GLU 224 Ca 0.05 0.78 -0.06 0.00 0.36 0.00 0.00 54.97 56.10 1qi9 s GLU 224 Cb -0.13 -3.52 -0.22 0.00 0.26 0.00 0.00 34.13 30.52 1qi9 s GLU 224 CO -0.11 -0.12 3.23 -0.35 -0.54 0.00 0.00 175.26 177.36 1qi9 n PRO 225 N 4.54 2.05 -3.05 4.30 -0.04 -1.26 -4.85 135.00 136.70 1qi9 n PRO 225 Ca -0.00 -1.09 -0.41 0.00 -0.04 0.00 0.00 63.50 61.96 1qi9 n PRO 225 Cb 0.50 -2.08 -0.05 0.00 -0.04 0.00 0.00 33.50 31.83 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 1.41 4.20 0.40 0.54 1.02 -1.26 -4.37 119.74 121.67 1qi9 s LYS 226 Ca 0.61 0.71 0.08 0.00 0.02 0.00 0.00 55.97 57.38 1qi9 s LYS 226 Cb 0.27 -3.60 -0.03 0.00 -0.52 0.00 0.00 37.83 33.94 1qi9 s LYS 226 CO -0.01 -0.34 0.32 1.14 -0.92 0.00 0.00 175.35 175.54 1qi9 s GLN 227 N 2.23 2.49 -0.27 1.68 -2.07 0.08 -4.65 119.66 119.15 1qi9 s GLN 227 Ca 0.30 -1.56 -0.26 0.00 -1.82 0.00 0.00 55.36 52.02 1qi9 s GLN 227 Cb -0.16 -2.31 0.00 0.00 -1.09 0.00 0.00 33.01 29.46 1qi9 s GLN 227 CO 0.10 -0.13 0.89 -2.00 -1.32 0.00 0.00 175.29 172.83 1qi9 s GLU 228 N -4.06 4.13 0.44 9.60 2.12 -1.26 -1.13 118.70 128.54 1qi9 s GLU 228 Ca 0.45 0.94 0.06 0.00 0.36 0.00 0.00 54.97 56.79 1qi9 s GLU 228 Cb -0.02 -3.68 -0.04 0.00 0.26 0.00 0.00 34.13 30.65 1qi9 s GLU 228 CO 0.26 -0.63 0.13 -0.08 -0.54 0.00 0.00 175.26 174.41 1qi9 s THR 229 N 3.04 1.95 0.59 -1.70 -1.32 -1.26 -5.00 115.64 111.94 1qi9 s THR 229 Ca 0.37 -1.81 -0.18 0.00 -1.21 0.00 0.00 61.69 58.86 1qi9 s THR 229 Cb -0.15 -2.76 -0.04 0.00 -1.51 0.00 0.00 72.50 68.05 1qi9 s THR 229 CO 0.09 0.00 1.14 -0.36 -2.21 0.00 0.00 174.62 173.29 1qi9 s PHE 230 N -2.70 2.58 0.50 9.09 0.08 -1.26 -0.64 117.98 125.63 1qi9 s PHE 230 Ca 0.32 1.54 -0.20 0.00 0.12 0.00 0.00 56.93 58.72 1qi9 s PHE 230 Cb 0.04 -3.31 -0.08 0.00 -0.57 0.00 0.00 43.02 39.11 1qi9 s PHE 230 CO 0.18 -1.77 1.05 0.00 -0.10 0.00 0.00 175.22 174.58 1qi9 s ALA 231 N -1.86 2.84 0.87 5.36 0.00 -0.33 -4.13 121.76 124.50 1qi9 s ALA 231 Ca 0.73 0.62 -0.12 0.00 0.00 0.00 0.00 51.96 53.19 1qi9 s ALA 231 Cb -0.25 -3.27 0.11 0.00 0.00 0.00 0.00 23.12 19.72 1qi9 s ALA 231 CO 0.32 -0.42 1.10 -1.25 0.00 0.00 0.00 175.76 175.51 1qi9 s PRO 232 N -3.32 1.47 0.00 0.00 0.04 -1.26 -4.36 135.00 127.56 1qi9 s PRO 232 Ca 0.68 0.61 0.00 0.00 0.04 0.00 0.00 61.00 62.32 1qi9 s PRO 232 Cb -0.17 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1qi9 s PRO 232 CO 0.22 -2.04 0.00 -0.25 0.04 0.00 0.00 177.00 174.97 1qi9 n ASP 233 N -3.71 0.00 -4.62 6.66 8.00 -1.26 -4.96 116.55 116.66 1qi9 n ASP 233 Ca 0.07 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.22 1qi9 n ASP 233 Cb 0.57 -1.95 -0.10 0.00 -0.02 0.00 0.00 41.12 39.61 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 -1.09 4.33 0.38 2.53 1.01 -1.26 -5.05 120.40 121.25 1qi9 s VAL 234 Ca 0.00 -0.22 0.05 0.00 0.00 0.00 0.00 61.98 61.82 1qi9 s VAL 234 Cb 0.00 -2.88 -0.07 0.00 0.00 0.00 0.00 36.38 33.43 1qi9 s VAL 234 CO 0.00 0.53 0.03 0.20 0.00 0.00 0.00 175.10 175.87 1qi9 s ASN 235 N -0.17 3.22 0.34 3.32 0.01 -1.26 -4.94 114.94 115.46 1qi9 s ASN 235 Ca 0.05 -1.40 0.05 0.00 -0.71 0.00 0.00 52.86 50.85 1qi9 s ASN 235 Cb -0.12 -0.19 -0.07 0.00 0.41 0.00 0.00 41.25 41.28 1qi9 s ASN 235 CO 0.02 -0.55 0.03 -0.31 -1.51 0.00 0.00 177.10 174.77 1qi9 s TYR 236 N -2.98 2.09 -1.54 2.20 2.02 0.36 -4.84 117.35 114.67 1qi9 s TYR 236 Ca 0.34 -0.85 -0.05 0.00 -0.37 0.00 0.00 57.07 56.14 1qi9 s TYR 236 Cb 0.09 -1.37 0.01 0.00 -0.40 0.00 0.00 41.96 40.29 1qi9 s TYR 236 CO 0.16 0.15 0.51 -1.33 -1.57 0.00 0.00 175.55 173.47 1qi9 n MET 237 N -0.74 -4.29 0.00 -0.62 2.81 -1.26 -1.14 117.12 111.88 1qi9 n MET 237 Ca -0.03 0.86 0.06 0.00 -1.81 0.00 0.00 57.70 56.77 1qi9 n MET 237 Cb 0.66 -5.68 -0.02 0.00 -0.71 0.00 0.00 33.22 27.47 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 -4.36 0.00 -3.15 2.03 0.24 -1.26 -4.49 118.33 107.35 1qi9 n VAL 238 Ca -0.12 -0.32 -0.39 0.00 -2.04 0.00 0.00 64.34 61.47 1qi9 n VAL 238 Cb 0.62 1.10 -0.06 0.00 -1.47 0.00 0.00 33.84 34.03 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 -1.76 6.77 0.14 -1.34 -1.08 -1.26 -4.68 116.67 113.45 1qi9 s ASP 239 Ca 0.08 0.93 -0.21 0.00 -0.52 0.00 0.00 52.55 52.83 1qi9 s ASP 239 Cb 0.10 -2.35 -0.00 0.00 -1.46 0.00 0.00 42.92 39.20 1qi9 s ASP 239 CO 0.37 -0.15 1.67 0.15 0.52 0.00 0.00 175.17 177.73 1qi9 h PHE 240 N 7.06 -0.34 -0.92 -5.34 3.57 -1.98 -1.25 116.94 117.75 1qi9 h PHE 240 Ca -0.37 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.15 1qi9 h PHE 240 Cb 1.17 0.18 -0.04 0.00 2.79 0.00 0.00 35.95 40.04 1qi9 h PHE 240 CO 0.67 -0.20 0.56 -0.44 -2.23 0.00 0.00 178.31 176.67 1qi9 h ASP 241 N -0.14 1.09 -0.37 0.41 3.32 -1.98 -0.45 116.42 118.29 1qi9 h ASP 241 Ca 0.11 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.09 1qi9 h ASP 241 Cb 0.30 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.56 1qi9 h ASP 241 CO -0.27 0.83 0.19 -0.33 -1.72 0.00 0.00 179.24 177.94 1qi9 h GLU 242 N 1.26 0.53 0.06 3.56 5.08 -1.85 -0.78 114.58 122.43 1qi9 h GLU 242 Ca 0.33 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.63 1qi9 h GLU 242 Cb -0.07 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.05 1qi9 h GLU 242 CO -0.06 0.47 -0.18 2.35 -1.00 0.00 0.00 179.01 180.58 1qi9 h TRP 243 N 0.47 -0.48 -0.34 4.33 7.01 -0.86 -1.90 115.95 124.18 1qi9 h TRP 243 Ca 0.13 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.14 1qi9 h TRP 243 Cb 0.10 0.21 -0.02 0.00 -2.10 0.00 0.00 29.16 27.35 1qi9 h TRP 243 CO -0.02 -0.27 0.20 1.25 -2.79 0.00 0.00 178.44 176.82 1qi9 h LEU 244 N -0.33 0.40 -0.68 0.65 6.46 -0.92 -1.97 115.31 118.93 1qi9 h LEU 244 Ca 0.04 -0.06 0.12 0.00 -0.12 0.00 0.00 57.88 57.86 1qi9 h LEU 244 Cb 0.37 -0.10 -0.08 0.00 -0.73 0.00 0.00 40.66 40.12 1qi9 h LEU 244 CO -0.13 0.34 0.25 -1.13 -0.62 0.00 0.00 178.44 177.15 1qi9 h ASN 245 N 0.43 0.23 -0.53 1.25 -1.24 -1.01 -0.39 115.58 114.32 1qi9 h ASN 245 Ca 0.12 0.10 -0.07 0.00 0.71 0.00 0.00 56.30 57.16 1qi9 h ASN 245 Cb 0.01 0.08 -0.02 0.00 0.73 0.00 0.00 38.32 39.12 1qi9 h ASN 245 CO -0.02 0.11 0.08 0.40 -1.29 0.00 0.00 177.43 176.71 1qi9 h ILE 246 N 0.41 1.25 -0.13 2.57 1.08 -0.84 -1.08 117.51 120.78 1qi9 h ILE 246 Ca 0.36 -0.98 -0.09 0.00 -0.39 0.00 0.00 64.86 63.76 1qi9 h ILE 246 Cb 0.50 0.72 -0.01 0.00 -3.07 0.00 0.00 36.82 34.95 1qi9 h ILE 246 CO -0.36 0.36 -0.33 1.56 -0.69 0.00 0.00 178.15 178.69 1qi9 h GLN 247 N 0.88 0.25 0.00 2.37 1.08 -0.66 -1.86 115.11 117.18 1qi9 h GLN 247 Ca 0.18 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1qi9 h GLN 247 Cb 0.41 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.83 1qi9 h GLN 247 CO 0.01 0.55 0.00 0.09 -0.95 0.00 0.00 178.83 178.54 1qi9 n ASN 248 N -4.09 0.00 0.00 1.46 3.02 -0.22 0.58 115.26 116.00 1qi9 n ASN 248 Ca -0.01 -1.31 0.00 0.00 -0.03 0.00 0.00 54.58 53.23 1qi9 n ASN 248 Cb 0.42 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.59 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 0.79 0.76 3.88 7.41 0.00 -0.70 -1.57 105.19 115.77 1qi9 n GLY 249 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 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 -1.76 1.62 0.64 -0.02 0.00 -0.42 -3.78 107.32 103.60 1qi9 s GLY 250 Ca 0.00 -0.42 -0.16 0.00 0.00 0.00 0.00 44.72 44.13 1qi9 s GLY 250 CO 0.00 -0.01 1.14 2.56 0.00 0.00 0.00 173.10 176.79 1qi9 s PRO 251 N -5.41 2.80 0.84 2.90 0.04 -1.26 -4.58 135.00 130.33 1qi9 s PRO 251 Ca 0.59 1.55 -0.12 0.00 0.04 0.00 0.00 61.00 63.06 1qi9 s PRO 251 Cb -0.11 -1.94 0.10 0.00 0.04 0.00 0.00 34.50 32.59 1qi9 s PRO 251 CO 0.51 -1.28 1.20 -2.14 0.04 0.00 0.00 177.00 175.33 1qi9 s PRO 252 N -3.82 1.44 0.44 0.56 0.02 -1.26 -4.82 135.00 127.56 1qi9 s PRO 252 Ca 0.71 1.72 0.29 0.00 0.02 0.00 0.00 61.00 63.74 1qi9 s PRO 252 Cb -0.24 -1.76 1.09 0.00 0.02 0.00 0.00 34.50 33.61 1qi9 s PRO 252 CO 0.38 -2.36 1.85 0.00 -0.33 0.00 0.00 177.00 176.55 1qi9 h ALA 253 N -1.17 1.00 0.00 -1.55 0.00 -1.95 -3.48 119.26 112.11 1qi9 h ALA 253 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1qi9 h ALA 253 Cb 1.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.08 1qi9 h ALA 253 CO 0.45 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.11 1qi9 n GLY 254 N 0.28 -1.22 3.94 0.00 0.00 -1.26 -5.16 105.19 101.77 1qi9 n GLY 254 Ca 0.02 -1.09 -0.24 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.47 2.35 0.21 1.61 0.04 -1.26 -4.75 135.00 131.73 1qi9 s PRO 255 Ca 0.00 -0.40 -0.15 0.00 0.04 0.00 0.00 61.00 60.49 1qi9 s PRO 255 Cb 0.00 -2.27 -0.08 0.00 0.04 0.00 0.00 34.50 32.19 1qi9 s PRO 255 CO 0.00 -1.04 0.63 -1.21 0.04 0.00 0.00 177.00 175.42 1qi9 s GLU 256 N -5.08 4.04 0.21 4.56 8.01 -1.26 -4.95 118.70 124.23 1qi9 s GLU 256 Ca 0.59 0.60 -0.30 0.00 0.01 0.00 0.00 54.97 55.86 1qi9 s GLU 256 Cb -0.11 -2.79 -0.10 0.00 -4.31 0.00 0.00 34.13 26.83 1qi9 s GLU 256 CO 0.43 0.38 1.46 -0.51 0.01 0.00 0.00 175.26 177.02 1qi9 s LEU 257 N -2.26 4.38 0.20 1.80 2.01 -1.26 -5.00 118.68 118.55 1qi9 s LEU 257 Ca 0.43 2.61 0.10 0.00 0.01 0.00 0.00 54.13 57.28 1qi9 s LEU 257 Cb -0.14 -3.61 -0.04 0.00 0.01 0.00 0.00 46.19 42.40 1qi9 s LEU 257 CO 0.20 -0.71 -0.16 -0.76 1.01 0.00 0.00 176.35 175.92 1qi9 s LEU 258 N 0.14 2.74 0.22 1.79 1.43 -1.26 -1.19 118.68 122.55 1qi9 s LEU 258 Ca 0.62 -0.73 -0.28 0.00 -1.03 0.00 0.00 54.13 52.71 1qi9 s LEU 258 Cb -0.41 -1.42 -0.09 0.00 0.03 0.00 0.00 46.19 44.30 1qi9 s LEU 258 CO 0.39 0.10 0.88 -0.62 0.23 0.00 0.00 176.35 177.33 1qi9 s ASP 259 N -2.85 7.56 0.50 2.29 -1.08 0.18 -4.40 116.67 118.87 1qi9 s ASP 259 Ca 0.24 1.84 0.28 0.00 -0.52 0.00 0.00 52.55 54.39 1qi9 s ASP 259 Cb -0.08 -2.57 1.19 0.00 -1.46 0.00 0.00 42.92 39.99 1qi9 s ASP 259 CO 0.13 0.17 1.93 0.44 0.52 0.00 0.00 175.17 178.37 1qi9 h ASP 260 N 4.20 0.00 -3.22 -0.34 3.32 -1.96 -3.41 116.42 115.00 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 -0.14 0.00 0.22 0.00 0.00 39.33 40.61 1qi9 h ASP 260 CO 0.67 0.13 -0.53 -1.61 -1.72 0.00 0.00 179.24 176.18 1qi9 s GLU 261 N -3.75 3.95 0.16 3.56 2.02 -1.26 -5.08 118.70 118.30 1qi9 s GLU 261 Ca 0.00 -0.29 -0.31 0.00 0.02 0.00 0.00 54.97 54.40 1qi9 s GLU 261 Cb 0.10 -3.26 -0.08 0.00 0.10 0.00 0.00 34.13 30.99 1qi9 s GLU 261 CO 0.59 0.35 1.34 -0.51 0.02 0.00 0.00 175.26 177.05 1qi9 s LEU 262 N 0.18 4.39 0.03 1.80 1.02 -1.26 -4.63 118.68 120.22 1qi9 s LEU 262 Ca 0.06 2.35 -0.01 0.00 0.02 0.00 0.00 54.13 56.55 1qi9 s LEU 262 Cb -0.12 -3.60 -0.02 0.00 0.02 0.00 0.00 46.19 42.47 1qi9 s LEU 262 CO -0.00 -0.58 -0.01 -0.13 0.02 0.00 0.00 176.35 175.65 1qi9 s ARG 263 N 0.45 0.46 0.78 1.70 0.52 -0.29 -4.80 118.95 117.77 1qi9 s ARG 263 Ca 0.60 -0.83 -0.11 0.00 -0.52 0.00 0.00 55.73 54.87 1qi9 s ARG 263 Cb -0.36 0.16 0.06 0.00 0.52 0.00 0.00 34.95 35.33 1qi9 s ARG 263 CO 0.34 -0.09 1.09 -0.06 0.02 0.00 0.00 175.30 176.61 1qi9 s PHE 264 N -2.47 2.61 -0.20 -0.53 0.08 0.66 -0.74 117.98 117.39 1qi9 s PHE 264 Ca -0.06 1.50 -0.29 0.00 0.12 0.00 0.00 56.93 58.20 1qi9 s PHE 264 Cb -0.02 -3.04 -0.03 0.00 -0.57 0.00 0.00 43.02 39.35 1qi9 s PHE 264 CO -0.05 -1.80 1.63 0.08 -0.10 0.00 0.00 175.22 174.98 1qi9 s VAL 265 N -2.93 3.67 0.00 -0.44 1.01 -1.26 -4.66 120.40 115.79 1qi9 s VAL 265 Ca 0.61 0.76 0.00 0.00 0.00 0.00 0.00 61.98 63.35 1qi9 s VAL 265 Cb -0.17 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.55 1qi9 s VAL 265 CO 0.56 -0.26 0.54 -2.11 0.00 0.00 0.00 175.10 173.83 1qi9 n ARG 266 N 7.61 0.38 -3.82 2.72 -4.01 -1.26 -4.76 116.66 113.52 1qi9 n ARG 266 Ca 0.19 -0.60 -0.08 0.00 -1.04 0.00 0.00 57.85 56.32 1qi9 n ARG 266 Cb 0.45 -0.57 0.01 0.00 -3.04 0.00 0.00 32.46 29.31 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 -0.13 -0.06 0.30 2.89 2.20 -1.26 -1.49 114.94 117.40 1qi9 s ASN 267 Ca 0.00 -1.00 0.05 0.00 -0.94 0.00 0.00 52.86 50.97 1qi9 s ASN 267 Cb 0.00 0.81 0.49 0.00 -2.00 0.00 0.00 41.25 40.55 1qi9 s ASN 267 CO 0.00 -1.59 1.75 0.00 -2.94 0.00 0.00 177.10 174.32 1qi9 h ALA 268 N 2.00 1.17 -0.67 3.54 0.00 -1.71 -2.34 119.26 121.25 1qi9 h ALA 268 Ca -0.29 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 1qi9 h ALA 268 Cb 1.25 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.90 1qi9 h ALA 268 CO 0.36 0.54 0.39 -0.09 0.00 0.00 0.00 179.25 180.45 1qi9 h ARG 269 N 0.32 0.93 -0.50 0.00 2.43 -1.55 -0.33 114.38 115.67 1qi9 h ARG 269 Ca 0.05 -0.09 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1qi9 h ARG 269 Cb 0.67 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1qi9 h ARG 269 CO 0.05 0.68 0.29 -0.44 -1.51 0.00 0.00 179.97 179.03 1qi9 h ASP 270 N 0.92 0.62 -0.49 -3.80 3.32 -1.77 0.36 116.42 115.58 1qi9 h ASP 270 Ca 0.24 -0.08 -0.08 0.00 0.02 0.00 0.00 57.03 57.13 1qi9 h ASP 270 Cb 0.00 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.38 1qi9 h ASP 270 CO -0.04 0.52 -0.02 0.25 -1.72 0.00 0.00 179.24 178.22 1qi9 h LEU 271 N 0.67 0.86 -0.47 1.55 5.85 -1.18 -2.14 115.31 120.45 1qi9 h LEU 271 Ca 0.18 -0.32 0.02 0.00 0.84 0.00 0.00 57.88 58.60 1qi9 h LEU 271 Cb 0.03 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.80 1qi9 h LEU 271 CO -0.03 0.97 0.29 0.00 -0.34 0.00 0.00 178.44 179.33 1qi9 h ALA 272 N 0.92 0.60 -0.53 1.25 0.00 -0.92 -2.65 119.26 117.93 1qi9 h ALA 272 Ca 0.13 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1qi9 h ALA 272 Cb 0.55 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.13 1qi9 h ALA 272 CO 0.03 -0.01 0.20 -0.09 0.00 0.00 0.00 179.25 179.38 1qi9 h ARG 273 N 0.58 0.38 -0.45 0.00 9.65 -0.36 -1.29 114.38 122.89 1qi9 h ARG 273 Ca 0.18 -0.02 0.09 0.00 -1.10 0.00 0.00 59.98 59.13 1qi9 h ARG 273 Cb -0.01 -0.09 -0.09 0.00 -1.39 0.00 0.00 29.97 28.40 1qi9 h ARG 273 CO -0.07 0.25 -0.20 0.28 2.80 0.00 0.00 179.97 183.03 1qi9 h VAL 274 N 0.39 0.40 0.00 0.20 2.07 -1.07 -1.56 116.25 116.68 1qi9 h VAL 274 Ca 0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.78 1qi9 h VAL 274 Cb 0.28 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1qi9 h VAL 274 CO -0.25 0.00 0.00 0.71 0.02 0.00 0.00 177.57 178.05 1qi9 h THR 275 N -0.11 0.00 0.00 2.57 1.35 -1.10 -1.46 112.91 114.17 1qi9 h THR 275 Ca 0.21 -0.43 -0.08 0.00 -0.55 0.00 0.00 66.41 65.56 1qi9 h THR 275 Cb 0.44 1.31 -0.01 0.00 -1.73 0.00 0.00 68.15 68.16 1qi9 h THR 275 CO -0.52 0.00 -0.59 0.15 -0.25 0.00 0.00 175.52 174.32 1qi9 h PHE 276 N 0.00 0.00 -0.07 4.73 3.57 -0.29 -3.37 116.94 121.51 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 0.54 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.28 1qi9 h PHE 276 CO 0.00 0.33 0.00 0.25 -2.23 0.00 0.00 178.31 176.66 1qi9 n THR 277 N -3.08 1.71 -2.71 4.41 -2.24 -0.86 -5.04 114.28 106.48 1qi9 n THR 277 Ca 0.00 -1.84 -0.25 0.00 -2.27 0.00 0.00 64.05 59.70 1qi9 n THR 277 Cb 0.68 -0.03 0.02 0.00 -2.10 0.00 0.00 70.33 68.90 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 -2.17 5.78 -0.41 3.42 1.47 -0.60 -5.04 116.67 119.12 1qi9 s ASP 278 Ca 0.27 0.52 0.01 0.00 1.18 0.00 0.00 52.55 54.53 1qi9 s ASP 278 Cb 0.22 -1.67 0.13 0.00 -0.34 0.00 0.00 42.92 41.26 1qi9 s ASP 278 CO 0.04 -0.84 0.21 0.20 0.68 0.00 0.00 175.17 175.47 1qi9 s ASN 279 N -4.24 3.58 0.00 2.11 0.01 -1.26 -5.01 114.94 110.13 1qi9 s ASN 279 Ca 0.50 -2.42 0.00 0.00 -0.71 0.00 0.00 52.86 50.24 1qi9 s ASN 279 Cb -0.10 -0.90 0.00 0.00 0.41 0.00 0.00 41.25 40.65 1qi9 s ASN 279 CO 0.41 -0.29 0.00 -0.38 -1.51 0.00 0.00 177.10 175.33 1qi9 n ILE 280 N 3.81 0.00 -1.29 0.60 2.08 -1.26 -2.91 119.36 120.38 1qi9 n ILE 280 Ca 0.08 0.00 0.06 0.00 0.56 0.00 0.00 62.75 63.45 1qi9 n ILE 280 Cb 0.36 0.00 0.08 0.00 -0.75 0.00 0.00 39.64 39.33 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 1.63 1.49 -0.28 4.38 0.23 -1.26 -4.85 115.26 116.61 1qi9 n ASN 281 Ca 0.00 -2.59 -0.01 0.00 -0.53 0.00 0.00 54.58 51.44 1qi9 n ASN 281 Cb 0.00 -0.31 0.11 0.00 -2.08 0.00 0.00 39.78 37.50 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 2.35 1.06 -0.40 5.53 1.35 -1.92 0.24 112.91 121.12 1qi9 h THR 282 Ca 0.00 -0.31 -0.07 0.00 -0.55 0.00 0.00 66.41 65.48 1qi9 h THR 282 Cb 1.10 0.07 -0.01 0.00 -1.73 0.00 0.00 68.15 67.58 1qi9 h THR 282 CO 0.00 0.17 -0.02 -0.33 -0.25 0.00 0.00 175.52 175.08 1qi9 h GLU 283 N 0.90 0.72 0.00 4.72 3.07 -1.91 -2.10 114.58 119.98 1qi9 h GLU 283 Ca 0.33 -0.24 -0.08 0.00 -0.50 0.00 0.00 59.36 58.87 1qi9 h GLU 283 Cb 0.11 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.95 1qi9 h GLU 283 CO -0.15 0.82 -0.37 0.00 -1.40 0.00 0.00 179.01 177.91 1qi9 h ALA 284 N 0.87 1.28 -0.35 3.43 0.00 -1.80 0.22 119.26 122.91 1qi9 h ALA 284 Ca 0.11 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1qi9 h ALA 284 Cb 0.51 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1qi9 h ALA 284 CO 0.02 0.46 -0.12 -0.92 0.00 0.00 0.00 179.25 178.70 1qi9 h TYR 285 N 0.00 0.78 -0.39 0.00 5.03 -0.38 0.10 116.97 122.12 1qi9 h TYR 285 Ca -0.00 -0.18 0.00 0.00 2.58 0.00 0.00 58.73 61.13 1qi9 h TYR 285 Cb 0.70 -0.19 -0.02 0.00 1.55 0.00 0.00 36.73 38.77 1qi9 h TYR 285 CO 0.00 0.87 0.26 0.00 -1.32 0.00 0.00 178.16 177.96 1qi9 h ARG 286 N 0.47 0.51 -0.68 1.82 3.08 -1.01 -0.62 114.38 117.95 1qi9 h ARG 286 Ca 0.08 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.08 1qi9 h ARG 286 Cb 0.63 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 30.53 1qi9 h ARG 286 CO 0.04 0.34 0.35 0.78 -1.07 0.00 0.00 179.97 180.42 1qi9 h GLY 287 N 0.53 1.02 1.00 0.04 0.00 -0.18 -2.05 103.07 103.43 1qi9 h GLY 287 Ca 0.14 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1qi9 h GLY 287 CO -0.03 0.45 0.23 0.00 0.00 0.00 0.00 176.54 177.18 1qi9 h ALA 288 N 1.43 0.44 -0.65 3.60 0.00 -0.35 0.21 119.26 123.93 1qi9 h ALA 288 Ca 0.24 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1qi9 h ALA 288 Cb 0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1qi9 h ALA 288 CO -0.04 -0.10 0.14 -0.07 0.00 0.00 0.00 179.25 179.19 1qi9 h LEU 289 N 0.46 1.01 -0.25 0.00 3.38 -0.91 -1.60 115.31 117.40 1qi9 h LEU 289 Ca 0.13 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 1qi9 h LEU 289 Cb -0.05 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1qi9 h LEU 289 CO -0.03 0.99 -0.02 0.40 0.09 0.00 0.00 178.44 179.87 1qi9 h ILE 290 N 0.98 1.27 -1.00 1.22 2.04 -0.86 -1.32 117.51 119.84 1qi9 h ILE 290 Ca 0.20 -0.97 0.01 0.00 1.00 0.00 0.00 64.86 65.11 1qi9 h ILE 290 Cb 0.39 1.40 -0.05 0.00 -0.74 0.00 0.00 36.82 37.82 1qi9 h ILE 290 CO 0.01 0.30 0.66 -0.07 0.00 0.00 0.00 178.15 179.05 1qi9 h LEU 291 N 0.23 1.14 -0.35 1.44 3.38 -0.91 -0.14 115.31 120.09 1qi9 h LEU 291 Ca 0.07 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 1qi9 h LEU 291 Cb 0.46 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1qi9 h LEU 291 CO 0.02 0.82 0.20 0.25 0.09 0.00 0.00 178.44 179.82 1qi9 h LEU 292 N 1.34 0.43 -1.66 1.67 5.85 -1.19 -1.01 115.31 120.75 1qi9 h LEU 292 Ca 0.37 -0.07 -0.02 0.00 0.84 0.00 0.00 57.88 59.00 1qi9 h LEU 292 Cb -0.14 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.78 1qi9 h LEU 292 CO -0.09 0.38 0.02 1.23 -0.34 0.00 0.00 178.44 179.64 1qi9 h GLY 293 N 0.44 0.25 -0.16 3.75 0.00 -0.49 -0.81 103.07 106.06 1qi9 h GLY 293 Ca 0.12 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1qi9 h GLY 293 CO -0.02 0.11 -0.04 1.04 0.00 0.00 0.00 176.54 177.63 1qi9 n LEU 294 N -4.42 1.24 -1.35 3.11 4.77 -0.13 -4.95 117.00 115.27 1qi9 n LEU 294 Ca -0.00 -0.39 -0.12 0.00 -0.03 0.00 0.00 56.01 55.46 1qi9 n LEU 294 Cb 0.15 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.21 1qi9 n LEU 294 CO 0.36 0.21 -0.15 -0.67 -1.33 0.00 0.00 177.39 175.81 1qi9 n ASP 295 N -0.11 -3.82 0.07 -1.43 2.03 -0.31 -4.87 116.55 108.11 1qi9 n ASP 295 Ca 0.18 -0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.35 1qi9 n ASP 295 Cb 0.33 -3.02 -0.06 0.00 -0.72 0.00 0.00 41.12 37.64 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 0.55 0.31 -4.00 -1.67 0.00 -1.47 -3.40 119.26 109.58 1qi9 h ALA 296 Ca -0.28 -0.73 -0.69 0.00 0.00 0.00 0.00 54.91 53.21 1qi9 h ALA 296 Cb 1.20 -0.01 -0.27 0.00 0.00 0.00 0.00 17.79 18.72 1qi9 h ALA 296 CO 0.33 0.82 -0.81 0.12 0.00 0.00 0.00 179.25 179.72 1qi9 s PHE 297 N -3.19 2.61 -0.29 0.00 5.36 -1.21 -4.74 117.98 116.52 1qi9 s PHE 297 Ca -0.06 -0.39 -0.17 0.00 -0.96 0.00 0.00 56.93 55.35 1qi9 s PHE 297 Cb 0.08 -1.64 -0.02 0.00 -0.34 0.00 0.00 43.02 41.10 1qi9 s PHE 297 CO 0.87 0.01 0.47 1.21 -1.46 0.00 0.00 175.22 176.32 1qi9 s ASN 298 N -0.42 6.35 0.40 6.13 3.84 -1.26 -4.41 114.94 125.57 1qi9 s ASN 298 Ca 0.04 0.30 0.09 0.00 0.21 0.00 0.00 52.86 53.51 1qi9 s ASN 298 Cb -0.12 -2.26 0.85 0.00 -0.55 0.00 0.00 41.25 39.17 1qi9 s ASN 298 CO 0.02 -0.31 1.99 -0.09 -2.79 0.00 0.00 177.10 175.92 1qi9 h ARG 299 N 8.18 0.35 0.00 0.43 2.43 -1.96 -1.84 114.38 121.98 1qi9 h ARG 299 Ca -0.29 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1qi9 h ARG 299 Cb 1.14 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1qi9 h ARG 299 CO 0.71 0.35 0.00 0.00 -1.51 0.00 0.00 179.97 179.52 1qi9 n ALA 300 N -2.49 2.18 -0.10 2.80 0.00 -1.26 -4.61 120.51 117.03 1qi9 n ALA 300 Ca 0.01 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1qi9 n ALA 300 Cb 0.17 -1.39 0.00 0.00 0.00 0.00 0.00 19.45 18.23 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 0.79 0.95 3.05 0.00 0.00 -0.69 -4.55 105.19 104.74 1qi9 n GLY 301 Ca 0.10 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.69 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 -2.10 4.04 -4.41 1.61 0.31 -1.26 0.15 118.33 116.68 1qi9 n VAL 302 Ca 0.00 -4.07 -0.20 0.00 -0.01 0.00 0.00 64.34 60.06 1qi9 n VAL 302 Cb 0.00 -2.44 -0.10 0.00 -0.91 0.00 0.00 33.84 30.38 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 2.31 2.02 1.54 4.52 0.01 -1.26 -4.63 114.94 119.45 1qi9 s ASN 303 Ca 0.44 -1.37 0.00 0.00 -0.71 0.00 0.00 52.86 51.22 1qi9 s ASN 303 Cb 0.07 -0.01 0.00 0.00 0.41 0.00 0.00 41.25 41.72 1qi9 s ASN 303 CO -0.01 -0.63 0.00 0.61 -1.51 0.00 0.00 177.10 175.56 1qi9 n GLY 304 N -0.61 3.37 0.05 0.66 0.00 -1.26 -1.32 105.19 106.09 1qi9 n GLY 304 Ca -0.02 -0.07 0.10 0.00 0.00 0.00 0.00 46.02 46.03 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 0.10 1.61 -0.04 -1.26 -2.24 135.00 147.27 1qi9 n PRO 305 Ca 0.00 0.27 0.13 0.00 -0.04 0.00 0.00 63.50 63.85 1qi9 n PRO 305 Cb 0.00 -1.66 0.31 0.00 -0.04 0.00 0.00 33.50 32.11 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 -0.08 0.54 0.04 -1.52 -3.26 116.94 112.65 1qi9 h PHE 306 Ca 0.00 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.72 1qi9 h PHE 306 Cb 0.38 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.52 1qi9 h PHE 306 CO 0.00 0.00 -0.16 0.82 -0.60 0.00 0.00 178.31 178.37 1qi9 h ILE 307 N 0.00 1.16 -0.22 -0.55 2.04 -1.49 -2.92 117.51 115.53 1qi9 h ILE 307 Ca 0.00 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.13 1qi9 h ILE 307 Cb 0.77 1.28 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 1qi9 h ILE 307 CO 0.00 0.22 0.00 0.47 0.00 0.00 0.00 178.15 178.84 1qi9 n ASP 308 N -4.29 2.59 -4.43 1.72 8.00 -1.23 -4.96 116.55 113.95 1qi9 n ASP 308 Ca -0.01 -1.85 -0.21 0.00 0.71 0.00 0.00 54.79 53.43 1qi9 n ASP 308 Cb 0.26 -0.14 -0.11 0.00 -0.02 0.00 0.00 41.12 41.12 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 -1.72 1.09 -0.01 0.53 -4.36 -1.10 -5.10 121.20 110.52 1qi9 s ILE 309 Ca 0.35 -2.00 0.05 0.00 -0.26 0.00 0.00 60.65 58.78 1qi9 s ILE 309 Cb 0.20 -2.76 -0.07 0.00 1.25 0.00 0.00 42.46 41.07 1qi9 s ILE 309 CO 0.30 -0.01 0.11 0.47 0.24 0.00 0.00 174.94 176.05 1qi9 n ASP 310 N -0.65 3.76 0.04 4.36 8.00 -1.26 -4.80 116.55 126.00 1qi9 n ASP 310 Ca -0.02 -0.02 -0.02 0.00 0.71 0.00 0.00 54.79 55.44 1qi9 n ASP 310 Cb 0.66 1.21 -0.08 0.00 -0.02 0.00 0.00 41.12 42.90 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 0.00 -6.46 -1.24 9.65 -1.99 -3.48 114.38 110.86 1qi9 h ARG 311 Ca 0.00 0.00 -0.63 0.00 -1.10 0.00 0.00 59.98 58.25 1qi9 h ARG 311 Cb 0.22 0.00 -0.16 0.00 -1.39 0.00 0.00 29.97 28.63 1qi9 h ARG 311 CO 0.00 0.39 -0.78 -0.65 2.80 0.00 0.00 179.97 181.73 1qi9 s GLN 312 N -2.86 1.67 0.09 0.20 -0.21 -1.26 -5.16 119.66 112.14 1qi9 s GLN 312 Ca -0.02 -1.55 0.07 0.00 0.02 0.00 0.00 55.36 53.87 1qi9 s GLN 312 Cb 0.08 -1.88 -0.03 0.00 1.00 0.00 0.00 33.01 32.18 1qi9 s GLN 312 CO 0.81 0.38 -0.18 0.00 -2.12 0.00 0.00 175.29 174.18 1qi9 s ALA 313 N -1.94 1.57 0.70 6.09 0.00 -1.26 -4.88 121.76 122.04 1qi9 s ALA 313 Ca 0.24 -1.16 -0.08 0.00 0.00 0.00 0.00 51.96 50.96 1qi9 s ALA 313 Cb -0.07 -0.19 0.04 0.00 0.00 0.00 0.00 23.12 22.90 1qi9 s ALA 313 CO 0.12 0.29 1.03 0.20 0.00 0.00 0.00 175.76 177.40 1qi9 s GLY 314 N -1.86 1.64 0.00 0.00 0.00 0.12 -4.99 107.32 102.22 1qi9 s GLY 314 Ca 0.03 -0.72 0.00 0.00 0.00 0.00 0.00 44.72 44.03 1qi9 s GLY 314 CO 0.04 -0.34 0.00 0.33 0.00 0.00 0.00 173.10 173.13 1qi9 n PHE 315 N -2.94 -0.19 -0.34 1.90 7.35 -1.26 -4.31 117.46 117.68 1qi9 n PHE 315 Ca 0.07 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.73 1qi9 n PHE 315 Cb 0.59 0.06 0.10 0.00 0.35 0.00 0.00 39.48 40.58 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 1.26 -3.64 -2.13 2.07 -1.94 -2.61 116.25 109.26 1qi9 h VAL 316 Ca 0.00 -0.59 -0.67 0.00 0.82 0.00 0.00 66.70 66.26 1qi9 h VAL 316 Cb 0.00 -0.02 -0.28 0.00 -1.52 0.00 0.00 31.29 29.47 1qi9 h VAL 316 CO 0.00 0.28 -0.80 0.20 0.02 0.00 0.00 177.57 177.26 1qi9 s ASN 317 N -6.22 3.72 -1.67 0.57 0.01 -1.26 -3.53 114.94 106.56 1qi9 s ASN 317 Ca -0.13 -0.36 0.00 0.00 -0.71 0.00 0.00 52.86 51.67 1qi9 s ASN 317 Cb 0.17 -1.24 0.00 0.00 0.41 0.00 0.00 41.25 40.59 1qi9 s ASN 317 CO 0.82 0.23 0.00 0.49 -1.51 0.00 0.00 177.10 177.13 1qi9 n PHE 318 N 3.10 -0.80 -4.02 2.20 3.72 -1.26 -4.46 117.46 115.94 1qi9 n PHE 318 Ca -0.18 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.14 1qi9 n PHE 318 Cb 0.52 -3.65 -0.03 0.00 -0.94 0.00 0.00 39.48 35.39 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 -0.98 3.30 0.32 1.37 0.00 -1.01 -4.19 105.19 104.01 1qi9 n GLY 319 Ca -0.22 -1.68 0.14 0.00 0.00 0.00 0.00 46.02 44.26 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 1.46 0.74 -0.21 -0.61 3.07 -1.82 0.95 117.51 121.08 1qi9 h ILE 320 Ca -0.11 0.00 0.00 0.00 1.55 0.00 0.00 64.86 66.30 1qi9 h ILE 320 Cb 0.52 0.89 -0.01 0.00 -0.27 0.00 0.00 36.82 37.95 1qi9 h ILE 320 CO 0.15 0.00 0.14 -1.28 -1.05 0.00 0.00 178.15 176.11 1qi9 h SER 321 N 0.00 0.25 -0.16 2.16 0.87 -1.87 -1.69 113.55 113.11 1qi9 h SER 321 Ca 0.09 -0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.63 1qi9 h SER 321 Cb 0.40 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.29 1qi9 h SER 321 CO -0.00 0.19 0.08 -0.74 -0.53 0.00 0.00 176.83 175.84 1qi9 h HIS 322 N 0.28 0.22 0.78 2.24 -0.00 -0.57 -1.50 115.15 116.60 1qi9 h HIS 322 Ca 0.08 -0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.40 1qi9 h HIS 322 Cb -0.02 -0.07 0.01 0.00 -0.00 0.00 0.00 27.41 27.33 1qi9 h HIS 322 CO -0.06 0.22 -0.39 -0.92 -0.00 0.00 0.00 177.93 176.78 1qi9 h TYR 323 N 0.15 -1.01 0.00 5.26 3.20 -1.12 -2.66 116.97 120.79 1qi9 h TYR 323 Ca 0.06 -0.02 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 1qi9 h TYR 323 Cb 0.08 0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1qi9 h TYR 323 CO -0.04 -0.62 -0.28 0.74 -1.64 0.00 0.00 178.16 176.32 1qi9 h PHE 324 N -1.07 0.00 0.00 -3.82 0.04 -1.38 -2.29 116.94 108.42 1qi9 h PHE 324 Ca -0.11 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.66 1qi9 h PHE 324 Cb 0.82 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.97 1qi9 h PHE 324 CO -0.03 0.28 -0.00 -0.09 -0.60 0.00 0.00 178.31 177.87 1qi9 h ARG 325 N 0.00 -0.00 0.00 1.51 2.43 -1.21 -3.05 114.38 114.05 1qi9 h ARG 325 Ca -0.00 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1qi9 h ARG 325 Cb 0.52 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.06 1qi9 h ARG 325 CO 0.04 0.03 -0.28 -0.07 -1.51 0.00 0.00 179.97 178.17 1qi9 h LEU 326 N -0.03 0.00 -1.67 3.80 3.38 -1.30 0.72 115.31 120.21 1qi9 h LEU 326 Ca -0.00 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.99 1qi9 h LEU 326 Cb 0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1qi9 h LEU 326 CO 0.00 0.28 0.25 0.40 0.09 0.00 0.00 178.44 179.47 1qi9 h ILE 327 N 0.00 1.05 0.06 1.22 1.08 -1.31 0.53 117.51 120.15 1qi9 h ILE 327 Ca -0.00 -0.15 -0.31 0.00 -0.39 0.00 0.00 64.86 64.00 1qi9 h ILE 327 Cb 0.89 0.57 -0.03 0.00 -3.07 0.00 0.00 36.82 35.18 1qi9 h ILE 327 CO 0.04 0.08 -1.73 0.61 -0.69 0.00 0.00 178.15 176.46 1qi9 n GLY 328 N -1.49 -0.67 0.22 5.37 0.00 -1.12 -4.54 105.19 102.96 1qi9 n GLY 328 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.22 1.34 0.00 4.61 0.00 -0.25 -1.90 119.26 122.84 1qi9 h ALA 329 Ca -0.41 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.21 1qi9 h ALA 329 Cb 1.70 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1qi9 h ALA 329 CO -0.07 0.45 0.00 0.00 0.00 0.00 0.00 179.25 179.64 1qi9 n ALA 330 N -2.48 1.27 0.15 0.00 0.00 0.18 -1.72 120.51 117.92 1qi9 n ALA 330 Ca -0.01 -0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.47 1qi9 n ALA 330 Cb 0.35 -1.10 0.29 0.00 0.00 0.00 0.00 19.45 19.00 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 -1.50 0.07 0.30 0.00 4.07 -0.72 -2.35 120.64 120.51 1qi9 n GLU 331 Ca 0.01 0.51 0.19 0.00 -0.06 0.00 0.00 57.16 57.82 1qi9 n GLU 331 Cb 0.07 -1.70 1.01 0.00 -0.06 0.00 0.00 31.44 30.76 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 -2.10 4.31 5.85 -1.56 -0.55 115.31 121.26 1qi9 h LEU 332 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1qi9 h LEU 332 Cb 0.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1qi9 h LEU 332 CO 0.00 0.00 0.00 0.00 -0.34 0.00 0.00 178.44 178.10 1qi9 h ALA 333 N 1.79 1.00 -0.04 1.25 0.00 -1.75 -1.94 119.26 119.58 1qi9 h ALA 333 Ca 0.02 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1qi9 h ALA 333 Cb 0.27 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1qi9 h ALA 333 CO -0.00 0.00 0.04 0.37 0.00 0.00 0.00 179.25 179.66 1qi9 h GLN 334 N 0.00 0.00 -0.37 0.00 5.75 -1.36 -1.28 115.11 117.86 1qi9 h GLN 334 Ca 0.00 0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.41 1qi9 h GLN 334 Cb 0.09 0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.63 1qi9 h GLN 334 CO 0.00 0.00 -0.15 -0.09 -2.65 0.00 0.00 178.83 175.94 1qi9 h ARG 335 N 0.00 0.66 -0.15 1.69 2.43 -1.57 -0.62 114.38 116.83 1qi9 h ARG 335 Ca 0.02 -0.22 -0.16 0.00 -0.81 0.00 0.00 59.98 58.81 1qi9 h ARG 335 Cb 0.10 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1qi9 h ARG 335 CO -0.00 0.79 -0.52 0.77 -1.51 0.00 0.00 179.97 179.50 1qi9 h SER 336 N 0.60 0.71 -0.79 -3.80 0.02 -1.46 -2.72 113.55 106.10 1qi9 h SER 336 Ca 0.10 -0.61 0.17 0.00 -0.84 0.00 0.00 61.79 60.61 1qi9 h SER 336 Cb 0.60 -0.21 -0.11 0.00 0.14 0.00 0.00 62.40 62.83 1qi9 h SER 336 CO 0.04 1.19 0.29 -1.28 -1.14 0.00 0.00 176.83 175.93 1qi9 h SER 337 N 0.26 0.21 -0.60 3.07 0.87 -1.26 -1.78 113.55 114.32 1qi9 h SER 337 Ca -0.02 0.13 -0.09 0.00 -1.23 0.00 0.00 61.79 60.57 1qi9 h SER 337 Cb 1.14 0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 63.21 1qi9 h SER 337 CO 0.11 0.04 0.01 -0.50 -0.53 0.00 0.00 176.83 175.95 1qi9 h TRP 338 N 0.38 1.15 -0.65 2.24 6.55 -0.90 -0.98 115.95 123.74 1qi9 h TRP 338 Ca 0.45 -0.19 0.03 0.00 0.95 0.00 0.00 58.89 60.13 1qi9 h TRP 338 Cb 0.75 -0.30 -0.04 0.00 -0.86 0.00 0.00 29.16 28.71 1qi9 h TRP 338 CO -0.19 1.01 0.40 -0.92 -1.05 0.00 0.00 178.44 177.69 1qi9 h TYR 339 N 0.97 0.75 -0.09 0.49 3.20 -1.09 -0.33 116.97 120.87 1qi9 h TYR 339 Ca 0.17 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 1qi9 h TYR 339 Cb 0.55 -0.24 -0.00 0.00 1.54 0.00 0.00 36.73 38.57 1qi9 h TYR 339 CO 0.04 0.42 0.03 1.96 -1.64 0.00 0.00 178.16 178.97 1qi9 h GLN 340 N 0.79 0.14 0.29 1.82 1.08 -1.20 0.08 115.11 118.12 1qi9 h GLN 340 Ca 0.26 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 1qi9 h GLN 340 Cb 0.03 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.42 1qi9 h GLN 340 CO -0.11 0.31 -0.32 0.87 -0.95 0.00 0.00 178.83 178.63 1qi9 h LYS 341 N -0.04 -0.62 0.00 1.46 1.57 -0.89 -1.20 116.57 116.85 1qi9 h LYS 341 Ca 0.03 0.04 -0.25 0.00 -1.87 0.00 0.00 60.65 58.60 1qi9 h LYS 341 Cb 0.22 0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 1qi9 h LYS 341 CO -0.00 -0.42 -1.72 0.91 -0.57 0.00 0.00 179.45 177.66 1qi9 n TRP 342 N -5.43 0.24 0.18 -1.35 7.02 -0.16 -0.63 117.44 117.31 1qi9 n TRP 342 Ca -0.09 0.11 0.03 0.00 -1.02 0.00 0.00 57.50 56.53 1qi9 n TRP 342 Cb 0.33 -0.85 0.31 0.00 -2.42 0.00 0.00 31.31 28.69 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 -1.16 -3.40 115.11 116.07 1qi9 h GLN 343 Ca -0.38 0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.77 1qi9 h GLN 343 Cb 1.29 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.82 1qi9 h GLN 343 CO -0.23 0.43 -0.01 0.28 -1.50 0.00 0.00 178.83 177.80 1qi9 n VAL 344 N -3.73 0.02 -0.06 -0.54 0.31 -0.85 -4.96 118.33 108.52 1qi9 n VAL 344 Ca -0.01 0.40 -0.21 0.00 -0.01 0.00 0.00 64.34 64.51 1qi9 n VAL 344 Cb 0.51 -1.41 -0.13 0.00 -0.91 0.00 0.00 33.84 31.90 1qi9 n VAL 344 CO 0.00 0.00 0.00 0.45 -1.32 0.00 0.00 176.83 175.96 1qi9 h HIS 345 N -0.01 0.20 -6.41 3.52 3.86 -1.39 -3.44 115.15 111.47 1qi9 h HIS 345 Ca 0.00 -0.15 -0.50 0.00 -1.16 0.00 0.00 60.37 58.57 1qi9 h HIS 345 Cb 0.01 -0.01 -0.08 0.00 1.06 0.00 0.00 27.41 28.39 1qi9 h HIS 345 CO -0.00 1.56 -0.78 0.54 0.86 0.00 0.00 177.93 180.11 1qi9 n ARG 346 N -4.12 -4.98 -2.60 2.45 1.74 0.20 -4.92 116.66 104.43 1qi9 n ARG 346 Ca -0.30 0.54 -0.37 0.00 -0.77 0.00 0.00 57.85 56.95 1qi9 n ARG 346 Cb 0.80 -5.40 -0.05 0.00 -1.02 0.00 0.00 32.46 26.79 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 -3.29 3.47 0.28 -1.55 5.36 -1.26 -0.52 117.98 120.46 1qi9 s PHE 347 Ca 0.69 1.70 -0.30 0.00 -0.96 0.00 0.00 56.93 58.07 1qi9 s PHE 347 Cb -0.36 -3.09 -0.10 0.00 -0.34 0.00 0.00 43.02 39.13 1qi9 s PHE 347 CO 0.85 -0.34 1.47 0.00 -1.46 0.00 0.00 175.22 175.74 1qi9 s ALA 348 N -1.54 3.64 0.79 11.12 0.00 -1.00 -1.86 121.76 132.90 1qi9 s ALA 348 Ca 0.53 1.40 -0.12 0.00 0.00 0.00 0.00 51.96 53.77 1qi9 s ALA 348 Cb -0.23 -3.57 0.07 0.00 0.00 0.00 0.00 23.12 19.39 1qi9 s ALA 348 CO 0.29 -0.82 1.13 1.03 0.00 0.00 0.00 175.76 177.40 1qi9 s ARG 349 N -0.70 1.95 0.39 0.00 1.81 -1.26 -4.71 118.95 116.43 1qi9 s ARG 349 Ca 0.59 1.43 0.10 0.00 -1.72 0.00 0.00 55.73 56.12 1qi9 s ARG 349 Cb -0.43 -1.84 0.89 0.00 -0.45 0.00 0.00 34.95 33.12 1qi9 s ARG 349 CO 0.47 -1.91 1.95 -1.35 -0.68 0.00 0.00 175.30 173.78 1qi9 h PRO 350 N -1.01 0.56 -0.20 3.54 0.11 -1.81 -1.34 132.00 131.86 1qi9 h PRO 350 Ca -0.45 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.53 1qi9 h PRO 350 Cb 1.26 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1qi9 h PRO 350 CO 0.49 0.37 -0.33 1.05 -0.21 0.00 0.00 178.00 179.37 1qi9 h GLU 351 N 0.58 0.40 -0.30 1.05 4.11 -1.92 0.99 114.58 119.50 1qi9 h GLU 351 Ca 0.33 -0.17 -0.08 0.00 0.07 0.00 0.00 59.36 59.51 1qi9 h GLU 351 Cb 0.51 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1qi9 h GLU 351 CO -0.11 0.69 -0.12 0.00 0.07 0.00 0.00 179.01 179.54 1qi9 h ALA 352 N 1.30 0.41 -0.25 1.06 0.00 -1.62 -2.30 119.26 117.87 1qi9 h ALA 352 Ca 0.04 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 1qi9 h ALA 352 Cb 0.75 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1qi9 h ALA 352 CO 0.06 0.28 -0.14 -0.07 0.00 0.00 0.00 179.25 179.38 1qi9 h LEU 353 N 0.36 0.40 -1.22 0.00 3.38 -1.22 -2.14 115.31 114.87 1qi9 h LEU 353 Ca 0.07 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1qi9 h LEU 353 Cb 0.63 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.23 1qi9 h LEU 353 CO 0.04 0.57 0.47 1.23 0.09 0.00 0.00 178.44 180.84 1qi9 h GLY 354 N 0.90 1.06 0.80 0.83 0.00 -0.61 0.47 103.07 106.52 1qi9 h GLY 354 Ca 0.07 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 1qi9 h GLY 354 CO 0.03 0.41 0.02 -1.33 0.00 0.00 0.00 176.54 175.66 1qi9 h GLY 355 N 1.03 0.23 0.86 4.60 0.00 -0.83 -0.78 103.07 108.18 1qi9 h GLY 355 Ca 0.27 -0.15 0.02 0.00 0.00 0.00 0.00 47.33 47.47 1qi9 h GLY 355 CO -0.05 0.14 0.15 -0.84 0.00 0.00 0.00 176.54 175.93 1qi9 h THR 356 N -0.02 0.99 0.66 4.70 2.02 -0.95 -0.96 112.91 119.36 1qi9 h THR 356 Ca 0.04 -0.10 -0.03 0.00 0.77 0.00 0.00 66.41 67.09 1qi9 h THR 356 Cb 0.30 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 1qi9 h THR 356 CO 0.00 0.06 -0.41 0.25 0.37 0.00 0.00 175.52 175.79 1qi9 h LEU 357 N 0.31 -1.04 -0.68 2.58 5.85 -0.89 -0.85 115.31 120.59 1qi9 h LEU 357 Ca 0.12 0.06 0.14 0.00 0.84 0.00 0.00 57.88 59.04 1qi9 h LEU 357 Cb 0.04 0.31 -0.10 0.00 0.37 0.00 0.00 40.66 41.28 1qi9 h LEU 357 CO -0.09 -0.64 0.14 -0.74 -0.34 0.00 0.00 178.44 176.78 1qi9 h HIS 358 N -1.01 0.21 -0.35 1.25 2.76 -0.92 0.12 115.15 117.21 1qi9 h HIS 358 Ca -0.08 0.04 -0.10 0.00 -2.20 0.00 0.00 60.37 58.03 1qi9 h HIS 358 Cb 0.82 0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.78 1qi9 h HIS 358 CO -0.11 -0.07 -0.20 -0.07 -1.30 0.00 0.00 177.93 176.19 1qi9 h LEU 359 N 0.25 0.67 -0.53 0.26 3.38 -1.07 -1.25 115.31 117.02 1qi9 h LEU 359 Ca 0.37 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 1qi9 h LEU 359 Cb 0.60 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1qi9 h LEU 359 CO -0.47 0.86 0.16 0.74 0.09 0.00 0.00 178.44 179.82 1qi9 h THR 360 N 0.59 1.24 -0.33 0.22 2.02 0.41 0.42 112.91 117.48 1qi9 h THR 360 Ca 0.09 -0.81 -0.05 0.00 0.77 0.00 0.00 66.41 66.42 1qi9 h THR 360 Cb 0.66 0.75 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 1qi9 h THR 360 CO 0.05 0.30 -0.00 0.40 0.37 0.00 0.00 175.52 176.63 1qi9 h ILE 361 N 0.73 1.19 0.00 3.11 2.04 -0.56 -0.76 117.51 123.26 1qi9 h ILE 361 Ca 0.17 -0.76 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1qi9 h ILE 361 Cb 0.29 0.95 0.00 0.00 -0.74 0.00 0.00 36.82 37.32 1qi9 h ILE 361 CO -0.00 0.26 0.00 0.29 0.00 0.00 0.00 178.15 178.70 1qi9 n LYS 362 N -4.29 0.07 -0.66 2.37 4.76 -0.50 -4.91 118.16 115.01 1qi9 n LYS 362 Ca 0.01 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.53 1qi9 n LYS 362 Cb 0.24 -1.58 0.00 0.00 -1.84 0.00 0.00 35.03 31.85 1qi9 n LYS 362 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1qi9 n GLY 363 N 1.36 0.66 0.05 0.72 0.00 -0.17 -4.93 105.19 102.88 1qi9 n GLY 363 Ca 0.06 -0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.06 1qi9 n GLY 363 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1qi9 n GLU 364 N -2.66 0.43 -4.37 1.61 1.02 -0.04 -4.92 120.64 111.72 1qi9 n GLU 364 Ca 0.00 -0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 56.95 1qi9 n GLU 364 Cb 0.00 -1.64 -0.10 0.00 -0.02 0.00 0.00 31.44 29.68 1qi9 n GLU 364 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1qi9 s LEU 365 N -4.39 2.14 -0.37 -4.62 1.43 -1.07 -4.94 118.68 106.85 1qi9 s LEU 365 Ca 0.01 -1.28 0.13 0.00 -1.03 0.00 0.00 54.13 51.96 1qi9 s LEU 365 Cb 0.13 -0.29 0.43 0.00 0.03 0.00 0.00 46.19 46.49 1qi9 s LEU 365 CO 0.82 -0.55 0.97 -3.20 0.23 0.00 0.00 176.35 174.62 1qi9 n ASN 366 N -0.51 2.46 -4.77 2.29 4.05 -1.26 -4.13 115.26 113.40 1qi9 n ASN 366 Ca -0.04 -3.08 -0.40 0.00 0.45 0.00 0.00 54.58 51.51 1qi9 n ASN 366 Cb 0.65 -0.52 -0.01 0.00 1.23 0.00 0.00 39.78 41.12 1qi9 n ASN 366 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1qi9 s ALA 367 N -3.19 3.46 0.00 5.20 0.00 -1.26 -4.88 121.76 121.09 1qi9 s ALA 367 Ca 0.35 1.31 -0.05 0.00 0.00 0.00 0.00 51.96 53.58 1qi9 s ALA 367 Cb 0.42 -3.50 -0.23 0.00 0.00 0.00 0.00 23.12 19.81 1qi9 s ALA 367 CO -0.05 -0.75 3.22 -3.47 0.00 0.00 0.00 175.76 174.71 1qi9 n ASP 368 N 0.60 4.74 -4.75 0.00 2.03 -1.26 -4.94 116.55 112.97 1qi9 n ASP 368 Ca 0.01 -2.38 -0.34 0.00 0.52 0.00 0.00 54.79 52.60 1qi9 n ASP 368 Cb 0.42 -1.26 0.05 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 1.12 2.42 0.43 -0.67 0.08 -1.26 -4.18 117.98 115.92 1qi9 s PHE 369 Ca 0.56 1.56 -0.26 0.00 0.12 0.00 0.00 56.93 58.92 1qi9 s PHE 369 Cb 0.27 -3.32 -0.09 0.00 -0.57 0.00 0.00 43.02 39.31 1qi9 s PHE 369 CO 0.00 -2.02 1.41 0.34 -0.10 0.00 0.00 175.22 174.85 1qi9 s ASP 370 N -2.17 6.04 0.66 1.36 2.15 -1.23 -4.77 116.67 118.72 1qi9 s ASP 370 Ca 0.71 2.88 0.43 0.00 0.43 0.00 0.00 52.55 57.00 1qi9 s ASP 370 Cb -0.25 -2.65 2.36 0.00 -0.30 0.00 0.00 42.92 42.08 1qi9 s ASP 370 CO 0.39 -1.06 2.36 -0.07 -0.17 0.00 0.00 175.17 176.62 1qi9 h LEU 371 N 2.50 0.00 -1.85 -1.34 3.38 -1.91 0.13 115.31 116.22 1qi9 h LEU 371 Ca -0.51 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.46 1qi9 h LEU 371 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1qi9 h LEU 371 CO 0.62 0.00 0.00 0.77 0.09 0.00 0.00 178.44 179.92 1qi9 h SER 372 N 0.00 0.00 0.00 -0.43 4.64 -1.94 0.82 113.55 116.64 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 0.02 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.05 1qi9 h SER 372 CO 0.00 0.00 -2.26 -0.11 -0.87 0.00 0.00 176.83 173.59 1qi9 n LEU 373 N -2.79 2.03 0.15 5.97 7.94 0.42 -4.10 117.00 126.63 1qi9 n LEU 373 Ca -0.01 0.16 0.05 0.00 -1.11 0.00 0.00 56.01 55.10 1qi9 n LEU 373 Cb 0.16 -0.70 0.51 0.00 0.53 0.00 0.00 43.42 43.92 1qi9 n LEU 373 CO 0.20 0.59 1.03 0.25 -1.11 0.00 0.00 177.39 178.35 1qi9 h LEU 374 N -0.57 0.18 -3.37 -1.96 5.85 -1.40 -1.38 115.31 112.65 1qi9 h LEU 374 Ca -0.55 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.14 1qi9 h LEU 374 Cb 1.58 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.56 1qi9 h LEU 374 CO -0.27 0.20 0.01 -0.62 -0.34 0.00 0.00 178.44 177.42 1qi9 n GLU 375 N -4.43 3.55 -2.79 1.25 1.02 0.27 -4.86 120.64 114.64 1qi9 n GLU 375 Ca -0.01 -2.96 -0.43 0.00 -0.02 0.00 0.00 57.16 53.73 1qi9 n GLU 375 Cb 0.15 -1.99 -0.00 0.00 -0.02 0.00 0.00 31.44 29.57 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 -1.57 6.93 0.17 1.62 3.84 -0.52 -4.82 114.94 120.59 1qi9 s ASN 376 Ca 0.47 -2.66 -0.14 0.00 0.21 0.00 0.00 52.86 50.74 1qi9 s ASN 376 Cb 0.37 -2.47 0.10 0.00 -0.55 0.00 0.00 41.25 38.70 1qi9 s ASN 376 CO 0.11 -0.96 1.81 0.00 -2.79 0.00 0.00 177.10 175.27 1qi9 h ALA 377 N 7.55 0.64 -0.77 1.71 0.00 -1.89 -0.84 119.26 125.66 1qi9 h ALA 377 Ca 0.35 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.32 1qi9 h ALA 377 Cb 0.89 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.48 1qi9 h ALA 377 CO 1.32 -0.01 0.45 1.49 0.00 0.00 0.00 179.25 182.50 1qi9 h GLU 378 N 0.58 0.78 0.00 0.00 4.57 -1.99 -0.52 114.58 118.00 1qi9 h GLU 378 Ca 0.20 -0.05 -0.05 0.00 -1.18 0.00 0.00 59.36 58.28 1qi9 h GLU 378 Cb 0.04 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.46 1qi9 h GLU 378 CO -0.10 0.51 -0.21 1.25 -1.18 0.00 0.00 179.01 179.28 1qi9 h LEU 379 N 0.80 0.18 -1.03 1.64 5.85 -1.92 -3.24 115.31 117.58 1qi9 h LEU 379 Ca 0.35 -0.79 -0.09 0.00 0.84 0.00 0.00 57.88 58.19 1qi9 h LEU 379 Cb 0.24 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1qi9 h LEU 379 CO -0.20 0.95 -0.32 -0.07 -0.34 0.00 0.00 178.44 178.46 1qi9 h LEU 380 N -0.57 0.30 -0.61 2.25 3.38 -1.03 -1.89 115.31 117.14 1qi9 h LEU 380 Ca -0.03 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1qi9 h LEU 380 Cb 0.98 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 1qi9 h LEU 380 CO 0.04 0.61 0.01 0.11 0.09 0.00 0.00 178.44 179.30 1qi9 h LYS 381 N 0.26 1.07 -0.48 1.13 1.57 -1.23 0.11 116.57 118.99 1qi9 h LYS 381 Ca 0.03 -0.34 -0.09 0.00 -1.87 0.00 0.00 60.65 58.39 1qi9 h LYS 381 Cb 0.69 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.89 1qi9 h LYS 381 CO 0.05 1.04 -0.06 0.00 -0.57 0.00 0.00 179.45 179.91 1qi9 h ARG 382 N 0.97 0.84 0.06 3.15 3.08 -1.46 -1.53 114.38 119.49 1qi9 h ARG 382 Ca 0.17 -0.26 -0.00 0.00 0.07 0.00 0.00 59.98 59.96 1qi9 h ARG 382 Cb 0.55 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1qi9 h ARG 382 CO 0.03 0.88 -0.03 0.28 -1.07 0.00 0.00 179.97 180.06 1qi9 h VAL 383 N 0.77 1.12 -0.62 2.04 2.07 -1.07 -1.75 116.25 118.81 1qi9 h VAL 383 Ca 0.14 -0.62 0.13 0.00 0.82 0.00 0.00 66.70 67.16 1qi9 h VAL 383 Cb 0.54 1.54 -0.11 0.00 -1.52 0.00 0.00 31.29 31.74 1qi9 h VAL 383 CO 0.03 0.16 -0.03 0.00 0.02 0.00 0.00 177.57 177.75 1qi9 h ALA 384 N 0.56 0.58 -0.67 1.67 0.00 -0.92 -1.48 119.26 119.00 1qi9 h ALA 384 Ca -0.01 0.20 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1qi9 h ALA 384 Cb 0.32 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1qi9 h ALA 384 CO 0.01 -0.40 0.15 0.00 0.00 0.00 0.00 179.25 179.01 1qi9 h ALA 385 N 1.58 0.89 -0.02 0.00 0.00 -1.15 -0.80 119.26 119.76 1qi9 h ALA 385 Ca 0.32 -0.25 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 1qi9 h ALA 385 Cb 0.52 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1qi9 h ALA 385 CO -0.55 0.62 -0.71 0.97 0.00 0.00 0.00 179.25 179.57 1qi9 h ILE 386 N 1.01 1.47 -0.03 0.00 2.10 -0.78 -2.53 117.51 118.76 1qi9 h ILE 386 Ca 0.21 -2.34 -0.05 0.00 1.08 0.00 0.00 64.86 63.76 1qi9 h ILE 386 Cb 0.39 2.26 0.00 0.00 -1.09 0.00 0.00 36.82 38.38 1qi9 h ILE 386 CO 0.01 0.68 -0.16 0.78 -1.08 0.00 0.00 178.15 178.37 1qi9 h ASN 387 N 0.07 0.19 -0.97 2.19 2.35 -1.24 -3.03 115.58 115.13 1qi9 h ASN 387 Ca -0.01 -0.67 0.05 0.00 -0.55 0.00 0.00 56.30 55.11 1qi9 h ASN 387 Cb 1.26 -0.06 -0.06 0.00 0.05 0.00 0.00 38.32 39.51 1qi9 h ASN 387 CO 0.10 0.83 0.64 0.00 -1.65 0.00 0.00 177.43 177.35 1qi9 h ALA 388 N 0.36 1.41 -0.36 -0.83 0.00 -1.18 0.21 119.26 118.87 1qi9 h ALA 388 Ca -0.01 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1qi9 h ALA 388 Cb 0.83 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1qi9 h ALA 388 CO 0.03 0.47 0.24 0.00 0.00 0.00 0.00 179.25 180.00 1qi9 h ALA 389 N 1.45 1.75 0.19 0.00 0.00 -1.41 -3.10 119.26 118.15 1qi9 h ALA 389 Ca 0.41 -0.02 -0.34 0.00 0.00 0.00 0.00 54.91 54.95 1qi9 h ALA 389 Cb 0.10 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.76 1qi9 h ALA 389 CO -0.14 0.23 -1.68 0.37 0.00 0.00 0.00 179.25 178.03 1qi9 h GLN 390 N 0.49 0.39 -7.18 0.00 5.75 -1.17 -3.48 115.11 109.91 1qi9 h GLN 390 Ca 0.13 -0.67 -0.47 0.00 -0.15 0.00 0.00 58.65 57.49 1qi9 h GLN 390 Cb -0.05 0.25 0.01 0.00 1.07 0.00 0.00 27.48 28.77 1qi9 h GLN 390 CO -0.03 1.31 0.36 -0.80 -2.65 0.00 0.00 178.83 177.02 1qi9 s ASN 391 N -7.29 6.62 0.19 -0.69 0.01 0.65 -4.99 114.94 109.44 1qi9 s ASN 391 Ca -0.14 1.55 -0.32 0.00 -0.71 0.00 0.00 52.86 53.25 1qi9 s ASN 391 Cb 0.05 -2.50 -0.11 0.00 0.41 0.00 0.00 41.25 39.10 1qi9 s ASN 391 CO 0.87 -0.58 1.68 -2.16 -1.51 0.00 0.00 177.10 175.40 1qi9 s PRO 392 N -4.05 4.15 -0.91 -0.60 0.04 -1.26 -1.16 135.00 131.21 1qi9 s PRO 392 Ca 0.59 2.53 0.00 0.00 0.04 0.00 0.00 61.00 64.16 1qi9 s PRO 392 Cb -0.10 -3.11 0.00 0.00 0.04 0.00 0.00 34.50 31.33 1qi9 s PRO 392 CO 0.31 -0.71 0.00 0.09 0.04 0.00 0.00 177.00 176.73 1qi9 n ASN 393 N 4.02 -4.47 -3.44 6.66 5.03 -1.26 -2.98 115.26 118.82 1qi9 n ASN 393 Ca 0.15 0.21 -0.25 0.00 0.87 0.00 0.00 54.58 55.56 1qi9 n ASN 393 Cb 0.36 -2.72 0.02 0.00 -1.02 0.00 0.00 39.78 36.41 1qi9 n ASN 393 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 1qi9 n ASN 394 N -0.06 -4.66 -4.73 6.41 4.13 -0.31 -4.90 115.26 111.14 1qi9 n ASN 394 Ca -0.09 -0.47 -0.42 0.00 1.68 0.00 0.00 54.58 55.28 1qi9 n ASN 394 Cb 0.35 -3.78 -0.03 0.00 -1.54 0.00 0.00 39.78 34.78 1qi9 n ASN 394 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1qi9 s GLU 395 N -6.11 4.32 0.04 3.52 2.12 -1.16 -4.68 118.70 116.74 1qi9 s GLU 395 Ca 0.45 2.15 -0.30 0.00 0.36 0.00 0.00 54.97 57.64 1qi9 s GLU 395 Cb -0.23 -3.19 -0.04 0.00 0.26 0.00 0.00 34.13 30.93 1qi9 s GLU 395 CO 0.56 -0.39 1.01 0.08 -0.54 0.00 0.00 175.26 175.98 1qi9 s VAL 396 N 0.53 4.63 0.11 3.70 1.01 -1.26 -3.72 120.40 125.41 1qi9 s VAL 396 Ca 0.61 1.96 0.02 0.00 0.00 0.00 0.00 61.98 64.57 1qi9 s VAL 396 Cb -0.39 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.70 1qi9 s VAL 396 CO 0.36 0.19 -0.06 0.42 0.00 0.00 0.00 175.10 176.01 1qi9 s THR 397 N 0.77 0.70 -0.21 3.92 -4.23 -1.26 -4.99 115.64 110.34 1qi9 s THR 397 Ca 0.52 -1.95 0.14 0.00 -1.18 0.00 0.00 61.69 59.22 1qi9 s THR 397 Cb -0.23 -1.74 0.46 0.00 1.34 0.00 0.00 72.50 72.33 1qi9 s THR 397 CO 0.29 -0.82 1.36 -1.22 -0.54 0.00 0.00 174.62 173.69 1qi9 n TYR 398 N -0.07 0.70 -1.70 3.99 4.02 -1.26 -3.99 117.16 118.84 1qi9 n TYR 398 Ca -0.11 -1.24 -0.34 0.00 -0.01 0.00 0.00 57.90 56.19 1qi9 n TYR 398 Cb 0.61 -0.34 0.06 0.00 -0.02 0.00 0.00 39.34 39.65 1qi9 n TYR 398 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1qi9 s LEU 399 N -3.04 3.44 -0.27 7.72 1.43 -1.26 -4.53 118.68 122.17 1qi9 s LEU 399 Ca 0.41 2.24 -0.29 0.00 -1.03 0.00 0.00 54.13 55.46 1qi9 s LEU 399 Cb 0.36 -4.58 0.00 0.00 0.03 0.00 0.00 46.19 42.00 1qi9 s LEU 399 CO 0.02 -1.87 1.25 -0.22 0.23 0.00 0.00 176.35 175.77 1qi9 s LEU 400 N -4.76 3.97 0.09 1.79 2.96 -1.26 -4.95 118.68 116.52 1qi9 s LEU 400 Ca 0.73 1.30 -0.31 0.00 -0.22 0.00 0.00 54.13 55.63 1qi9 s LEU 400 Cb -0.26 -3.54 -0.09 0.00 0.50 0.00 0.00 46.19 42.79 1qi9 s LEU 400 CO 0.40 -0.96 1.78 -2.84 -1.32 0.00 0.00 176.35 173.41 1qi9 s PRO 401 N 3.90 4.16 0.01 0.98 0.02 -1.26 -4.83 135.00 137.98 1qi9 s PRO 401 Ca 0.54 2.49 -0.07 0.00 0.02 0.00 0.00 61.00 63.98 1qi9 s PRO 401 Cb -0.17 -3.66 -0.05 0.00 0.02 0.00 0.00 34.50 30.64 1qi9 s PRO 401 CO 0.19 -0.82 0.28 -0.65 -0.33 0.00 0.00 177.00 175.68 1qi9 s GLN 402 N 2.90 3.60 0.00 5.54 -1.52 -0.29 -4.75 119.66 125.14 1qi9 s GLN 402 Ca 0.79 -0.04 0.30 0.00 -1.95 0.00 0.00 55.36 54.46 1qi9 s GLN 402 Cb -0.43 -3.08 1.51 0.00 -0.22 0.00 0.00 33.01 30.79 1qi9 s GLN 402 CO 0.35 0.64 2.02 0.00 -0.25 0.00 0.00 175.29 178.05 1qi9 n ALA 403 N 1.13 2.66 -2.86 6.09 0.00 -0.56 -0.49 120.51 126.48 1qi9 n ALA 403 Ca -0.11 -0.25 -0.15 0.00 0.00 0.00 0.00 53.44 52.93 1qi9 n ALA 403 Cb 0.53 -1.40 -0.14 0.00 0.00 0.00 0.00 19.45 18.43 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 -2.24 0.25 0.43 0.00 -4.36 -1.26 -4.88 121.20 109.14 1qi9 s ILE 404 Ca 0.38 -0.12 0.09 0.00 -0.26 0.00 0.00 60.65 60.73 1qi9 s ILE 404 Cb 0.21 -0.22 0.27 0.00 1.25 0.00 0.00 42.46 43.96 1qi9 s ILE 404 CO 0.41 0.08 2.08 1.56 0.24 0.00 0.00 174.94 179.30 1qi9 h GLN 405 N 6.14 0.44 0.00 0.37 1.08 -1.87 -2.35 115.11 118.93 1qi9 h GLN 405 Ca -0.27 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 1qi9 h GLN 405 Cb 1.19 -0.10 0.00 0.00 -0.05 0.00 0.00 27.48 28.52 1qi9 h GLN 405 CO 0.50 0.29 -0.19 -0.85 -0.95 0.00 0.00 178.83 177.64 1qi9 n GLU 406 N -4.49 0.24 0.00 1.46 0.28 -1.26 -4.53 120.64 112.34 1qi9 n GLU 406 Ca 0.02 0.16 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 1qi9 n GLU 406 Cb 0.07 -1.74 0.00 0.00 1.43 0.00 0.00 31.44 31.20 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 1.34 0.11 3.82 -1.84 0.00 -0.89 -4.82 105.19 102.91 1qi9 n GLY 407 Ca 0.05 -0.96 -0.31 0.00 0.00 0.00 0.00 46.02 44.80 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 5.40 0.85 1.61 1.04 -1.26 -4.97 113.70 112.37 1qi9 s SER 408 Ca 0.00 1.60 -0.13 0.00 0.48 0.00 0.00 55.95 57.90 1qi9 s SER 408 Cb 0.00 -2.48 0.08 0.00 0.10 0.00 0.00 66.02 63.72 1qi9 s SER 408 CO 0.00 -1.43 0.97 -2.65 0.98 0.00 0.00 173.24 171.11 1qi9 n PRO 409 N -3.12 -0.04 -1.75 4.02 -0.02 -1.26 -4.85 135.00 127.97 1qi9 n PRO 409 Ca 0.07 0.06 -0.41 0.00 -2.02 0.00 0.00 63.50 61.20 1qi9 n PRO 409 Cb 0.54 -2.25 -0.01 0.00 -0.02 0.00 0.00 33.50 31.76 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 -3.48 4.01 -3.53 3.45 -1.04 -1.26 -4.80 114.28 107.64 1qi9 n THR 410 Ca 0.12 -3.27 -0.14 0.00 -2.04 0.00 0.00 64.05 58.71 1qi9 n THR 410 Cb 0.51 -2.52 -0.05 0.00 -1.82 0.00 0.00 70.33 66.46 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 2.01 -0.51 0.83 -1.42 -3.43 -1.26 -1.42 115.29 110.09 1qi9 s HIS 411 Ca 0.52 0.60 -0.13 0.00 -0.80 0.00 0.00 55.06 55.25 1qi9 s HIS 411 Cb 0.15 0.41 0.07 0.00 -1.43 0.00 0.00 32.58 31.77 1qi9 s HIS 411 CO -0.07 -0.68 0.98 -2.30 -2.00 0.00 0.00 174.74 170.67 1qi9 n PRO 412 N 0.35 0.04 -0.16 -0.38 -0.02 -1.26 -4.94 135.00 128.63 1qi9 n PRO 412 Ca -0.18 0.08 -0.10 0.00 -2.02 0.00 0.00 63.50 61.29 1qi9 n PRO 412 Cb 0.61 -2.26 -0.00 0.00 -0.02 0.00 0.00 33.50 31.83 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 -1.06 0.72 -3.36 2.55 0.87 -1.65 -3.46 113.55 108.16 1qi9 h SER 413 Ca -0.45 -0.26 -0.65 0.00 -1.23 0.00 0.00 61.79 59.20 1qi9 h SER 413 Cb 1.30 -0.19 -0.25 0.00 -0.44 0.00 0.00 62.40 62.82 1qi9 h SER 413 CO 0.43 0.80 -0.70 -0.47 -0.53 0.00 0.00 176.83 176.35 1qi9 s TYR 414 N -5.18 2.96 0.64 2.24 5.04 -1.26 -3.51 117.35 118.27 1qi9 s TYR 414 Ca -0.13 -0.60 -0.07 0.00 -2.44 0.00 0.00 57.07 53.83 1qi9 s TYR 414 Cb 0.11 -2.00 0.14 0.00 0.35 0.00 0.00 41.96 40.55 1qi9 s TYR 414 CO 0.79 -0.27 0.87 -0.35 -1.34 0.00 0.00 175.55 175.25 1qi9 n PRO 415 N 4.05 -0.48 -2.62 4.97 -0.04 -1.26 -3.00 135.00 136.63 1qi9 n PRO 415 Ca -0.18 -1.74 -0.42 0.00 -0.04 0.00 0.00 63.50 61.12 1qi9 n PRO 415 Cb 0.52 -0.77 -0.03 0.00 -0.04 0.00 0.00 33.50 33.18 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 -4.31 7.31 0.22 3.54 0.15 -0.90 -4.87 113.70 114.83 1qi9 s SER 416 Ca 0.52 1.81 -0.01 0.00 0.70 0.00 0.00 55.95 58.97 1qi9 s SER 416 Cb -0.02 -2.58 0.19 0.00 -1.71 0.00 0.00 66.02 61.90 1qi9 s SER 416 CO 0.36 -0.28 1.56 1.23 1.20 0.00 0.00 173.24 177.32 1qi9 h GLY 417 N 6.43 0.57 1.01 9.45 0.00 -1.90 -1.14 103.07 117.48 1qi9 h GLY 417 Ca -0.42 -0.61 -0.01 0.00 0.00 0.00 0.00 47.33 46.30 1qi9 h GLY 417 CO 0.76 0.55 0.44 0.45 0.00 0.00 0.00 176.54 178.74 1qi9 h HIS 418 N 0.41 1.01 -0.31 5.60 3.86 -1.96 -1.05 115.15 122.71 1qi9 h HIS 418 Ca 0.02 -0.01 -0.13 0.00 -1.16 0.00 0.00 60.37 59.09 1qi9 h HIS 418 Cb 0.99 -0.33 -0.00 0.00 1.06 0.00 0.00 27.41 29.12 1qi9 h HIS 418 CO 0.04 0.69 -0.32 0.00 0.86 0.00 0.00 177.93 179.20 1qi9 h ALA 419 N 1.23 0.45 -0.31 2.45 0.00 -1.84 -0.63 119.26 120.62 1qi9 h ALA 419 Ca 0.27 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 1qi9 h ALA 419 Cb -0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1qi9 h ALA 419 CO -0.05 0.49 0.18 1.15 0.00 0.00 0.00 179.25 181.03 1qi9 h THR 420 N 0.52 1.11 -0.06 0.00 2.02 -1.11 0.00 112.91 115.39 1qi9 h THR 420 Ca 0.05 -0.26 -0.15 0.00 0.77 0.00 0.00 66.41 66.81 1qi9 h THR 420 Cb 0.89 0.73 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 1qi9 h THR 420 CO 0.08 0.11 -0.63 0.06 0.37 0.00 0.00 175.52 175.50 1qi9 h GLN 421 N 0.39 0.22 0.00 6.66 3.07 -1.21 -1.92 115.11 122.32 1qi9 h GLN 421 Ca 0.11 -0.16 -0.10 0.00 0.09 0.00 0.00 58.65 58.59 1qi9 h GLN 421 Cb 0.02 0.03 -0.01 0.00 0.08 0.00 0.00 27.48 27.59 1qi9 h GLN 421 CO -0.02 0.78 -0.48 -0.91 0.09 0.00 0.00 178.83 178.29 1qi9 h ASN 422 N 0.16 0.00 -0.33 0.06 2.35 -0.84 0.41 115.58 117.39 1qi9 h ASN 422 Ca -0.01 0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.60 1qi9 h ASN 422 Cb 1.15 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.51 1qi9 h ASN 422 CO 0.10 0.48 -0.33 1.23 -1.65 0.00 0.00 177.43 177.25 1qi9 h GLY 423 N 2.25 0.88 1.01 2.83 0.00 -0.70 -0.44 103.07 108.90 1qi9 h GLY 423 Ca -0.00 -0.90 -0.03 0.00 0.00 0.00 0.00 47.33 46.39 1qi9 h GLY 423 CO 0.06 0.82 0.28 0.00 0.00 0.00 0.00 176.54 177.69 1qi9 h ALA 424 N 0.74 0.84 -0.24 3.60 0.00 -0.72 -2.36 119.26 121.12 1qi9 h ALA 424 Ca 0.05 -0.16 -0.18 0.00 0.00 0.00 0.00 54.91 54.62 1qi9 h ALA 424 Cb 0.91 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1qi9 h ALA 424 CO 0.08 0.44 -0.56 0.74 0.00 0.00 0.00 179.25 179.95 1qi9 h PHE 425 N 0.90 0.92 -0.65 0.00 0.04 -0.71 -1.40 116.94 116.04 1qi9 h PHE 425 Ca 0.22 -0.33 -0.02 0.00 2.80 0.00 0.00 57.97 60.63 1qi9 h PHE 425 Cb 0.18 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 38.12 1qi9 h PHE 425 CO 0.01 1.12 0.31 0.00 -0.60 0.00 0.00 178.31 179.15 1qi9 h ALA 426 N 0.80 1.33 -0.20 2.45 0.00 -1.02 -1.55 119.26 121.06 1qi9 h ALA 426 Ca 0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1qi9 h ALA 426 Cb 1.15 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.67 1qi9 h ALA 426 CO 0.12 0.52 -0.03 1.15 0.00 0.00 0.00 179.25 181.01 1qi9 h THR 427 N 0.91 1.28 -0.08 0.00 2.02 -0.87 -1.67 112.91 114.50 1qi9 h THR 427 Ca 0.22 -0.98 0.04 0.00 0.77 0.00 0.00 66.41 66.46 1qi9 h THR 427 Cb 0.10 1.51 -0.04 0.00 -1.74 0.00 0.00 68.15 67.97 1qi9 h THR 427 CO -0.03 0.30 -0.17 0.58 0.37 0.00 0.00 175.52 176.57 1qi9 h VAL 428 N 0.12 0.57 0.17 3.16 2.07 -1.05 -0.69 116.25 120.60 1qi9 h VAL 428 Ca 0.05 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1qi9 h VAL 428 Cb 0.46 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1qi9 h VAL 428 CO 0.02 0.00 -0.13 -0.07 0.02 0.00 0.00 177.57 177.41 1qi9 h LEU 429 N -0.23 -0.34 -0.88 2.57 3.38 -1.21 -2.04 115.31 116.57 1qi9 h LEU 429 Ca 0.08 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.14 1qi9 h LEU 429 Cb 0.35 0.11 -0.06 0.00 0.09 0.00 0.00 40.66 41.15 1qi9 h LEU 429 CO -0.22 -0.21 0.55 0.11 0.09 0.00 0.00 178.44 178.76 1qi9 h LYS 430 N -0.31 0.98 -0.68 1.13 1.57 -1.12 -1.09 116.57 117.04 1qi9 h LYS 430 Ca -0.01 -0.06 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1qi9 h LYS 430 Cb 0.28 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.34 1qi9 h LYS 430 CO -0.01 0.65 0.12 0.00 -0.57 0.00 0.00 179.45 179.63 1qi9 h ALA 431 N 1.41 0.91 0.01 3.86 0.00 -0.85 0.13 119.26 124.73 1qi9 h ALA 431 Ca 0.38 -0.27 -0.22 0.00 0.00 0.00 0.00 54.91 54.80 1qi9 h ALA 431 Cb 0.15 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1qi9 h ALA 431 CO -0.17 0.67 -0.94 -0.07 0.00 0.00 0.00 179.25 178.74 1qi9 h LEU 432 N 1.06 0.42 -0.65 0.00 3.38 -1.15 -3.05 115.31 115.32 1qi9 h LEU 432 Ca 0.21 -0.34 -0.15 0.00 0.09 0.00 0.00 57.88 57.69 1qi9 h LEU 432 Cb 0.44 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1qi9 h LEU 432 CO 0.01 1.15 -0.62 0.40 0.09 0.00 0.00 178.44 179.48 1qi9 h ILE 433 N 0.17 1.40 0.00 1.22 2.04 -1.05 -3.42 117.51 117.87 1qi9 h ILE 433 Ca -0.07 -2.02 0.00 0.00 1.00 0.00 0.00 64.86 63.77 1qi9 h ILE 433 Cb 1.58 2.04 0.00 0.00 -0.74 0.00 0.00 36.82 39.70 1qi9 h ILE 433 CO 0.16 0.59 0.00 0.61 0.00 0.00 0.00 178.15 179.51 1qi9 n GLY 434 N 0.29 -1.52 0.18 5.37 0.00 0.45 -4.34 105.19 105.62 1qi9 n GLY 434 Ca -0.02 -1.50 -0.04 0.00 0.00 0.00 0.00 46.02 44.46 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 0.13 0.43 0.99 5.85 -1.52 0.14 115.31 121.33 1qi9 h LEU 435 Ca 0.00 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1qi9 h LEU 435 Cb 0.00 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1qi9 h LEU 435 CO 0.00 0.11 -0.30 -0.78 -0.34 0.00 0.00 178.44 177.12 1qi9 h ASP 436 N 0.30 -0.79 0.47 1.25 3.58 -1.88 -2.15 116.42 117.20 1qi9 h ASP 436 Ca 0.21 0.06 -0.08 0.00 0.42 0.00 0.00 57.03 57.64 1qi9 h ASP 436 Cb 0.21 0.25 -0.01 0.00 1.72 0.00 0.00 39.33 41.49 1qi9 h ASP 436 CO -0.22 -0.46 -0.36 0.03 -2.88 0.00 0.00 179.24 175.35 1qi9 h ARG 437 N -0.72 0.00 -0.37 0.28 3.08 -1.74 -2.27 114.38 112.65 1qi9 h ARG 437 Ca -0.04 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.07 1qi9 h ARG 437 Cb 0.61 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 1qi9 h ARG 437 CO 0.01 0.36 0.25 0.78 -1.07 0.00 0.00 179.97 180.31 1qi9 h GLY 438 N 1.30 0.27 0.47 0.04 0.00 -0.48 -1.55 103.07 103.12 1qi9 h GLY 438 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 47.33 47.24 1qi9 h GLY 438 CO 0.05 0.06 -0.16 0.61 0.00 0.00 0.00 176.54 177.10 1qi9 n GLY 439 N -1.55 -0.70 3.80 4.60 0.00 -0.85 -1.15 105.19 109.34 1qi9 n GLY 439 Ca 0.05 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.42 5.33 0.16 1.61 1.01 -0.58 -4.77 116.67 117.01 1qi9 s ASP 440 Ca 0.28 1.78 -0.26 0.00 0.71 0.00 0.00 52.55 55.07 1qi9 s ASP 440 Cb 0.20 -2.52 -0.08 0.00 1.01 0.00 0.00 42.92 41.53 1qi9 s ASP 440 CO 0.47 -1.48 0.81 0.00 0.21 0.00 0.00 175.17 175.18 1qi9 s TYR 442 N -1.00 2.56 0.23 0.00 6.14 0.14 -4.85 117.35 120.55 1qi9 s TYR 442 Ca 0.37 0.38 -0.30 0.00 0.64 0.00 0.00 57.07 58.17 1qi9 s TYR 442 Cb -0.23 -3.96 -0.09 0.00 0.42 0.00 0.00 41.96 38.10 1qi9 s TYR 442 CO 0.27 -3.78 1.05 -1.25 0.64 0.00 0.00 175.55 172.49 1qi9 s PRO 443 N 2.32 4.68 -1.28 4.97 0.04 -1.26 -4.08 135.00 140.40 1qi9 s PRO 443 Ca 0.73 1.68 -0.14 0.00 0.04 0.00 0.00 61.00 63.31 1qi9 s PRO 443 Cb -0.41 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 30.89 1qi9 s PRO 443 CO 0.32 0.24 0.59 -0.25 0.04 0.00 0.00 177.00 177.94 1qi9 n ASP 444 N 1.75 -2.85 -4.76 6.66 8.00 -1.26 -4.91 116.55 119.19 1qi9 n ASP 444 Ca 0.00 -1.07 -0.37 0.00 0.71 0.00 0.00 54.79 54.06 1qi9 n ASP 444 Cb 0.46 -2.91 0.02 0.00 -0.02 0.00 0.00 41.12 38.67 1qi9 n ASP 444 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1qi9 s PRO 445 N -6.50 3.32 0.25 -0.24 0.04 -1.26 -4.88 135.00 125.73 1qi9 s PRO 445 Ca 0.27 1.96 0.01 0.00 0.04 0.00 0.00 61.00 63.28 1qi9 s PRO 445 Cb -0.11 -2.22 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 1qi9 s PRO 445 CO 0.90 -0.97 0.13 0.14 0.04 0.00 0.00 177.00 177.24 1qi9 s VAL 446 N -1.47 0.31 -0.10 -0.36 -7.23 -1.26 -0.43 120.40 109.87 1qi9 s VAL 446 Ca 0.70 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.80 1qi9 s VAL 446 Cb -0.34 -2.56 0.03 0.00 0.56 0.00 0.00 36.38 34.07 1qi9 s VAL 446 CO 0.39 0.00 0.25 -0.72 -0.31 0.00 0.00 175.10 174.71 1qi9 s TYR 447 N -3.84 -0.29 0.61 2.82 -0.85 -0.48 -4.78 117.35 110.54 1qi9 s TYR 447 Ca 0.38 0.70 -0.19 0.00 -0.52 0.00 0.00 57.07 57.44 1qi9 s TYR 447 Cb 0.07 0.08 -0.03 0.00 0.38 0.00 0.00 41.96 42.46 1qi9 s TYR 447 CO 0.14 -0.16 1.26 -2.14 -1.52 0.00 0.00 175.55 173.14 1qi9 s PRO 448 N 0.44 2.80 1.00 -3.49 0.02 -1.26 0.65 135.00 135.16 1qi9 s PRO 448 Ca -0.03 1.98 -0.14 0.00 0.02 0.00 0.00 61.00 62.83 1qi9 s PRO 448 Cb -0.04 -1.92 0.19 0.00 0.02 0.00 0.00 34.50 32.74 1qi9 s PRO 448 CO -0.02 -1.38 1.14 0.16 -0.33 0.00 0.00 177.00 176.56 1qi9 s ASP 449 N -1.44 2.72 0.55 2.53 1.47 0.37 -4.80 116.67 118.07 1qi9 s ASP 449 Ca 0.79 0.89 0.28 0.00 1.18 0.00 0.00 52.55 55.69 1qi9 s ASP 449 Cb -0.35 -1.38 1.62 0.00 -0.34 0.00 0.00 42.92 42.47 1qi9 s ASP 449 CO 0.37 -3.04 2.16 0.44 0.68 0.00 0.00 175.17 175.79 1qi9 h ASP 450 N -1.83 0.00 0.53 2.11 3.32 -1.93 0.24 116.42 118.85 1qi9 h ASP 450 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.55 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 0.54 0.06 -0.33 0.47 -1.72 0.00 0.00 179.24 178.26 1qi9 n ASP 451 N -3.78 0.49 -1.47 6.45 8.00 -1.26 -4.87 116.55 120.11 1qi9 n ASP 451 Ca -0.02 -0.26 -0.12 0.00 0.71 0.00 0.00 54.79 55.09 1qi9 n ASP 451 Cb 0.16 0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.33 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 1.45 -0.08 0.04 0.44 0.00 0.83 -4.76 105.19 103.11 1qi9 n GLY 452 Ca 0.08 -0.36 0.01 0.00 0.00 0.00 0.00 46.02 45.75 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 -1.88 0.00 -4.03 0.99 4.77 -1.26 -0.25 117.00 115.35 1qi9 n LEU 453 Ca -0.12 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.76 1qi9 n LEU 453 Cb 0.59 0.16 -0.11 0.00 -2.33 0.00 0.00 43.42 41.73 1qi9 n LEU 453 CO 0.19 0.16 -0.38 -0.54 -1.33 0.00 0.00 177.39 175.49 1qi9 s LYS 454 N -2.70 0.44 -0.09 3.23 -0.14 -1.26 -4.99 119.74 114.24 1qi9 s LYS 454 Ca -0.06 -0.74 -0.15 0.00 -1.36 0.00 0.00 55.97 53.66 1qi9 s LYS 454 Cb 0.07 -0.07 -0.05 0.00 -1.68 0.00 0.00 37.83 36.10 1qi9 s LYS 454 CO 0.59 -0.01 0.38 -0.51 -0.76 0.00 0.00 175.35 175.04 1qi9 s LEU 455 N -1.66 4.35 -0.13 3.17 1.43 -1.26 -0.48 118.68 124.10 1qi9 s LEU 455 Ca -0.11 0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 53.73 1qi9 s LEU 455 Cb -0.08 -2.54 -0.03 0.00 0.03 0.00 0.00 46.19 43.57 1qi9 s LEU 455 CO -0.01 0.17 -0.01 -0.63 0.23 0.00 0.00 176.35 176.10 1qi9 s ILE 456 N -0.14 4.17 0.05 -0.59 -1.09 0.21 -4.90 121.20 118.91 1qi9 s ILE 456 Ca 0.22 -0.28 -0.31 0.00 -2.23 0.00 0.00 60.65 58.05 1qi9 s ILE 456 Cb -0.15 -2.80 -0.10 0.00 -1.58 0.00 0.00 42.46 37.83 1qi9 s ILE 456 CO 0.09 0.54 1.93 0.47 -1.23 0.00 0.00 174.94 176.74 1qi9 n ASP 457 N 2.94 4.08 -4.70 3.58 8.00 -1.26 -1.38 116.55 127.81 1qi9 n ASP 457 Ca -0.18 0.93 -0.40 0.00 0.71 0.00 0.00 54.79 55.86 1qi9 n ASP 457 Cb 0.53 -1.52 -0.05 0.00 -0.02 0.00 0.00 41.12 40.06 1qi9 n ASP 457 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 1qi9 s PHE 458 N 3.92 3.52 -0.64 1.24 5.36 0.43 -4.90 117.98 126.91 1qi9 s PHE 458 Ca 0.87 1.18 0.03 0.00 -0.96 0.00 0.00 56.93 58.06 1qi9 s PHE 458 Cb -0.47 -2.83 0.16 0.00 -0.34 0.00 0.00 43.02 39.54 1qi9 s PHE 458 CO 0.41 -0.01 0.42 1.03 -1.46 0.00 0.00 175.22 175.61 1qi9 s ARG 459 N 1.20 2.35 0.00 10.12 0.52 -1.26 -4.62 118.95 127.26 1qi9 s ARG 459 Ca 0.36 -2.97 0.00 0.00 -0.52 0.00 0.00 55.73 52.60 1qi9 s ARG 459 Cb -0.17 -3.46 0.00 0.00 0.52 0.00 0.00 34.95 31.84 1qi9 s ARG 459 CO 0.16 -1.20 0.00 0.41 0.02 0.00 0.00 175.30 174.69 1qi9 n GLY 460 N 2.61 3.67 3.70 -3.53 0.00 -1.26 -5.15 105.19 105.24 1qi9 n GLY 460 Ca 0.13 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 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 1.92 3.66 0.07 1.61 0.01 -1.26 -4.91 113.70 114.80 1qi9 s SER 461 Ca 0.00 2.28 -0.34 0.00 1.31 0.00 0.00 55.95 59.20 1qi9 s SER 461 Cb 0.00 -2.58 -0.13 0.00 0.21 0.00 0.00 66.02 63.52 1qi9 s SER 461 CO 0.00 -2.61 1.67 0.00 0.41 0.00 0.00 173.24 172.70 1qi9 s LEU 463 N 1.94 5.24 0.52 0.00 1.43 -1.26 -4.97 118.68 121.57 1qi9 s LEU 463 Ca 0.84 -1.01 -0.20 0.00 -1.03 0.00 0.00 54.13 52.73 1qi9 s LEU 463 Cb -0.70 -2.23 -0.07 0.00 0.03 0.00 0.00 46.19 43.22 1qi9 s LEU 463 CO 0.43 -0.57 1.10 0.42 0.23 0.00 0.00 176.35 177.96 1qi9 s THR 464 N 1.82 3.36 0.21 5.49 -4.23 -1.26 0.24 115.64 121.27 1qi9 s THR 464 Ca 0.07 0.85 -0.10 0.00 -1.18 0.00 0.00 61.69 61.33 1qi9 s THR 464 Cb -0.20 -3.34 0.15 0.00 1.34 0.00 0.00 72.50 70.44 1qi9 s THR 464 CO 0.10 -0.18 1.73 -0.26 -0.54 0.00 0.00 174.62 175.46 1qi9 h PHE 465 N 1.31 0.30 -0.28 3.99 0.04 -1.12 0.26 116.94 121.45 1qi9 h PHE 465 Ca -0.50 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.24 1qi9 h PHE 465 Cb 1.25 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 39.34 1qi9 h PHE 465 CO 0.53 0.04 -0.10 1.05 -0.60 0.00 0.00 178.31 179.22 1qi9 h GLU 466 N 0.33 0.46 -0.26 1.51 4.11 -1.43 -1.33 114.58 117.97 1qi9 h GLU 466 Ca 0.31 -0.12 -0.16 0.00 0.07 0.00 0.00 59.36 59.45 1qi9 h GLU 466 Cb 0.42 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.61 1qi9 h GLU 466 CO -0.35 0.57 -0.50 0.78 0.07 0.00 0.00 179.01 179.58 1qi9 h GLY 467 N 0.88 0.79 2.00 1.06 0.00 -1.34 0.08 103.07 106.54 1qi9 h GLY 467 Ca 0.08 -0.87 -0.09 0.00 0.00 0.00 0.00 47.33 46.45 1qi9 h GLY 467 CO 0.02 0.79 -0.42 0.83 0.00 0.00 0.00 176.54 177.76 1qi9 h GLU 468 N 0.56 0.00 -0.03 4.80 4.39 -0.06 0.36 114.58 124.60 1qi9 h GLU 468 Ca 0.02 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.69 1qi9 h GLU 468 Cb 1.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 1qi9 h GLU 468 CO 0.10 0.42 -0.09 0.82 -1.16 0.00 0.00 179.01 179.10 1qi9 h ILE 469 N 0.00 1.46 -0.65 3.13 2.04 -1.15 -1.24 117.51 121.09 1qi9 h ILE 469 Ca -0.00 -1.50 0.00 0.00 1.00 0.00 0.00 64.86 64.36 1qi9 h ILE 469 Cb 0.92 2.38 -0.03 0.00 -0.74 0.00 0.00 36.82 39.34 1qi9 h ILE 469 CO 0.05 0.41 0.43 0.78 0.00 0.00 0.00 178.15 179.82 1qi9 h ASN 470 N -0.44 0.76 -1.00 1.72 2.35 -0.72 -1.87 115.58 116.38 1qi9 h ASN 470 Ca -0.00 -0.03 0.10 0.00 -0.55 0.00 0.00 56.30 55.82 1qi9 h ASN 470 Cb 0.71 -0.19 -0.08 0.00 0.05 0.00 0.00 38.32 38.81 1qi9 h ASN 470 CO 0.02 0.56 0.64 0.50 -1.65 0.00 0.00 177.43 177.50 1qi9 h LYS 471 N 0.89 1.03 -0.03 0.81 3.64 -0.17 -1.25 116.57 121.49 1qi9 h LYS 471 Ca 0.24 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 1qi9 h LYS 471 Cb -0.09 -0.23 -0.00 0.00 -0.41 0.00 0.00 32.23 31.50 1qi9 h LYS 471 CO -0.05 0.68 0.02 1.25 -2.27 0.00 0.00 179.45 179.08 1qi9 h LEU 472 N 1.06 0.03 -0.91 5.20 5.85 -0.79 0.28 115.31 126.02 1qi9 h LEU 472 Ca 0.47 -0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.17 1qi9 h LEU 472 Cb 0.37 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1qi9 h LEU 472 CO -0.22 0.03 0.50 0.00 -0.34 0.00 0.00 178.44 178.41 1qi9 h ALA 473 N 1.01 1.17 -0.04 1.25 0.00 -0.55 -1.81 119.26 120.28 1qi9 h ALA 473 Ca 0.01 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 1qi9 h ALA 473 Cb 0.00 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1qi9 h ALA 473 CO -0.00 0.67 -0.65 0.28 0.00 0.00 0.00 179.25 179.55 1qi9 h VAL 474 N 1.27 1.42 0.01 0.00 2.07 -0.87 -2.17 116.25 117.98 1qi9 h VAL 474 Ca 0.32 -2.12 0.01 0.00 0.82 0.00 0.00 66.70 65.73 1qi9 h VAL 474 Cb 0.02 2.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1qi9 h VAL 474 CO -0.05 0.62 -0.05 0.78 0.02 0.00 0.00 177.57 178.88 1qi9 h ASN 475 N 0.13 -0.15 -0.23 0.57 -0.26 0.02 0.27 115.58 115.94 1qi9 h ASN 475 Ca -0.01 0.02 -0.00 0.00 -0.56 0.00 0.00 56.30 55.75 1qi9 h ASN 475 Cb 1.17 0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 38.48 1qi9 h ASN 475 CO 0.10 -0.08 0.13 0.58 -1.06 0.00 0.00 177.43 177.10 1qi9 h VAL 476 N -0.10 1.10 0.06 2.81 2.07 -1.28 0.34 116.25 121.25 1qi9 h VAL 476 Ca 0.02 -0.25 0.01 0.00 0.82 0.00 0.00 66.70 67.30 1qi9 h VAL 476 Cb 0.12 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1qi9 h VAL 476 CO -0.05 0.10 -0.13 0.00 0.02 0.00 0.00 177.57 177.50 1qi9 h ALA 477 N 1.03 -0.20 0.00 1.67 0.00 -1.16 -2.87 119.26 117.72 1qi9 h ALA 477 Ca 0.08 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1qi9 h ALA 477 Cb 0.04 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1qi9 h ALA 477 CO -0.01 -0.65 -0.03 0.74 0.00 0.00 0.00 179.25 179.30 1qi9 h PHE 478 N -0.26 0.00 -0.20 0.00 -1.00 -0.79 -2.50 116.94 112.19 1qi9 h PHE 478 Ca 0.03 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.76 1qi9 h PHE 478 Cb 0.28 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.83 1qi9 h PHE 478 CO -0.16 0.03 -0.09 0.78 -1.61 0.00 0.00 178.31 177.25 1qi9 h GLY 479 N 2.62 0.34 1.44 -1.45 0.00 -0.10 0.28 103.07 106.20 1qi9 h GLY 479 Ca -0.00 -0.20 -0.20 0.00 0.00 0.00 0.00 47.33 46.93 1qi9 h GLY 479 CO 0.00 0.19 -0.73 3.21 0.00 0.00 0.00 176.54 179.21 1qi9 h ARG 480 N 0.30 0.55 -0.52 4.80 2.47 -1.31 -2.22 114.38 118.45 1qi9 h ARG 480 Ca 0.06 -0.44 0.02 0.00 -1.26 0.00 0.00 59.98 58.36 1qi9 h ARG 480 Cb 0.36 0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.73 1qi9 h ARG 480 CO 0.02 1.07 0.32 1.96 0.56 0.00 0.00 179.97 183.89 1qi9 h GLN 481 N 0.38 0.61 0.00 0.04 4.20 -1.35 -2.53 115.11 116.47 1qi9 h GLN 481 Ca -0.04 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1qi9 h GLN 481 Cb 1.33 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1qi9 h GLN 481 CO 0.14 0.40 0.00 0.52 -0.67 0.00 0.00 178.83 179.22 1qi9 h MET 482 N 0.63 0.00 0.00 1.46 2.86 -0.75 -1.29 114.93 117.84 1qi9 h MET 482 Ca 0.21 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.79 1qi9 h MET 482 Cb 0.01 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 1qi9 h MET 482 CO -0.09 0.00 -0.26 -0.07 1.06 0.00 0.00 176.91 177.55 1qi9 h LEU 483 N 0.00 0.00 0.00 1.22 3.38 -0.98 -3.44 115.31 115.49 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 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1qi9 h LEU 483 CO 0.00 0.26 0.00 0.61 0.09 0.00 0.00 178.44 179.40 1qi9 n GLY 484 N 0.76 1.03 0.37 0.83 0.00 -0.48 -1.50 105.19 106.19 1qi9 n GLY 484 Ca 0.02 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.08 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 -0.89 0.47 -4.00 -0.61 -5.35 -1.07 -4.16 119.36 103.75 1qi9 n ILE 485 Ca 0.00 -0.73 -0.09 0.00 -0.27 0.00 0.00 62.75 61.65 1qi9 n ILE 485 Cb 0.00 0.85 -0.08 0.00 -1.74 0.00 0.00 39.64 38.67 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 -0.81 0.49 0.35 4.28 3.76 -1.24 -4.57 115.29 117.55 1qi9 s HIS 486 Ca 0.12 -0.86 0.08 0.00 -0.15 0.00 0.00 55.06 54.25 1qi9 s HIS 486 Cb 0.07 -0.16 -0.03 0.00 1.11 0.00 0.00 32.58 33.57 1qi9 s HIS 486 CO 0.10 -0.66 0.24 0.71 -0.85 0.00 0.00 174.74 174.28 1qi9 s TYR 487 N -3.98 2.81 0.37 1.40 1.51 -1.26 -4.43 117.35 113.77 1qi9 s TYR 487 Ca 0.18 -0.35 0.11 0.00 -1.01 0.00 0.00 57.07 56.00 1qi9 s TYR 487 Cb 0.04 -1.78 0.88 0.00 -0.11 0.00 0.00 41.96 41.00 1qi9 s TYR 487 CO -0.00 0.21 1.85 -0.09 -1.11 0.00 0.00 175.55 176.41 1qi9 h ARG 488 N 1.34 0.60 -0.28 -0.62 2.43 -1.99 -1.04 114.38 114.83 1qi9 h ARG 488 Ca -0.44 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 58.60 1qi9 h ARG 488 Cb 1.25 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 30.65 1qi9 h ARG 488 CO 0.60 0.40 -0.20 0.27 -1.51 0.00 0.00 179.97 179.53 1qi9 h PHE 489 N 0.62 0.58 -0.69 2.20 -5.15 -1.95 0.59 116.94 113.14 1qi9 h PHE 489 Ca 0.47 -0.11 0.04 0.00 -0.20 0.00 0.00 57.97 58.17 1qi9 h PHE 489 Cb 0.87 -0.15 -0.05 0.00 0.22 0.00 0.00 35.95 36.85 1qi9 h PHE 489 CO -0.00 0.69 0.42 -0.44 -2.00 0.00 0.00 178.31 176.98 1qi9 h ASP 490 N 0.47 0.67 0.07 -0.68 3.32 -1.51 -1.76 116.42 117.00 1qi9 h ASP 490 Ca 0.07 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 1qi9 h ASP 490 Cb 0.62 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1qi9 h ASP 490 CO 0.04 0.45 -0.03 1.23 -1.72 0.00 0.00 179.24 179.21 1qi9 h GLY 491 N 0.80 -0.10 0.89 2.75 0.00 -1.19 -2.04 103.07 104.18 1qi9 h GLY 491 Ca 0.29 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.66 1qi9 h GLY 491 CO -0.13 -0.04 0.01 -2.22 0.00 0.00 0.00 176.54 174.16 1qi9 h ILE 492 N -0.93 1.10 -0.08 2.60 1.08 -0.93 -0.59 117.51 119.76 1qi9 h ILE 492 Ca -0.01 -0.28 -0.10 0.00 -0.39 0.00 0.00 64.86 64.08 1qi9 h ILE 492 Cb 0.56 1.23 -0.01 0.00 -3.07 0.00 0.00 36.82 35.53 1qi9 h ILE 492 CO 0.02 0.08 -0.40 1.56 -0.69 0.00 0.00 178.15 178.72 1qi9 h GLN 493 N -0.07 0.16 -0.30 2.37 1.08 -1.47 -2.53 115.11 114.36 1qi9 h GLN 493 Ca 0.01 -0.07 -0.11 0.00 -1.45 0.00 0.00 58.65 57.03 1qi9 h GLN 493 Cb 0.11 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.53 1qi9 h GLN 493 CO -0.00 0.54 -0.23 0.78 -0.95 0.00 0.00 178.83 178.97 1qi9 h GLY 494 N 1.21 0.75 0.61 3.46 0.00 -1.14 -1.91 103.07 106.04 1qi9 h GLY 494 Ca 0.01 -0.72 0.08 0.00 0.00 0.00 0.00 47.33 46.70 1qi9 h GLY 494 CO 0.06 0.65 0.44 1.41 0.00 0.00 0.00 176.54 179.10 1qi9 h LEU 495 N 0.44 0.65 -0.36 3.11 3.38 -0.86 -1.61 115.31 120.05 1qi9 h LEU 495 Ca 0.06 0.04 -0.17 0.00 0.09 0.00 0.00 57.88 57.89 1qi9 h LEU 495 Cb 0.78 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1qi9 h LEU 495 CO 0.06 0.39 -0.46 -0.07 0.09 0.00 0.00 178.44 178.45 1qi9 h LEU 496 N 0.78 0.98 -0.51 1.67 3.38 -1.44 -2.05 115.31 118.11 1qi9 h LEU 496 Ca 0.36 -0.48 0.09 0.00 0.09 0.00 0.00 57.88 57.93 1qi9 h LEU 496 Cb 0.27 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 40.67 1qi9 h LEU 496 CO -0.21 1.28 0.09 0.25 0.09 0.00 0.00 178.44 179.94 1qi9 h LEU 497 N 0.72 -0.03 -0.43 1.67 5.85 -0.90 -1.63 115.31 120.56 1qi9 h LEU 497 Ca 0.04 0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 1qi9 h LEU 497 Cb 1.06 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 1qi9 h LEU 497 CO 0.11 0.01 0.24 1.23 -0.34 0.00 0.00 178.44 179.69 1qi9 h GLY 498 N 0.22 0.63 0.89 3.75 0.00 -1.22 -1.63 103.07 105.71 1qi9 h GLY 498 Ca 0.26 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.30 1qi9 h GLY 498 CO -0.35 0.27 0.07 -2.09 0.00 0.00 0.00 176.54 174.44 1qi9 h GLU 499 N 0.56 0.24 -0.07 4.80 4.81 -1.12 -1.64 114.58 122.15 1qi9 h GLU 499 Ca 0.15 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1qi9 h GLU 499 Cb 0.04 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.38 1qi9 h GLU 499 CO -0.03 0.31 0.04 1.15 -0.73 0.00 0.00 179.01 179.76 1qi9 h THR 500 N 0.11 1.06 -0.85 0.32 2.02 -1.09 0.06 112.91 114.53 1qi9 h THR 500 Ca 0.05 -0.16 0.01 0.00 0.77 0.00 0.00 66.41 67.09 1qi9 h THR 500 Cb 0.16 1.05 -0.04 0.00 -1.74 0.00 0.00 68.15 67.57 1qi9 h THR 500 CO -0.01 0.05 0.56 0.40 0.37 0.00 0.00 175.52 176.90 1qi9 h ILE 501 N 0.04 1.20 -0.30 3.11 2.04 -1.30 -2.29 117.51 120.02 1qi9 h ILE 501 Ca 0.02 -0.39 -0.11 0.00 1.00 0.00 0.00 64.86 65.39 1qi9 h ILE 501 Cb 0.05 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.08 1qi9 h ILE 501 CO -0.00 0.21 -0.26 0.74 0.00 0.00 0.00 178.15 178.84 1qi9 h THR 502 N 1.14 1.27 -0.65 -0.27 2.02 -0.68 -2.20 112.91 113.54 1qi9 h THR 502 Ca 0.32 -1.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.16 1qi9 h THR 502 Cb -0.10 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.60 1qi9 h THR 502 CO -0.08 0.43 0.33 0.58 0.37 0.00 0.00 175.52 177.14 1qi9 h VAL 503 N 0.51 1.22 -0.30 3.16 2.07 -0.76 -1.17 116.25 120.98 1qi9 h VAL 503 Ca 0.07 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 67.01 1qi9 h VAL 503 Cb 0.71 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1qi9 h VAL 503 CO 0.05 0.25 0.15 0.03 0.02 0.00 0.00 177.57 178.08 1qi9 h ARG 504 N 0.90 0.31 -0.12 1.57 2.47 -1.02 -0.43 114.38 118.06 1qi9 h ARG 504 Ca 0.23 -0.02 -0.02 0.00 -1.26 0.00 0.00 59.98 58.91 1qi9 h ARG 504 Cb 0.10 -0.07 -0.00 0.00 -1.65 0.00 0.00 29.97 28.34 1qi9 h ARG 504 CO -0.03 0.20 0.01 1.15 0.56 0.00 0.00 179.97 181.86 1qi9 h THR 505 N 0.32 1.24 -0.52 2.04 2.02 -1.27 -1.48 112.91 115.26 1qi9 h THR 505 Ca 0.12 -0.77 0.10 0.00 0.77 0.00 0.00 66.41 66.63 1qi9 h THR 505 Cb 0.04 1.52 -0.09 0.00 -1.74 0.00 0.00 68.15 67.88 1qi9 h THR 505 CO -0.08 0.22 -0.02 -0.07 0.37 0.00 0.00 175.52 175.94 1qi9 h LEU 506 N -0.05 -0.27 -0.25 2.58 3.38 -1.11 -0.47 115.31 119.13 1qi9 h LEU 506 Ca 0.03 0.13 -0.08 0.00 0.09 0.00 0.00 57.88 58.06 1qi9 h LEU 506 Cb 0.34 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1qi9 h LEU 506 CO 0.00 -0.10 -0.15 -0.74 0.09 0.00 0.00 178.44 177.54 1qi9 h HIS 507 N 0.10 0.64 -0.39 1.13 2.76 -1.04 -0.87 115.15 117.48 1qi9 h HIS 507 Ca 0.27 -0.17 0.08 0.00 -2.20 0.00 0.00 60.37 58.34 1qi9 h HIS 507 Cb 0.41 -0.14 -0.07 0.00 1.55 0.00 0.00 27.41 29.15 1qi9 h HIS 507 CO -0.34 0.83 -0.09 0.37 -1.30 0.00 0.00 177.93 177.39 1qi9 h GLN 508 N 0.27 0.01 -0.33 5.26 4.15 -0.73 -2.46 115.11 121.28 1qi9 h GLN 508 Ca 0.05 -0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.42 1qi9 h GLN 508 Cb 0.68 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.35 1qi9 h GLN 508 CO 0.04 0.00 0.01 0.93 -1.93 0.00 0.00 178.83 177.89 1qi9 h GLU 509 N 0.01 0.58 -1.00 1.69 5.08 -0.98 -3.08 114.58 116.88 1qi9 h GLU 509 Ca 0.19 -0.18 0.17 0.00 -1.00 0.00 0.00 59.36 58.53 1qi9 h GLU 509 Cb 0.28 -0.05 -0.10 0.00 0.50 0.00 0.00 28.75 29.38 1qi9 h GLU 509 CO -0.39 0.70 0.62 1.25 -1.00 0.00 0.00 179.01 180.19 1qi9 h LEU 510 N 0.39 0.81 -1.87 1.33 5.85 -0.90 -1.13 115.31 119.80 1qi9 h LEU 510 Ca 0.10 0.08 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 1qi9 h LEU 510 Cb 0.43 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 1qi9 h LEU 510 CO 0.02 0.35 -0.12 0.24 -0.34 0.00 0.00 178.44 178.58 1qi9 h MET 511 N 0.82 0.00 0.00 1.25 2.86 -1.35 -2.85 114.93 115.66 1qi9 h MET 511 Ca 0.54 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 58.17 1qi9 h MET 511 Cb 0.77 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.43 1qi9 h MET 511 CO -0.33 0.12 -0.51 1.79 1.06 0.00 0.00 176.91 179.04 1qi9 h THR 512 N 0.00 0.07 -3.87 2.22 1.35 -1.28 -3.48 112.91 107.93 1qi9 h THR 512 Ca -0.00 -1.11 -0.52 0.00 -0.55 0.00 0.00 66.41 64.23 1qi9 h THR 512 Cb 0.35 1.81 0.05 0.00 -1.73 0.00 0.00 68.15 68.64 1qi9 h THR 512 CO 0.02 0.04 0.60 -0.36 -0.25 0.00 0.00 175.52 175.56 1qi9 s PHE 513 N -3.25 3.15 0.04 4.73 0.08 -1.08 -4.96 117.98 116.69 1qi9 s PHE 513 Ca 0.03 1.48 -0.24 0.00 0.12 0.00 0.00 56.93 58.33 1qi9 s PHE 513 Cb 0.07 -3.58 -0.16 0.00 -0.57 0.00 0.00 43.02 38.78 1qi9 s PHE 513 CO 0.73 -1.57 1.49 0.00 -0.10 0.00 0.00 175.22 175.78 1qi9 h ALA 514 N 3.42 0.06 -2.64 5.36 0.00 -1.92 -3.44 119.26 120.09 1qi9 h ALA 514 Ca -0.48 -0.14 -0.50 0.00 0.00 0.00 0.00 54.91 53.78 1qi9 h ALA 514 Cb 1.22 -0.02 0.06 0.00 0.00 0.00 0.00 17.79 19.05 1qi9 h ALA 514 CO 0.65 -0.29 0.47 -1.83 0.00 0.00 0.00 179.25 178.25 1qi9 s GLU 515 N -5.13 3.75 0.10 0.00 1.03 -1.26 -4.94 118.70 112.25 1qi9 s GLU 515 Ca -0.14 1.71 -0.31 0.00 0.03 0.00 0.00 54.97 56.25 1qi9 s GLU 515 Cb 0.04 -2.36 -0.08 0.00 -0.80 0.00 0.00 34.13 30.94 1qi9 s GLU 515 CO 0.68 -0.54 1.49 -1.21 -1.33 0.00 0.00 175.26 174.35 1qi9 s GLU 516 N -2.77 4.26 0.14 -4.83 2.02 -1.26 -4.95 118.70 111.30 1qi9 s GLU 516 Ca 0.64 2.19 -0.25 0.00 0.02 0.00 0.00 54.97 57.57 1qi9 s GLU 516 Cb -0.27 -3.34 0.07 0.00 0.10 0.00 0.00 34.13 30.69 1qi9 s GLU 516 CO 0.32 -0.56 0.99 -1.54 0.02 0.00 0.00 175.26 174.49 1qi9 s SER 517 N 1.48 -0.16 0.33 -0.19 1.04 -1.26 -4.79 113.70 110.14 1qi9 s SER 517 Ca 0.68 -0.38 0.07 0.00 0.48 0.00 0.00 55.95 56.80 1qi9 s SER 517 Cb -0.39 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.16 1qi9 s SER 517 CO 0.30 -0.84 0.27 0.35 0.98 0.00 0.00 173.24 174.29 1qi9 n THR 518 N -0.47 0.00 -4.61 2.02 -2.24 -1.26 -4.29 114.28 103.42 1qi9 n THR 518 Ca -0.06 -2.36 -0.25 0.00 -2.27 0.00 0.00 64.05 59.11 1qi9 n THR 518 Cb 0.61 1.16 -0.14 0.00 -2.10 0.00 0.00 70.33 69.86 1qi9 n THR 518 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1qi9 s PHE 519 N -3.30 1.73 -0.13 4.78 0.08 -1.07 -4.89 117.98 115.18 1qi9 s PHE 519 Ca 0.38 -0.37 -0.06 0.00 0.12 0.00 0.00 56.93 57.00 1qi9 s PHE 519 Cb 0.02 -1.03 0.06 0.00 -0.57 0.00 0.00 43.02 41.49 1qi9 s PHE 519 CO 0.27 0.08 0.29 -2.00 -0.10 0.00 0.00 175.22 173.76 1qi9 s GLU 520 N -1.14 0.23 0.14 0.44 2.12 -1.26 0.10 118.70 119.33 1qi9 s GLU 520 Ca 0.07 0.68 -0.25 0.00 0.36 0.00 0.00 54.97 55.82 1qi9 s GLU 520 Cb -0.09 -0.05 0.07 0.00 0.26 0.00 0.00 34.13 34.33 1qi9 s GLU 520 CO 0.02 -0.20 0.99 -0.59 -0.54 0.00 0.00 175.26 174.93 1qi9 s PHE 521 N 1.72 -0.11 -0.18 5.30 -0.71 -0.88 -1.55 117.98 121.56 1qi9 s PHE 521 Ca -0.06 -0.18 -0.14 0.00 -1.04 0.00 0.00 56.93 55.51 1qi9 s PHE 521 Cb -0.11 0.64 -0.04 0.00 -1.21 0.00 0.00 43.02 42.30 1qi9 s PHE 521 CO -0.10 -0.80 0.31 0.50 -1.34 0.00 0.00 175.22 173.80 1qi9 s ARG 522 N -3.18 4.21 0.85 1.99 3.52 -1.26 -1.03 118.95 124.04 1qi9 s ARG 522 Ca 0.13 0.09 -0.11 0.00 -0.13 0.00 0.00 55.73 55.70 1qi9 s ARG 522 Cb -0.01 -3.48 0.10 0.00 -1.56 0.00 0.00 34.95 30.00 1qi9 s ARG 522 CO 0.02 0.12 1.09 -0.51 -0.81 0.00 0.00 175.30 175.22 1qi9 s LEU 523 N 0.82 2.47 0.26 -0.88 1.43 -0.24 -4.91 118.68 117.63 1qi9 s LEU 523 Ca 0.16 1.49 -0.02 0.00 -1.03 0.00 0.00 54.13 54.73 1qi9 s LEU 523 Cb -0.14 -4.01 0.49 0.00 0.03 0.00 0.00 46.19 42.56 1qi9 s LEU 523 CO 0.05 -2.36 1.79 -0.26 0.23 0.00 0.00 176.35 175.80 1qi9 h PHE 524 N -1.36 0.84 0.00 0.29 0.04 -1.98 -1.07 116.94 113.71 1qi9 h PHE 524 Ca -0.48 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.32 1qi9 h PHE 524 Cb 1.27 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 39.17 1qi9 h PHE 524 CO 0.46 0.27 0.00 0.25 -0.60 0.00 0.00 178.31 178.69 1qi9 n THR 525 N -4.80 0.00 0.00 -1.55 -2.24 -1.26 -1.59 114.28 102.85 1qi9 n THR 525 Ca 0.16 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.94 1qi9 n THR 525 Cb 0.37 -0.35 0.00 0.00 -2.10 0.00 0.00 70.33 68.25 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 0.83 2.10 3.78 3.38 0.00 -0.40 -4.90 105.19 109.97 1qi9 n GLY 526 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.71 3.36 -0.25 1.61 8.01 -1.26 -4.70 118.70 124.76 1qi9 s GLU 527 Ca 0.00 1.43 -0.16 0.00 0.01 0.00 0.00 54.97 56.25 1qi9 s GLU 527 Cb 0.00 -2.02 -0.03 0.00 -4.31 0.00 0.00 34.13 27.76 1qi9 s GLU 527 CO 0.00 -0.81 0.42 0.08 0.01 0.00 0.00 175.26 174.96 1qi9 s VAL 528 N -2.05 5.15 0.02 2.63 1.01 -1.26 -1.08 120.40 124.82 1qi9 s VAL 528 Ca 0.69 0.69 -0.01 0.00 0.00 0.00 0.00 61.98 63.35 1qi9 s VAL 528 Cb -0.20 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.40 1qi9 s VAL 528 CO 0.29 0.16 0.17 -0.51 0.00 0.00 0.00 175.10 175.21 1qi9 s ILE 529 N 1.98 5.26 -0.04 2.22 2.07 -0.20 0.04 121.20 132.53 1qi9 s ILE 529 Ca 0.18 -0.32 0.00 0.00 -1.41 0.00 0.00 60.65 59.10 1qi9 s ILE 529 Cb -0.16 -3.50 0.03 0.00 0.13 0.00 0.00 42.46 38.96 1qi9 s ILE 529 CO 0.09 0.25 -0.01 -0.75 -1.91 0.00 0.00 174.94 172.61 1qi9 s LYS 530 N -2.16 0.54 -0.09 3.50 2.20 -0.90 -2.07 119.74 120.77 1qi9 s LYS 530 Ca 0.30 0.03 -0.01 0.00 -0.36 0.00 0.00 55.97 55.93 1qi9 s LYS 530 Cb -0.13 -0.72 -0.03 0.00 -1.51 0.00 0.00 37.83 35.44 1qi9 s LYS 530 CO 0.22 -0.16 -0.03 -0.51 -0.36 0.00 0.00 175.35 174.51 1qi9 s LEU 531 N 1.25 3.41 0.18 5.43 1.43 0.11 -1.60 118.68 128.90 1qi9 s LEU 531 Ca -0.06 0.06 0.11 0.00 -1.03 0.00 0.00 54.13 53.21 1qi9 s LEU 531 Cb -0.13 -1.77 -0.04 0.00 0.03 0.00 0.00 46.19 44.27 1qi9 s LEU 531 CO -0.02 0.35 -0.23 -0.36 0.23 0.00 0.00 176.35 176.32 1qi9 s PHE 532 N -0.73 2.35 0.37 0.29 0.40 -0.44 -2.59 117.98 117.63 1qi9 s PHE 532 Ca 0.11 -0.34 0.36 0.00 -0.60 0.00 0.00 56.93 56.46 1qi9 s PHE 532 Cb -0.11 -1.18 1.76 0.00 0.51 0.00 0.00 43.02 43.99 1qi9 s PHE 532 CO 0.02 0.47 2.14 1.96 0.70 0.00 0.00 175.22 180.51 1qi9 h GLN 533 N 3.32 0.00 -0.02 0.44 4.20 -1.86 -1.35 115.11 119.84 1qi9 h GLN 533 Ca -0.47 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.24 1qi9 h GLN 533 Cb 1.20 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.98 1qi9 h GLN 533 CO 0.47 0.03 0.00 -0.40 -0.67 0.00 0.00 178.83 178.26 1qi9 n ASP 534 N -3.20 0.45 0.00 1.46 5.68 -1.26 -4.57 116.55 115.11 1qi9 n ASP 534 Ca -0.01 -1.26 0.00 0.00 -0.50 0.00 0.00 54.79 53.02 1qi9 n ASP 534 Cb 0.21 -0.01 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 1.00 0.46 3.92 6.12 0.00 -0.51 -5.07 105.19 111.11 1qi9 n GLY 535 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.00 5.01 0.00 2.61 -4.23 -1.25 -4.78 115.64 111.00 1qi9 s THR 536 Ca 0.00 -0.15 -0.21 0.00 -1.18 0.00 0.00 61.69 60.16 1qi9 s THR 536 Cb 0.00 -3.86 0.04 0.00 1.34 0.00 0.00 72.50 70.02 1qi9 s THR 536 CO 0.00 -0.68 0.46 0.72 -0.54 0.00 0.00 174.62 174.57 1qi9 s PHE 537 N -2.50 -0.35 0.23 3.99 -0.71 -1.26 -1.32 117.98 116.05 1qi9 s PHE 537 Ca 0.43 0.48 0.11 0.00 -1.04 0.00 0.00 56.93 56.91 1qi9 s PHE 537 Cb -0.10 0.24 -0.05 0.00 -1.21 0.00 0.00 43.02 41.90 1qi9 s PHE 537 CO 0.40 -0.53 -0.21 0.95 -1.34 0.00 0.00 175.22 174.49 1qi9 s THR 538 N -1.82 2.28 -0.23 -4.49 -4.23 -0.62 -1.16 115.64 105.36 1qi9 s THR 538 Ca -0.09 -2.19 0.02 0.00 -1.18 0.00 0.00 61.69 58.25 1qi9 s THR 538 Cb -0.02 -2.15 0.05 0.00 1.34 0.00 0.00 72.50 71.72 1qi9 s THR 538 CO 0.03 -0.30 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.07 1qi9 s ILE 539 N -2.18 1.95 -1.45 2.99 -1.09 -0.64 -2.12 121.20 118.65 1qi9 s ILE 539 Ca 0.24 -1.37 -0.09 0.00 -2.23 0.00 0.00 60.65 57.20 1qi9 s ILE 539 Cb -0.06 -2.04 0.05 0.00 -1.58 0.00 0.00 42.46 38.83 1qi9 s ILE 539 CO 0.11 0.06 0.90 0.47 -1.23 0.00 0.00 174.94 175.25 1qi9 n ASP 540 N 4.54 -3.66 0.00 3.58 8.00 0.11 -1.68 116.55 127.44 1qi9 n ASP 540 Ca -0.15 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.57 1qi9 n ASP 540 Cb 0.44 -3.99 0.00 0.00 -0.02 0.00 0.00 41.12 37.55 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 2.78 3.65 0.44 0.00 -1.26 -5.02 105.19 104.10 1qi9 n GLY 541 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 -2.01 3.33 0.03 1.61 5.36 -0.68 -4.97 117.98 120.65 1qi9 s PHE 542 Ca 0.00 1.27 -0.30 0.00 -0.96 0.00 0.00 56.93 56.94 1qi9 s PHE 542 Cb 0.00 -3.13 -0.07 0.00 -0.34 0.00 0.00 43.02 39.48 1qi9 s PHE 542 CO 0.00 -0.42 1.50 0.21 -1.46 0.00 0.00 175.22 175.05 1qi9 s LYS 543 N 2.93 4.25 0.48 10.12 2.20 -1.26 -1.63 119.74 136.83 1qi9 s LYS 543 Ca 0.39 2.11 -0.19 0.00 -0.36 0.00 0.00 55.97 57.92 1qi9 s LYS 543 Cb -0.15 -3.56 -0.09 0.00 -1.51 0.00 0.00 37.83 32.51 1qi9 s LYS 543 CO 0.07 -0.63 0.98 0.00 -0.36 0.00 0.00 175.35 175.41 1qi9 h PRO 545 N 1.41 0.00 -7.56 0.00 0.13 -1.84 -3.44 132.00 120.70 1qi9 h PRO 545 Ca -0.48 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.17 1qi9 h PRO 545 Cb 1.19 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.41 1qi9 h PRO 545 CO 0.61 0.61 0.41 0.20 -0.23 0.00 0.00 178.00 179.59 1qi9 s GLY 546 N -4.52 1.60 0.14 1.56 0.00 -1.26 -4.97 107.32 99.87 1qi9 s GLY 546 Ca 0.03 -0.53 -0.12 0.00 0.00 0.00 0.00 44.72 44.10 1qi9 s GLY 546 CO 0.76 -0.09 1.54 -2.00 0.00 0.00 0.00 173.10 173.32 1qi9 h LEU 547 N -0.92 0.88 -8.56 0.66 5.85 -1.90 -3.46 115.31 107.86 1qi9 h LEU 547 Ca -0.46 -0.37 -0.36 0.00 0.84 0.00 0.00 57.88 57.53 1qi9 h LEU 547 Cb 1.30 -0.24 -0.17 0.00 0.37 0.00 0.00 40.66 41.92 1qi9 h LEU 547 CO 0.65 1.04 -0.74 0.68 -0.34 0.00 0.00 178.44 179.73 1qi9 s VAL 548 N -4.77 1.16 0.15 1.05 -7.23 -1.26 -4.82 120.40 104.68 1qi9 s VAL 548 Ca -0.12 -1.75 -0.31 0.00 -1.81 0.00 0.00 61.98 57.98 1qi9 s VAL 548 Cb 0.11 -1.52 -0.10 0.00 0.56 0.00 0.00 36.38 35.43 1qi9 s VAL 548 CO 0.84 -0.53 1.60 -0.47 -0.31 0.00 0.00 175.10 176.23 1qi9 s TYR 549 N -2.46 2.91 -0.03 2.82 5.04 -1.26 -4.90 117.35 119.47 1qi9 s TYR 549 Ca 0.09 0.53 0.05 0.00 -2.44 0.00 0.00 57.07 55.30 1qi9 s TYR 549 Cb -0.03 -3.96 0.07 0.00 0.35 0.00 0.00 41.96 38.40 1qi9 s TYR 549 CO 0.02 -3.61 0.99 0.25 -1.34 0.00 0.00 175.55 171.86 1qi9 n THR 550 N 4.13 0.49 0.00 4.34 -2.24 -1.26 -4.85 114.28 114.89 1qi9 n THR 550 Ca 0.14 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.34 1qi9 n THR 550 Cb 0.39 0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 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 -0.37 3.12 0.33 3.38 0.00 -1.26 -4.72 105.19 105.68 1qi9 n GLY 551 Ca 0.04 -1.77 0.04 0.00 0.00 0.00 0.00 46.02 44.32 1qi9 n GLY 551 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1qi9 h VAL 552 N 0.00 1.11 -0.21 1.61 -1.51 -2.00 -2.42 116.25 112.84 1qi9 h VAL 552 Ca 0.00 -0.26 0.05 0.00 -1.23 0.00 0.00 66.70 65.26 1qi9 h VAL 552 Cb 0.00 0.28 -0.01 0.00 -2.13 0.00 0.00 31.29 29.43 1qi9 h VAL 552 CO 0.00 0.14 0.15 -0.08 -1.23 0.00 0.00 177.57 176.55 1qi9 h GLU 553 N 0.76 0.05 -0.01 5.19 4.81 -2.04 0.44 114.58 123.79 1qi9 h GLU 553 Ca 0.24 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1qi9 h GLU 553 Cb 0.01 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1qi9 h GLU 553 CO -0.06 0.04 -0.07 0.09 -0.73 0.00 0.00 179.01 178.28 1qi9 n ASN 554 N -4.49 1.12 -4.13 1.04 3.02 -0.91 -4.51 115.26 106.40 1qi9 n ASN 554 Ca 0.02 -1.20 -0.43 0.00 -0.03 0.00 0.00 54.58 52.93 1qi9 n ASN 554 Cb 0.25 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.45 1qi9 n ASN 554 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64