#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xds s LEU 10 N 0.00 3.87 -0.22 1.53 1.43 -1.26 -5.03 118.68 119.00 1xds s LEU 10 Ca 0.00 2.27 0.01 0.00 -1.03 0.00 0.00 54.13 55.38 1xds s LEU 10 Cb 0.00 -4.41 0.05 0.00 0.03 0.00 0.00 46.19 41.86 1xds s LEU 10 CO 0.00 -1.12 -0.07 -1.61 0.23 0.00 0.00 176.35 173.78 1xds s GLU 11 N -3.00 1.73 0.60 1.70 2.02 -1.26 -5.12 118.70 115.37 1xds s GLU 11 Ca 0.69 -0.90 -0.19 0.00 0.02 0.00 0.00 54.97 54.59 1xds s GLU 11 Cb -0.27 -2.48 -0.04 0.00 0.10 0.00 0.00 34.13 31.44 1xds s GLU 11 CO 0.32 -0.53 1.07 -2.30 0.02 0.00 0.00 175.26 173.83 1xds n PRO 12 N 4.69 1.02 -3.82 0.39 -0.02 -1.26 -5.05 135.00 130.96 1xds n PRO 12 Ca -0.13 0.39 -0.24 0.00 -2.02 0.00 0.00 63.50 61.50 1xds n PRO 12 Cb 0.45 -2.27 -0.02 0.00 -0.02 0.00 0.00 33.50 31.64 1xds n PRO 12 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1xds s THR 13 N -1.46 2.02 0.51 3.45 -4.23 -1.26 -4.99 115.64 109.68 1xds s THR 13 Ca 0.77 -1.47 0.19 0.00 -1.18 0.00 0.00 61.69 59.99 1xds s THR 13 Cb -0.41 -2.50 0.33 0.00 1.34 0.00 0.00 72.50 71.26 1xds s THR 13 CO 0.46 0.00 2.07 0.44 -0.54 0.00 0.00 174.62 177.05 1xds h ASP 14 N 0.91 0.07 0.61 3.99 5.19 -1.99 -2.26 116.42 122.93 1xds h ASP 14 Ca -0.39 0.00 -0.27 0.00 -0.62 0.00 0.00 57.03 55.75 1xds h ASP 14 Cb 1.29 -0.02 0.01 0.00 0.18 0.00 0.00 39.33 40.79 1xds h ASP 14 CO 0.59 0.05 -1.24 -0.61 -3.12 0.00 0.00 179.24 174.91 1xds h GLN 15 N 0.08 0.29 -0.01 3.56 5.75 -1.98 -2.14 115.11 120.65 1xds h GLN 15 Ca 0.14 -0.48 0.00 0.00 -0.15 0.00 0.00 58.65 58.16 1xds h GLN 15 Cb 0.45 0.18 -0.00 0.00 1.07 0.00 0.00 27.48 29.17 1xds h GLN 15 CO -0.01 1.22 -0.01 -0.44 -2.65 0.00 0.00 178.83 176.94 1xds h ASP 16 N 0.08 -0.04 -0.76 -0.69 3.32 -1.81 -1.27 116.42 115.25 1xds h ASP 16 Ca -0.14 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 56.91 1xds h ASP 16 Cb 1.96 0.02 -0.04 0.00 0.22 0.00 0.00 39.33 41.49 1xds h ASP 16 CO 0.20 -0.02 0.42 0.25 -1.72 0.00 0.00 179.24 178.37 1xds h LEU 17 N -0.01 0.97 -0.46 1.55 5.85 -1.52 0.46 115.31 122.14 1xds h LEU 17 Ca 0.01 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.61 1xds h LEU 17 Cb 0.03 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 1xds h LEU 17 CO -0.02 0.78 0.14 -0.78 -0.34 0.00 0.00 178.44 178.22 1xds h ASP 18 N 1.09 0.68 -0.63 1.25 3.58 -1.17 -0.54 116.42 120.67 1xds h ASP 18 Ca 0.27 -0.21 -0.04 0.00 0.42 0.00 0.00 57.03 57.48 1xds h ASP 18 Cb 0.04 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 40.88 1xds h ASP 18 CO -0.04 0.71 0.25 0.58 -2.88 0.00 0.00 179.24 177.85 1xds h VAL 19 N 0.61 1.23 0.10 2.25 2.07 -0.68 -0.86 116.25 120.97 1xds h VAL 19 Ca 0.15 -0.74 -0.00 0.00 0.82 0.00 0.00 66.70 66.93 1xds h VAL 19 Cb 0.27 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1xds h VAL 19 CO -0.00 0.29 -0.07 0.25 0.02 0.00 0.00 177.57 178.06 1xds h LEU 20 N 0.88 -0.17 -0.77 2.57 5.85 -0.72 -0.73 115.31 122.22 1xds h LEU 20 Ca 0.21 0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.82 1xds h LEU 20 Cb 0.21 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 1xds h LEU 20 CO -0.02 -0.11 -0.43 -0.07 -0.34 0.00 0.00 178.44 177.48 1xds h LEU 21 N -0.16 0.44 0.00 2.25 3.38 -0.98 0.15 115.31 120.38 1xds h LEU 21 Ca -0.01 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1xds h LEU 21 Cb 0.14 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1xds h LEU 21 CO 0.00 0.81 -1.79 0.29 0.09 0.00 0.00 178.44 177.85 1xds n LYS 22 N -4.01 0.56 0.00 1.13 5.02 -0.34 -4.29 118.16 116.23 1xds n LYS 22 Ca -0.02 -0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.11 1xds n LYS 22 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.03 1xds n LYS 22 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1xds n ASN 23 N -2.10 0.00 -0.01 4.39 4.05 -0.39 -4.76 115.26 116.43 1xds n ASN 23 Ca -0.02 0.00 -0.05 0.00 0.45 0.00 0.00 54.58 54.96 1xds n ASN 23 Cb 0.51 0.00 0.16 0.00 1.23 0.00 0.00 39.78 41.68 1xds n ASN 23 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 177.26 174.14 1xds h LEU 24 N 0.00 0.57 -2.06 1.20 3.38 -1.30 -2.75 115.31 114.35 1xds h LEU 24 Ca 0.00 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.77 1xds h LEU 24 Cb 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.59 1xds h LEU 24 CO 0.00 0.81 0.00 0.61 0.09 0.00 0.00 178.44 179.95 1xds n GLY 25 N -0.32 1.34 3.53 0.83 0.00 0.51 -4.95 105.19 106.12 1xds n GLY 25 Ca -0.00 -0.69 -0.43 0.00 0.00 0.00 0.00 46.02 44.90 1xds n GLY 25 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1xds s ASN 26 N -1.68 6.35 -0.02 1.61 3.04 -1.04 -4.89 114.94 118.32 1xds s ASN 26 Ca 0.35 -0.21 0.21 0.00 0.04 0.00 0.00 52.86 53.24 1xds s ASN 26 Cb 0.22 -2.32 -0.28 0.00 -1.54 0.00 0.00 41.25 37.32 1xds s ASN 26 CO 0.31 -0.73 0.64 -0.11 -3.04 0.00 0.00 177.10 174.17 1xds n LEU 27 N 6.21 0.41 -0.04 3.21 7.94 -1.26 -4.47 117.00 128.99 1xds n LEU 27 Ca -0.02 -0.21 -0.14 0.00 -1.11 0.00 0.00 56.01 54.53 1xds n LEU 27 Cb 0.48 0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.35 1xds n LEU 27 CO 0.52 0.10 0.51 0.58 -1.11 0.00 0.00 177.39 178.00 1xds h VAL 28 N 0.00 1.38 0.15 1.96 2.07 -1.98 -3.35 116.25 116.48 1xds h VAL 28 Ca 0.00 -1.54 -0.01 0.00 0.82 0.00 0.00 66.70 65.97 1xds h VAL 28 Cb 0.76 2.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1xds h VAL 28 CO 0.00 0.45 -0.07 0.74 0.02 0.00 0.00 177.57 178.71 1xds h THR 29 N -0.06 0.98 0.00 2.57 2.02 -1.96 -0.07 112.91 116.40 1xds h THR 29 Ca 0.00 -0.60 0.00 0.00 0.77 0.00 0.00 66.41 66.58 1xds h THR 29 Cb 0.85 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 68.61 1xds h THR 29 CO 0.06 0.14 0.00 -0.81 0.37 0.00 0.00 175.52 175.28 1xds n PRO 30 N -5.05 0.00 0.00 6.66 -0.04 -1.26 -0.52 135.00 134.80 1xds n PRO 30 Ca -0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.37 1xds n PRO 30 Cb 0.21 -0.95 0.00 0.00 -0.04 0.00 0.00 33.50 32.72 1xds n PRO 30 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xds n ALA 32 N 0.64 0.00 0.08 0.55 0.00 -0.04 -2.35 120.51 119.38 1xds n ALA 32 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1xds n ALA 32 Cb 0.00 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.56 1xds n ALA 32 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1xds h LEU 33 N 0.00 0.29 -0.32 0.00 -0.00 -1.07 -1.78 115.31 112.43 1xds h LEU 33 Ca 0.00 -0.17 -0.20 0.00 -0.00 0.00 0.00 57.88 57.51 1xds h LEU 33 Cb 0.00 -0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 40.57 1xds h LEU 33 CO 0.00 0.84 -0.78 0.03 -0.00 0.00 0.00 178.44 178.53 1xds h ARG 34 N 0.19 0.47 -0.28 1.13 3.08 -1.72 -1.90 114.38 115.34 1xds h ARG 34 Ca -0.01 -0.41 -0.10 0.00 0.07 0.00 0.00 59.98 59.53 1xds h ARG 34 Cb 1.14 0.09 -0.01 0.00 0.08 0.00 0.00 29.97 31.28 1xds h ARG 34 CO 0.10 1.04 -0.23 0.28 -1.07 0.00 0.00 179.97 180.09 1xds h VAL 35 N 0.31 1.30 -0.97 2.04 2.07 -1.84 -1.72 116.25 117.45 1xds h VAL 35 Ca -0.04 -1.38 0.03 0.00 0.82 0.00 0.00 66.70 66.13 1xds h VAL 35 Cb 1.38 1.56 -0.05 0.00 -1.52 0.00 0.00 31.29 32.66 1xds h VAL 35 CO 0.14 0.44 0.64 0.00 0.02 0.00 0.00 177.57 178.80 1xds h ALA 36 N 0.72 1.37 -0.33 1.67 0.00 -1.31 -2.31 119.26 119.07 1xds h ALA 36 Ca 0.05 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.76 1xds h ALA 36 Cb 0.78 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1xds h ALA 36 CO 0.06 0.55 -0.41 0.00 0.00 0.00 0.00 179.25 179.45 1xds h ALA 37 N 1.43 0.65 0.00 0.00 0.00 -1.23 -2.76 119.26 117.35 1xds h ALA 37 Ca 0.38 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xds h ALA 37 Cb -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1xds h ALA 37 CO -0.11 0.67 0.00 2.41 0.00 0.00 0.00 179.25 182.22 1xds n THR 38 N -4.04 0.00 -1.63 0.00 -1.04 -0.66 -1.76 114.28 105.15 1xds n THR 38 Ca -0.02 0.00 0.04 0.00 -2.04 0.00 0.00 64.05 62.03 1xds n THR 38 Cb 0.55 -0.48 0.06 0.00 -1.82 0.00 0.00 70.33 68.63 1xds n THR 38 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1xds n LEU 39 N -0.83 1.00 -3.41 -4.42 4.77 -1.10 -4.98 117.00 108.03 1xds n LEU 39 Ca 0.11 -1.90 -0.21 0.00 -0.03 0.00 0.00 56.01 53.98 1xds n LEU 39 Cb 0.05 -0.18 -0.03 0.00 -2.33 0.00 0.00 43.42 40.93 1xds n LEU 39 CO 0.08 0.46 -0.07 0.54 -1.33 0.00 0.00 177.39 177.07 1xds n ARG 40 N -0.58 -2.31 -0.19 3.23 1.74 -0.72 -4.58 116.66 113.25 1xds n ARG 40 Ca 0.07 0.19 -0.01 0.00 -0.77 0.00 0.00 57.85 57.33 1xds n ARG 40 Cb 0.68 -4.78 0.10 0.00 -1.02 0.00 0.00 32.46 27.45 1xds n ARG 40 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1xds h LEU 41 N -0.55 0.22 0.00 0.55 4.07 -1.76 1.20 115.31 119.05 1xds h LEU 41 Ca -0.32 0.07 0.00 0.00 0.08 0.00 0.00 57.88 57.71 1xds h LEU 41 Cb 1.21 0.05 0.00 0.00 1.08 0.00 0.00 40.66 43.01 1xds h LEU 41 CO 0.45 0.14 0.00 0.52 -1.08 0.00 0.00 178.44 178.47 1xds n VAL 42 N -4.99 1.33 -0.06 1.22 0.31 -1.26 -1.94 118.33 112.92 1xds n VAL 42 Ca 0.08 0.33 -0.07 0.00 -0.01 0.00 0.00 64.34 64.67 1xds n VAL 42 Cb 0.25 -1.21 -0.02 0.00 -0.91 0.00 0.00 33.84 31.95 1xds n VAL 42 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1xds n ASP 43 N -1.44 1.77 -0.50 4.52 8.00 0.33 -4.52 116.55 124.72 1xds n ASP 43 Ca 0.02 0.29 0.41 0.00 0.71 0.00 0.00 54.79 56.22 1xds n ASP 43 Cb 0.07 -0.66 0.72 0.00 -0.02 0.00 0.00 41.12 41.24 1xds n ASP 43 CO 0.00 0.00 0.00 0.45 -0.39 0.00 0.00 177.20 177.26 1xds h HIS 44 N -0.80 0.23 -0.44 1.24 3.86 0.99 1.14 115.15 121.36 1xds h HIS 44 Ca 0.00 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.08 1xds h HIS 44 Cb 0.80 -0.06 -0.01 0.00 1.06 0.00 0.00 27.41 29.20 1xds h HIS 44 CO -0.35 -0.07 -0.28 -0.07 0.86 0.00 0.00 177.93 178.03 1xds h LEU 45 N 0.06 1.01 -2.24 2.43 4.07 -1.61 -3.50 115.31 115.54 1xds h LEU 45 Ca 0.78 -0.41 -0.08 0.00 0.08 0.00 0.00 57.88 58.25 1xds h LEU 45 Cb 2.83 -0.28 -0.05 0.00 1.08 0.00 0.00 40.66 44.24 1xds h LEU 45 CO -0.17 1.21 0.10 0.18 -1.08 0.00 0.00 178.44 178.68 1xds n LEU 46 N -4.09 3.37 -0.57 1.67 4.77 0.39 -5.12 117.00 117.42 1xds n LEU 46 Ca -0.01 -1.73 0.04 0.00 -0.03 0.00 0.00 56.01 54.29 1xds n LEU 46 Cb 0.49 -0.59 0.07 0.00 -2.33 0.00 0.00 43.42 41.07 1xds n LEU 46 CO 0.47 0.52 0.32 0.00 -1.33 0.00 0.00 177.39 177.38 1xds n ALA 56 N 0.09 2.37 -1.70 -1.18 0.00 -1.26 -5.08 120.51 113.75 1xds n ALA 56 Ca 0.14 -2.04 -0.34 0.00 0.00 0.00 0.00 53.44 51.20 1xds n ALA 56 Cb 0.72 -0.49 0.00 0.00 0.00 0.00 0.00 19.45 19.69 1xds n ALA 56 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xds n ASP 57 N -0.48 7.10 -1.64 0.00 -0.08 -1.26 -3.91 116.55 116.27 1xds n ASP 57 Ca 0.08 -3.57 -0.09 0.00 -1.51 0.00 0.00 54.79 49.70 1xds n ASP 57 Cb 0.76 -1.13 0.15 0.00 2.34 0.00 0.00 41.12 43.24 1xds n ASP 57 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1xds n ARG 58 N 0.03 2.26 0.00 -0.67 1.74 -1.26 -4.82 116.66 113.93 1xds n ARG 58 Ca 0.52 -1.89 0.00 0.00 -0.77 0.00 0.00 57.85 55.71 1xds n ARG 58 Cb 0.38 -1.80 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 1xds n ARG 58 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1xds n THR 59 N -0.25 0.43 -1.75 0.55 -2.24 -1.25 -4.97 114.28 104.80 1xds n THR 59 Ca 0.31 -0.69 -0.17 0.00 -2.27 0.00 0.00 64.05 61.23 1xds n THR 59 Cb 1.11 0.81 -0.05 0.00 -2.10 0.00 0.00 70.33 70.10 1xds n THR 59 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1xds n ASP 60 N -0.22 -5.00 -4.89 3.42 8.00 -1.26 -5.00 116.55 111.60 1xds n ASP 60 Ca 0.00 0.28 -0.35 0.00 0.71 0.00 0.00 54.79 55.43 1xds n ASP 60 Cb 0.13 -4.02 -0.05 0.00 -0.02 0.00 0.00 41.12 37.16 1xds n ASP 60 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1xds s THR 61 N -2.69 5.38 0.03 -3.53 -4.23 -1.26 -5.03 115.64 104.30 1xds s THR 61 Ca 0.00 0.12 -0.33 0.00 -1.18 0.00 0.00 61.69 60.29 1xds s THR 61 Cb 0.00 -3.52 -0.12 0.00 1.34 0.00 0.00 72.50 70.20 1xds s THR 61 CO 0.00 0.43 1.79 1.57 -0.54 0.00 0.00 174.62 177.87 1xds n HIS 62 N 1.32 2.37 -0.16 3.99 -0.00 -1.26 -4.89 115.22 116.59 1xds n HIS 62 Ca -0.13 0.03 -0.03 0.00 0.46 0.00 0.00 57.72 58.05 1xds n HIS 62 Cb 0.53 -2.65 0.06 0.00 -0.12 0.00 0.00 29.99 27.82 1xds n HIS 62 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1xds h PRO 63 N 8.19 0.32 0.11 1.57 0.13 -2.00 -1.77 132.00 138.56 1xds h PRO 63 Ca -0.47 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 1xds h PRO 63 Cb 1.26 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1xds h PRO 63 CO 0.93 0.21 -0.05 1.96 -0.23 0.00 0.00 178.00 180.82 1xds h GLN 64 N 0.33 -0.15 -0.78 0.86 1.08 -2.01 -3.01 115.11 111.43 1xds h GLN 64 Ca 0.24 0.01 0.17 0.00 -1.45 0.00 0.00 58.65 57.62 1xds h GLN 64 Cb 0.26 0.03 -0.11 0.00 -0.05 0.00 0.00 27.48 27.61 1xds h GLN 64 CO -0.25 0.08 0.25 0.00 -0.95 0.00 0.00 178.83 177.96 1xds h ALA 65 N 0.49 1.09 -0.26 3.87 0.00 -1.93 -2.21 119.26 120.31 1xds h ALA 65 Ca -0.02 0.16 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1xds h ALA 65 Cb 0.30 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1xds h ALA 65 CO 0.03 -0.32 0.09 1.25 0.00 0.00 0.00 179.25 180.29 1xds h LEU 66 N 0.33 0.38 -1.01 0.00 5.85 -1.24 -1.48 115.31 118.14 1xds h LEU 66 Ca 0.45 -0.20 -0.08 0.00 0.84 0.00 0.00 57.88 58.89 1xds h LEU 66 Cb 0.78 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 1xds h LEU 66 CO -0.50 0.48 -0.18 0.77 -0.34 0.00 0.00 178.44 178.66 1xds h SER 67 N 0.26 0.49 -0.92 1.25 4.64 -1.34 0.13 113.55 118.08 1xds h SER 67 Ca 0.09 -0.15 0.01 0.00 -0.47 0.00 0.00 61.79 61.27 1xds h SER 67 Cb 0.23 -0.13 -0.05 0.00 -0.31 0.00 0.00 62.40 62.14 1xds h SER 67 CO -0.00 0.69 0.61 0.03 -0.87 0.00 0.00 176.83 177.29 1xds h ARG 68 N 0.45 1.20 -0.21 4.77 3.08 -1.15 0.12 114.38 122.65 1xds h ARG 68 Ca 0.08 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.00 1xds h ARG 68 Cb 0.58 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1xds h ARG 68 CO 0.04 0.80 -0.10 1.25 -1.07 0.00 0.00 179.97 180.89 1xds h LEU 69 N 1.24 0.44 -1.31 3.04 5.85 -0.38 -2.86 115.31 121.33 1xds h LEU 69 Ca 0.34 -0.41 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 1xds h LEU 69 Cb -0.14 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 1xds h LEU 69 CO -0.07 0.75 0.30 0.58 -0.34 0.00 0.00 178.44 179.65 1xds h VAL 70 N 0.13 1.17 -0.59 1.05 2.07 -0.45 0.11 116.25 119.74 1xds h VAL 70 Ca 0.05 -0.45 -0.02 0.00 0.82 0.00 0.00 66.70 67.10 1xds h VAL 70 Cb 0.59 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 1xds h VAL 70 CO 0.03 0.19 0.30 0.03 0.02 0.00 0.00 177.57 178.14 1xds h ARG 71 N 0.77 0.84 -0.28 1.57 3.08 -0.70 0.20 114.38 119.86 1xds h ARG 71 Ca 0.20 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 60.10 1xds h ARG 71 Cb 0.03 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1xds h ARG 71 CO -0.03 0.66 0.03 1.25 -1.07 0.00 0.00 179.97 180.81 1xds h HIS 72 N 0.80 0.52 -0.25 3.04 2.76 -1.12 -1.92 115.15 118.98 1xds h HIS 72 Ca 0.20 -0.08 -0.01 0.00 -2.20 0.00 0.00 60.37 58.29 1xds h HIS 72 Cb 0.09 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 28.90 1xds h HIS 72 CO -0.01 0.59 0.11 -0.07 -1.30 0.00 0.00 177.93 177.26 1xds h LEU 73 N 0.29 0.30 -0.18 0.26 3.38 -0.49 -2.44 115.31 116.44 1xds h LEU 73 Ca 0.08 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1xds h LEU 73 Cb 0.37 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1xds h LEU 73 CO 0.01 0.27 -0.01 0.74 0.09 0.00 0.00 178.44 179.54 1xds h THR 74 N 0.35 1.27 -0.16 0.22 2.02 -0.37 -1.92 112.91 114.32 1xds h THR 74 Ca 0.09 -0.91 -0.04 0.00 0.77 0.00 0.00 66.41 66.32 1xds h THR 74 Cb 0.06 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1xds h THR 74 CO -0.01 0.27 -0.10 0.58 0.37 0.00 0.00 175.52 176.63 1xds h VAL 75 N 0.06 1.16 -0.48 3.16 2.07 -0.90 -2.95 116.25 118.36 1xds h VAL 75 Ca 0.05 -0.70 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1xds h VAL 75 Cb 0.42 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1xds h VAL 75 CO 0.01 0.22 0.00 1.33 0.02 0.00 0.00 177.57 179.15 1xds n VAL 76 N -4.30 0.79 -1.10 2.57 0.24 -0.98 -4.93 118.33 110.62 1xds n VAL 76 Ca -0.01 -0.69 0.00 0.00 -2.04 0.00 0.00 64.34 61.61 1xds n VAL 76 Cb 0.24 0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 1xds n VAL 76 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xds n GLY 77 N 1.18 0.92 0.09 7.63 0.00 -1.12 -4.98 105.19 108.91 1xds n GLY 77 Ca 0.17 -0.57 -0.11 0.00 0.00 0.00 0.00 46.02 45.50 1xds n GLY 77 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xds n VAL 78 N -2.79 1.08 -4.45 1.61 0.31 -0.73 -4.23 118.33 109.14 1xds n VAL 78 Ca 0.00 -0.52 -0.21 0.00 -0.01 0.00 0.00 64.34 63.60 1xds n VAL 78 Cb 0.24 -0.93 -0.11 0.00 -0.91 0.00 0.00 33.84 32.13 1xds n VAL 78 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1xds s LEU 79 N -5.70 2.15 0.34 7.52 1.43 -1.13 -2.65 118.68 120.63 1xds s LEU 79 Ca -0.18 -1.39 0.06 0.00 -1.03 0.00 0.00 54.13 51.59 1xds s LEU 79 Cb 0.06 -0.36 -0.02 0.00 0.03 0.00 0.00 46.19 45.90 1xds s LEU 79 CO 0.52 -0.62 0.33 -1.61 0.23 0.00 0.00 176.35 175.20 1xds s GLU 80 N -3.90 1.83 0.00 1.70 8.01 -0.71 -4.47 118.70 121.16 1xds s GLU 80 Ca 0.36 -1.99 0.00 0.00 0.01 0.00 0.00 54.97 53.35 1xds s GLU 80 Cb 0.09 0.35 0.00 0.00 -4.31 0.00 0.00 34.13 30.26 1xds s GLU 80 CO 0.15 -0.70 0.00 0.41 0.01 0.00 0.00 175.26 175.14 1xds n GLY 81 N -0.63 0.97 0.13 -1.39 0.00 -1.26 -2.00 105.19 101.01 1xds n GLY 81 Ca 0.06 -1.65 0.02 0.00 0.00 0.00 0.00 46.02 44.45 1xds n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xds n GLY 82 N 0.00 -1.48 2.77 -0.02 0.00 -1.26 -4.82 105.19 100.38 1xds n GLY 82 Ca 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.52 1xds n GLY 82 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1xds n GLU 83 N -1.61 0.00 -0.13 1.61 1.02 -1.26 -4.72 120.64 115.55 1xds n GLU 83 Ca -0.00 -0.27 -0.27 0.00 -0.02 0.00 0.00 57.16 56.60 1xds n GLU 83 Cb 0.06 -1.56 -0.09 0.00 -0.02 0.00 0.00 31.44 29.83 1xds n GLU 83 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1xds n ARG 87 N 3.85 0.57 -2.99 3.49 1.74 -1.26 -5.17 116.66 116.88 1xds n ARG 87 Ca 0.00 0.25 -0.33 0.00 -0.77 0.00 0.00 57.85 56.99 1xds n ARG 87 Cb 0.00 -1.46 -0.06 0.00 -1.02 0.00 0.00 32.46 29.91 1xds n ARG 87 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1xds s PRO 88 N -2.55 4.16 -0.60 5.56 0.04 -1.26 -4.54 135.00 135.80 1xds s PRO 88 Ca -0.37 0.90 -0.27 0.00 0.04 0.00 0.00 61.00 61.30 1xds s PRO 88 Cb 0.13 -2.42 0.00 0.00 0.04 0.00 0.00 34.50 32.25 1xds s PRO 88 CO 0.47 0.13 1.56 -1.17 0.04 0.00 0.00 177.00 178.04 1xds s LEU 89 N -2.86 3.32 -0.02 -3.56 2.96 -1.26 -4.10 118.68 113.16 1xds s LEU 89 Ca 0.55 0.21 0.02 0.00 -0.22 0.00 0.00 54.13 54.69 1xds s LEU 89 Cb -0.11 -2.79 0.00 0.00 0.50 0.00 0.00 46.19 43.79 1xds s LEU 89 CO 0.17 -1.97 -0.06 -0.60 -1.32 0.00 0.00 176.35 172.57 1xds s ARG 90 N 6.10 0.68 0.75 1.98 3.52 -0.85 -4.93 118.95 126.20 1xds s ARG 90 Ca 0.55 -0.20 -0.17 0.00 -0.13 0.00 0.00 55.73 55.79 1xds s ARG 90 Cb -0.12 -0.67 -0.10 0.00 -1.56 0.00 0.00 34.95 32.51 1xds s ARG 90 CO 0.22 0.07 -0.04 -2.30 -0.81 0.00 0.00 175.30 172.44 1xds n PRO 91 N 3.33 0.09 -1.92 5.12 -0.02 -1.26 -1.73 135.00 138.60 1xds n PRO 91 Ca -0.18 0.05 -0.15 0.00 -2.02 0.00 0.00 63.50 61.20 1xds n PRO 91 Cb 0.55 -1.36 0.07 0.00 -0.02 0.00 0.00 33.50 32.74 1xds n PRO 91 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1xds n THR 92 N -2.25 0.00 0.05 3.45 -2.24 -1.09 -4.73 114.28 107.48 1xds n THR 92 Ca 0.06 -1.05 -0.11 0.00 -2.27 0.00 0.00 64.05 60.68 1xds n THR 92 Cb 0.51 -1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 67.67 1xds n THR 92 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1xds h ARG 93 N 0.00 -0.33 -0.69 -0.78 2.43 -1.91 -2.05 114.38 111.05 1xds h ARG 93 Ca -0.21 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.08 1xds h ARG 93 Cb 0.79 0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 30.35 1xds h ARG 93 CO 0.23 -0.22 0.33 1.25 -1.51 0.00 0.00 179.97 180.04 1xds h LEU 94 N -0.35 0.40 -5.21 3.80 7.12 -1.92 -3.37 115.31 115.79 1xds h LEU 94 Ca 0.07 0.07 0.00 0.00 0.13 0.00 0.00 57.88 58.14 1xds h LEU 94 Cb 0.43 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 40.57 1xds h LEU 94 CO -0.21 0.23 0.40 0.61 -0.13 0.00 0.00 178.44 179.34 1xds n GLY 95 N -1.30 0.81 4.33 3.75 0.00 -0.77 -4.57 105.19 107.43 1xds n GLY 95 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1xds n GLY 95 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xds n LEU 97 N 2.72 0.00 -1.31 0.99 4.77 -1.26 -4.34 117.00 118.56 1xds n LEU 97 Ca 0.00 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.05 1xds n LEU 97 Cb 0.00 -0.08 0.28 0.00 -2.33 0.00 0.00 43.42 41.29 1xds n LEU 97 CO 0.20 0.00 0.72 0.18 -1.33 0.00 0.00 177.39 177.17 1xds n LEU 98 N 0.00 3.85 -4.70 2.23 4.77 -1.26 -3.75 117.00 118.15 1xds n LEU 98 Ca 0.00 -1.94 -0.42 0.00 -0.03 0.00 0.00 56.01 53.61 1xds n LEU 98 Cb 0.00 -0.51 -0.03 0.00 -2.33 0.00 0.00 43.42 40.55 1xds n LEU 98 CO 0.00 0.66 0.94 0.00 -1.33 0.00 0.00 177.39 177.65 1xds s ALA 99 N -1.79 3.46 0.21 -1.18 0.00 -1.26 -4.59 121.76 116.61 1xds s ALA 99 Ca 0.40 0.70 -0.16 0.00 0.00 0.00 0.00 51.96 52.90 1xds s ALA 99 Cb 0.26 -3.49 0.21 0.00 0.00 0.00 0.00 23.12 20.10 1xds s ALA 99 CO 0.19 -0.66 1.60 0.22 0.00 0.00 0.00 175.76 177.11 1xds h ASP 100 N 7.27 -0.90 0.08 0.00 3.58 -1.91 -2.17 116.42 122.37 1xds h ASP 100 Ca -0.37 0.22 0.00 0.00 0.42 0.00 0.00 57.03 57.30 1xds h ASP 100 Cb 1.18 0.51 0.00 0.00 1.72 0.00 0.00 39.33 42.74 1xds h ASP 100 CO 0.86 -0.27 0.00 0.61 -2.88 0.00 0.00 179.24 177.56 1xds n GLY 101 N -1.46 -1.01 3.76 -0.78 0.00 -1.26 -4.82 105.19 99.62 1xds n GLY 101 Ca 0.07 -0.18 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 1xds n GLY 101 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1xds s HIS 102 N -2.08 2.84 -2.00 1.61 5.65 -0.82 -4.91 115.29 115.57 1xds s HIS 102 Ca 0.44 0.98 0.08 0.00 0.25 0.00 0.00 55.06 56.81 1xds s HIS 102 Cb 0.21 -3.95 0.46 0.00 -1.18 0.00 0.00 32.58 28.12 1xds s HIS 102 CO 0.37 -3.03 1.06 -0.35 -0.65 0.00 0.00 174.74 172.14 1xds n PRO 103 N 1.81 0.72 0.04 2.88 -0.04 -1.26 -2.11 135.00 137.04 1xds n PRO 103 Ca 0.06 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.61 1xds n PRO 103 Cb 0.39 -1.16 -0.09 0.00 -0.04 0.00 0.00 33.50 32.59 1xds n PRO 103 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xds n ALA 104 N -0.66 2.56 -1.97 0.55 0.00 -1.26 -4.66 120.51 115.06 1xds n ALA 104 Ca 0.06 -0.44 -0.20 0.00 0.00 0.00 0.00 53.44 52.85 1xds n ALA 104 Cb 0.03 -0.89 -0.05 0.00 0.00 0.00 0.00 19.45 18.54 1xds n ALA 104 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1xds n GLN 105 N -2.51 -1.58 0.31 0.00 1.13 -0.89 -4.85 117.38 108.99 1xds n GLN 105 Ca -0.04 1.09 0.19 0.00 -1.94 0.00 0.00 57.00 56.30 1xds n GLN 105 Cb 0.61 -5.60 1.04 0.00 0.11 0.00 0.00 30.24 26.41 1xds n GLN 105 CO 0.00 0.00 0.00 1.96 -1.44 0.00 0.00 177.06 177.58 1xds h GLN 106 N 0.00 0.00 -0.68 -1.09 1.08 -1.86 -0.75 115.11 111.81 1xds h GLN 106 Ca -0.44 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 56.71 1xds h GLN 106 Cb 1.33 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.73 1xds h GLN 106 CO 0.59 0.00 0.25 -0.09 -0.95 0.00 0.00 178.83 178.62 1xds h ARG 107 N 0.00 1.03 0.00 1.46 2.43 -1.86 -1.66 114.38 115.78 1xds h ARG 107 Ca 0.01 -0.20 -0.23 0.00 -0.81 0.00 0.00 59.98 58.75 1xds h ARG 107 Cb 0.11 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.50 1xds h ARG 107 CO -0.00 0.87 -0.96 0.00 -1.51 0.00 0.00 179.97 178.38 1xds h ALA 108 N 1.11 0.34 -0.91 2.80 0.00 -1.53 -1.46 119.26 119.61 1xds h ALA 108 Ca 0.22 -0.71 0.02 0.00 0.00 0.00 0.00 54.91 54.44 1xds h ALA 108 Cb 0.25 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 1xds h ALA 108 CO -0.01 0.81 0.60 -1.49 0.00 0.00 0.00 179.25 179.16 1xds h TRP 109 N 0.24 1.13 0.00 0.00 4.06 -1.31 -2.84 115.95 117.24 1xds h TRP 109 Ca -0.08 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.88 1xds h TRP 109 Cb 1.60 -0.38 -0.00 0.00 -1.00 0.00 0.00 29.16 29.37 1xds h TRP 109 CO 0.06 0.70 -0.74 -0.07 -3.56 0.00 0.00 178.44 174.83 1xds h LEU 110 N 1.21 0.00 -9.54 -4.49 3.38 -1.28 -3.21 115.31 101.37 1xds h LEU 110 Ca 0.34 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.75 1xds h LEU 110 Cb -0.10 0.00 0.05 0.00 0.09 0.00 0.00 40.66 40.70 1xds h LEU 110 CO -0.08 0.05 0.92 -0.67 0.09 0.00 0.00 178.44 178.75 1xds n ASP 111 N -2.82 3.52 0.05 -0.43 4.64 -0.55 -4.63 116.55 116.33 1xds n ASP 111 Ca 0.01 1.06 0.13 0.00 -1.38 0.00 0.00 54.79 54.60 1xds n ASP 111 Cb 0.57 -1.49 0.50 0.00 -1.04 0.00 0.00 41.12 39.66 1xds n ASP 111 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 1xds n LEU 112 N 4.01 0.37 0.03 -2.67 4.77 -1.26 -1.95 117.00 120.29 1xds n LEU 112 Ca 0.17 0.54 -0.03 0.00 -0.03 0.00 0.00 56.01 56.66 1xds n LEU 112 Cb 0.32 -0.44 -0.10 0.00 -2.33 0.00 0.00 43.42 40.87 1xds n LEU 112 CO 0.64 -0.14 -0.25 0.78 -1.33 0.00 0.00 177.39 177.09 1xds h ASN 113 N 0.00 0.00 -3.76 -1.43 2.35 -1.95 -3.37 115.58 107.41 1xds h ASN 113 Ca 0.00 0.00 -0.54 0.00 -0.55 0.00 0.00 56.30 55.21 1xds h ASN 113 Cb 0.55 0.00 0.20 0.00 0.05 0.00 0.00 38.32 39.12 1xds h ASN 113 CO 0.00 0.76 -0.11 0.61 -1.65 0.00 0.00 177.43 177.03 1xds n GLY 114 N 1.43 -0.99 0.10 2.83 0.00 -0.82 -4.70 105.19 103.02 1xds n GLY 114 Ca -0.10 -0.58 -0.05 0.00 0.00 0.00 0.00 46.02 45.28 1xds n GLY 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xds h ALA 115 N -1.16 0.59 0.07 4.61 0.00 -1.83 -2.42 119.26 119.13 1xds h ALA 115 Ca -0.45 -0.76 -0.00 0.00 0.00 0.00 0.00 54.91 53.70 1xds h ALA 115 Cb 1.30 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1xds h ALA 115 CO 0.41 1.03 -0.03 0.28 0.00 0.00 0.00 179.25 180.94 1xds h VAL 116 N 0.02 1.17 -0.71 0.00 2.07 -1.88 -1.47 116.25 115.44 1xds h VAL 116 Ca -0.02 -1.47 0.05 0.00 0.82 0.00 0.00 66.70 66.09 1xds h VAL 116 Cb 1.50 2.04 -0.05 0.00 -1.52 0.00 0.00 31.29 33.26 1xds h VAL 116 CO 0.11 0.33 0.42 -1.28 0.02 0.00 0.00 177.57 177.18 1xds h SER 117 N -0.83 0.66 -0.46 0.57 0.87 -1.66 0.34 113.55 113.04 1xds h SER 117 Ca -0.01 0.02 0.08 0.00 -1.23 0.00 0.00 61.79 60.64 1xds h SER 117 Cb 0.62 -0.12 -0.06 0.00 -0.44 0.00 0.00 62.40 62.40 1xds h SER 117 CO 0.02 0.43 0.09 -0.74 -0.53 0.00 0.00 176.83 176.09 1xds h HIS 118 N 0.79 0.14 -0.55 2.24 2.76 -1.49 -2.49 115.15 116.55 1xds h HIS 118 Ca 0.31 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.44 1xds h HIS 118 Cb 0.13 0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.08 1xds h HIS 118 CO -0.06 -0.00 0.09 0.00 -1.30 0.00 0.00 177.93 176.66 1xds h ALA 119 N 1.35 0.73 -1.03 5.26 0.00 -0.10 -3.06 119.26 122.41 1xds h ALA 119 Ca 0.23 -0.25 0.28 0.00 0.00 0.00 0.00 54.91 55.17 1xds h ALA 119 Cb 0.29 -0.21 -0.12 0.00 0.00 0.00 0.00 17.79 17.75 1xds h ALA 119 CO -0.30 0.47 0.62 -0.44 0.00 0.00 0.00 179.25 179.61 1xds h ASP 120 N 0.80 0.56 -0.10 0.00 3.32 0.09 -0.86 116.42 120.23 1xds h ASP 120 Ca 0.17 0.13 0.03 0.00 0.02 0.00 0.00 57.03 57.38 1xds h ASP 120 Cb 0.41 0.05 -0.00 0.00 0.22 0.00 0.00 39.33 40.01 1xds h ASP 120 CO 0.01 0.04 0.08 -0.07 -1.72 0.00 0.00 179.24 177.58 1xds h LEU 121 N 0.46 0.00 -0.62 1.55 3.38 -1.41 -0.82 115.31 117.85 1xds h LEU 121 Ca 0.66 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.63 1xds h LEU 121 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 1xds h LEU 121 CO -0.45 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.08 1xds n ALA 122 N -2.48 1.12 0.26 1.53 0.00 -0.33 -2.65 120.51 117.95 1xds n ALA 122 Ca -0.01 0.08 0.17 0.00 0.00 0.00 0.00 53.44 53.69 1xds n ALA 122 Cb 0.19 -1.17 0.92 0.00 0.00 0.00 0.00 19.45 19.39 1xds n ALA 122 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xds h PHE 123 N 0.00 0.00 0.00 0.00 -1.00 -1.31 -1.65 116.94 112.99 1xds h PHE 123 Ca 0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1xds h PHE 123 Cb 0.05 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.61 1xds h PHE 123 CO 0.00 0.00 0.00 1.79 -1.61 0.00 0.00 178.31 178.49 1xds h THR 124 N 0.00 0.00 -0.44 -1.55 1.35 -1.75 -1.35 112.91 109.18 1xds h THR 124 Ca 0.00 -0.33 -0.09 0.00 -0.55 0.00 0.00 66.41 65.44 1xds h THR 124 Cb 0.04 1.15 -0.05 0.00 -1.73 0.00 0.00 68.15 67.56 1xds h THR 124 CO 0.00 0.00 0.12 0.61 -0.25 0.00 0.00 175.52 176.00 1xds n GLY 125 N 0.02 2.76 0.24 5.82 0.00 -0.62 -4.57 105.19 108.84 1xds n GLY 125 Ca 0.02 -0.61 0.10 0.00 0.00 0.00 0.00 46.02 45.52 1xds n GLY 125 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1xds h LEU 126 N 2.11 0.00 -0.33 0.99 5.85 -1.41 -2.91 115.31 119.60 1xds h LEU 126 Ca 0.11 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 1xds h LEU 126 Cb 1.65 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.66 1xds h LEU 126 CO 0.42 0.19 0.20 0.25 -0.34 0.00 0.00 178.44 179.15 1xds h LEU 127 N 0.00 0.40 -0.47 2.25 5.85 -1.84 -1.61 115.31 119.88 1xds h LEU 127 Ca -0.00 -0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.51 1xds h LEU 127 Cb 0.46 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 1xds h LEU 127 CO 0.02 0.34 -0.39 -0.78 -0.34 0.00 0.00 178.44 177.29 1xds h ASP 128 N 0.42 0.89 -0.63 1.25 1.82 -1.90 -1.46 116.42 116.81 1xds h ASP 128 Ca 0.12 -0.40 0.12 0.00 -0.39 0.00 0.00 57.03 56.47 1xds h ASP 128 Cb 0.02 -0.25 -0.09 0.00 0.68 0.00 0.00 39.33 39.69 1xds h ASP 128 CO -0.02 1.17 0.18 0.58 -1.61 0.00 0.00 179.24 179.54 1xds h VAL 129 N 0.69 0.66 0.00 2.25 2.07 -1.32 -1.56 116.25 119.04 1xds h VAL 129 Ca 0.06 -0.11 -0.17 0.00 0.82 0.00 0.00 66.70 67.29 1xds h VAL 129 Cb 0.96 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1xds h VAL 129 CO 0.09 0.06 -0.83 0.58 0.02 0.00 0.00 177.57 177.49 1xds h VAL 130 N 0.32 1.52 -0.00 2.57 2.07 -1.08 0.13 116.25 121.77 1xds h VAL 130 Ca 0.33 -2.91 -0.05 0.00 0.82 0.00 0.00 66.70 64.90 1xds h VAL 130 Cb 0.48 2.60 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 1xds h VAL 130 CO -0.39 0.81 -0.22 0.03 0.02 0.00 0.00 177.57 177.82 1xds h ARG 131 N 0.00 0.00 0.00 1.57 3.08 -0.39 -3.39 114.38 115.25 1xds h ARG 131 Ca -0.01 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1xds h ARG 131 Cb 1.53 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.58 1xds h ARG 131 CO 0.11 0.23 -0.37 0.25 -1.07 0.00 0.00 179.97 179.11 1xds n THR 132 N -4.27 0.00 -0.22 2.04 -2.24 -0.67 -5.03 114.28 103.88 1xds n THR 132 Ca -0.02 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1xds n THR 132 Cb 0.28 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1xds n THR 132 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xds n GLY 133 N 0.96 1.93 3.82 3.38 0.00 0.45 -5.04 105.19 110.69 1xds n GLY 133 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1xds n GLY 133 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xds s ARG 134 N -0.22 4.19 0.74 1.61 1.81 -1.25 -4.78 118.95 121.06 1xds s ARG 134 Ca 0.00 0.83 -0.13 0.00 -1.72 0.00 0.00 55.73 54.70 1xds s ARG 134 Cb 0.00 -2.76 0.04 0.00 -0.45 0.00 0.00 34.95 31.79 1xds s ARG 134 CO 0.00 0.33 1.14 -1.25 -0.68 0.00 0.00 175.30 174.83 1xds s PRO 135 N -2.25 2.24 -0.00 3.54 0.04 -1.26 -4.29 135.00 133.03 1xds s PRO 135 Ca 0.46 1.46 0.15 0.00 0.04 0.00 0.00 61.00 63.12 1xds s PRO 135 Cb -0.15 -1.87 -0.17 0.00 0.04 0.00 0.00 34.50 32.35 1xds s PRO 135 CO 0.20 -1.70 0.66 0.00 0.04 0.00 0.00 177.00 176.20 1xds n ALA 136 N -3.01 4.03 -0.12 8.56 0.00 0.53 -4.65 120.51 125.85 1xds n ALA 136 Ca 0.11 -0.44 -0.09 0.00 0.00 0.00 0.00 53.44 53.02 1xds n ALA 136 Cb 0.52 -0.56 -0.02 0.00 0.00 0.00 0.00 19.45 19.39 1xds n ALA 136 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1xds h TYR 137 N 0.00 0.56 -0.35 0.00 3.20 -1.74 -2.57 116.97 116.07 1xds h TYR 137 Ca 0.00 -0.05 0.01 0.00 3.14 0.00 0.00 58.73 61.83 1xds h TYR 137 Cb 0.37 -0.17 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 1xds h TYR 137 CO 0.00 0.53 0.23 0.00 -1.64 0.00 0.00 178.16 177.28 1xds h ALA 138 N 0.97 0.44 -0.64 1.82 0.00 -1.83 -2.23 119.26 117.80 1xds h ALA 138 Ca 0.12 -0.02 0.18 0.00 0.00 0.00 0.00 54.91 55.18 1xds h ALA 138 Cb 0.22 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1xds h ALA 138 CO -0.01 -0.10 0.46 0.78 0.00 0.00 0.00 179.25 180.37 1xds h GLY 139 N 0.46 0.12 0.71 0.00 0.00 -1.75 -0.79 103.07 101.82 1xds h GLY 139 Ca 0.13 -0.03 -0.33 0.00 0.00 0.00 0.00 47.33 47.11 1xds h GLY 139 CO -0.04 0.01 -1.91 -2.13 0.00 0.00 0.00 176.54 172.47 1xds n ARG 140 N -4.37 0.68 0.00 4.80 3.00 -1.00 -4.74 116.66 115.02 1xds n ARG 140 Ca 0.12 0.24 0.00 0.00 -0.00 0.00 0.00 57.85 58.22 1xds n ARG 140 Cb 0.67 -1.72 0.00 0.00 0.00 0.00 0.00 32.46 31.41 1xds n ARG 140 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1xds n TYR 141 N -3.15 0.00 0.00 -0.14 0.53 -0.87 -5.06 117.16 108.47 1xds n TYR 141 Ca -0.25 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.63 1xds n TYR 141 Cb 1.06 0.00 0.00 0.00 -1.03 0.00 0.00 39.34 39.37 1xds n TYR 141 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1xds n GLY 142 N 0.67 2.82 3.76 2.72 0.00 -0.33 -5.02 105.19 109.81 1xds n GLY 142 Ca 0.00 -0.71 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 1xds n GLY 142 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xds s ARG 143 N 0.00 2.83 0.86 1.61 0.52 -1.26 -4.85 118.95 118.65 1xds s ARG 143 Ca 0.00 -0.70 -0.11 0.00 -0.52 0.00 0.00 55.73 54.40 1xds s ARG 143 Cb 0.00 -2.70 0.11 0.00 0.52 0.00 0.00 34.95 32.88 1xds s ARG 143 CO 0.00 0.57 1.11 -1.25 0.02 0.00 0.00 175.30 175.74 1xds s PRO 144 N -2.31 1.54 0.13 3.54 0.04 -1.26 -4.09 135.00 132.58 1xds s PRO 144 Ca 0.28 1.23 -0.30 0.00 0.04 0.00 0.00 61.00 62.25 1xds s PRO 144 Cb -0.12 -1.81 -0.07 0.00 0.04 0.00 0.00 34.50 32.54 1xds s PRO 144 CO 0.21 -2.16 1.57 0.35 0.04 0.00 0.00 177.00 177.00 1xds h PHE 145 N -1.51 -1.34 -0.49 0.56 3.57 -1.94 -1.67 116.94 114.12 1xds h PHE 145 Ca -0.45 0.05 -0.07 0.00 3.53 0.00 0.00 57.97 61.03 1xds h PHE 145 Cb 1.26 0.61 -0.02 0.00 2.79 0.00 0.00 35.95 40.59 1xds h PHE 145 CO 0.52 -0.50 0.03 -1.49 -2.23 0.00 0.00 178.31 174.64 1xds h TRP 146 N -0.50 0.91 -0.53 0.41 4.06 -1.94 -1.82 115.95 116.54 1xds h TRP 146 Ca 0.07 -0.15 0.04 0.00 2.06 0.00 0.00 58.89 60.91 1xds h TRP 146 Cb 0.64 -0.24 -0.03 0.00 -1.00 0.00 0.00 29.16 28.53 1xds h TRP 146 CO -0.53 0.85 0.35 0.93 -3.56 0.00 0.00 178.44 176.48 1xds h GLU 147 N 0.71 0.55 -0.30 0.49 5.08 -1.86 -2.49 114.58 116.76 1xds h GLU 147 Ca 0.14 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.30 1xds h GLU 147 Cb 0.47 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1xds h GLU 147 CO 0.02 0.37 -0.48 0.22 -1.00 0.00 0.00 179.01 178.14 1xds h ASP 148 N 0.57 0.88 -0.41 1.42 3.58 -0.58 -2.67 116.42 119.21 1xds h ASP 148 Ca 0.22 -0.44 -0.10 0.00 0.42 0.00 0.00 57.03 57.13 1xds h ASP 148 Cb 0.15 -0.25 -0.02 0.00 1.72 0.00 0.00 39.33 40.93 1xds h ASP 148 CO -0.06 1.21 -0.09 -0.07 -2.88 0.00 0.00 179.24 177.35 1xds h LEU 149 N 0.64 0.85 -0.16 2.28 3.38 -0.93 -2.38 115.31 118.98 1xds h LEU 149 Ca 0.03 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1xds h LEU 149 Cb 1.06 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1xds h LEU 149 CO 0.10 0.96 -0.08 0.77 0.09 0.00 0.00 178.44 180.29 1xds h SER 150 N 0.77 0.00 0.40 -0.43 4.64 -1.42 -3.19 113.55 114.32 1xds h SER 150 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1xds h SER 150 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1xds h SER 150 CO 0.04 0.08 -1.06 0.00 -0.87 0.00 0.00 176.83 175.02 1xds n ALA 151 N -2.12 3.44 -4.00 5.18 0.00 -1.01 -4.79 120.51 117.21 1xds n ALA 151 Ca 0.03 -0.42 -0.31 0.00 0.00 0.00 0.00 53.44 52.75 1xds n ALA 151 Cb 0.54 -0.95 -0.15 0.00 0.00 0.00 0.00 19.45 18.88 1xds n ALA 151 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1xds s ASP 152 N -3.90 4.03 0.26 0.00 3.68 -0.90 -5.02 116.67 114.82 1xds s ASP 152 Ca 0.03 -1.23 -0.03 0.00 2.13 0.00 0.00 52.55 53.46 1xds s ASP 152 Cb 0.14 -1.33 0.33 0.00 -1.45 0.00 0.00 42.92 40.61 1xds s ASP 152 CO 0.81 -0.21 1.80 0.58 0.13 0.00 0.00 175.17 178.28 1xds h VAL 153 N 6.67 1.24 -0.34 1.11 2.07 -1.87 -3.03 116.25 122.09 1xds h VAL 153 Ca -0.20 -0.85 -0.13 0.00 0.82 0.00 0.00 66.70 66.34 1xds h VAL 153 Cb 1.06 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.44 1xds h VAL 153 CO 0.44 0.32 -0.32 0.00 0.02 0.00 0.00 177.57 178.03 1xds h ALA 154 N 1.28 0.79 -0.14 1.67 0.00 -1.95 -2.19 119.26 118.73 1xds h ALA 154 Ca 0.19 -0.41 -0.17 0.00 0.00 0.00 0.00 54.91 54.52 1xds h ALA 154 Cb 0.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1xds h ALA 154 CO -0.00 0.65 -0.61 -0.07 0.00 0.00 0.00 179.25 179.22 1xds h LEU 155 N 0.63 0.55 -0.27 0.00 3.38 -1.83 -2.35 115.31 115.42 1xds h LEU 155 Ca 0.07 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 57.72 1xds h LEU 155 Cb 0.85 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 1xds h LEU 155 CO 0.07 1.02 0.15 0.00 0.09 0.00 0.00 178.44 179.78 1xds h ALA 156 N 0.98 0.35 -0.36 1.53 0.00 -1.41 -1.26 119.26 119.08 1xds h ALA 156 Ca -0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1xds h ALA 156 Cb 1.16 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 1xds h ALA 156 CO 0.11 -0.12 0.06 -0.44 0.00 0.00 0.00 179.25 178.86 1xds h ASP 157 N 0.32 0.57 -0.39 0.00 5.19 -1.35 -1.29 116.42 119.49 1xds h ASP 157 Ca 0.10 -0.26 -0.07 0.00 -0.62 0.00 0.00 57.03 56.18 1xds h ASP 157 Cb 0.07 -0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.41 1xds h ASP 157 CO -0.02 0.69 -0.02 0.77 -3.12 0.00 0.00 179.24 177.54 1xds h SER 158 N 0.43 0.68 -0.91 6.45 4.64 -1.40 -0.80 113.55 122.64 1xds h SER 158 Ca 0.11 -0.32 0.05 0.00 -0.47 0.00 0.00 61.79 61.16 1xds h SER 158 Cb 0.36 -0.18 -0.06 0.00 -0.31 0.00 0.00 62.40 62.21 1xds h SER 158 CO 0.01 0.84 0.60 0.15 -0.87 0.00 0.00 176.83 177.55 1xds h PHE 159 N 0.51 1.08 -0.19 4.77 3.57 -1.15 -1.87 116.94 123.67 1xds h PHE 159 Ca 0.11 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 1xds h PHE 159 Cb 0.50 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 1xds h PHE 159 CO 0.04 0.60 0.04 0.22 -2.23 0.00 0.00 178.31 176.98 1xds h ASP 160 N 1.09 0.29 -0.02 0.41 3.58 -0.84 -2.77 116.42 118.16 1xds h ASP 160 Ca 0.38 -0.24 -0.03 0.00 0.42 0.00 0.00 57.03 57.55 1xds h ASP 160 Cb 0.11 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.07 1xds h ASP 160 CO -0.13 0.45 -0.06 0.00 -2.88 0.00 0.00 179.24 176.62 1xds h ALA 161 N 0.84 1.62 0.00 -0.78 0.00 -0.84 -3.10 119.26 116.99 1xds h ALA 161 Ca 0.06 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1xds h ALA 161 Cb 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1xds h ALA 161 CO 0.00 0.28 0.00 1.28 0.00 0.00 0.00 179.25 180.81 1xds n LEU 162 N -4.34 3.79 -1.45 0.00 4.77 -0.73 -5.10 117.00 113.94 1xds n LEU 162 Ca -0.01 -1.77 0.00 0.00 -0.03 0.00 0.00 56.01 54.20 1xds n LEU 162 Cb 0.21 -0.74 0.00 0.00 -2.33 0.00 0.00 43.42 40.56 1xds n LEU 162 CO 0.37 0.69 -0.20 -1.54 -1.33 0.00 0.00 177.39 175.38 1xds n SER 164 N 1.07 -5.00 -0.22 -1.43 3.41 -1.18 -5.11 113.62 105.16 1xds n SER 164 Ca 0.00 0.71 0.10 0.00 -0.26 0.00 0.00 58.87 59.41 1xds n SER 164 Cb 0.45 -2.69 -0.06 0.00 -0.26 0.00 0.00 64.21 61.65 1xds n SER 164 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1xds n GLU 172 N 0.75 0.89 -0.11 4.33 -0.58 -1.26 -5.21 120.64 119.45 1xds n GLU 172 Ca 0.00 -0.45 -0.03 0.00 -0.42 0.00 0.00 57.16 56.27 1xds n GLU 172 Cb 0.00 -1.43 -0.03 0.00 -0.57 0.00 0.00 31.44 29.42 1xds n GLU 172 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1xds n ALA 173 N -0.80 -0.16 -0.07 0.62 0.00 -1.26 -0.35 120.51 118.48 1xds n ALA 173 Ca 0.06 0.22 -0.14 0.00 0.00 0.00 0.00 53.44 53.57 1xds n ALA 173 Cb 0.37 0.03 -0.12 0.00 0.00 0.00 0.00 19.45 19.73 1xds n ALA 173 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1xds h PRO 174 N 0.00 0.00 -0.94 0.00 0.13 -2.01 -2.46 132.00 126.72 1xds h PRO 174 Ca 0.04 0.00 0.27 0.00 -0.87 0.00 0.00 66.00 65.44 1xds h PRO 174 Cb 0.10 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.20 1xds h PRO 174 CO -0.24 0.92 0.68 0.00 -0.23 0.00 0.00 178.00 179.12 1xds h ALA 175 N -0.17 2.88 0.02 -0.56 0.00 -1.84 -2.58 119.26 117.00 1xds h ALA 175 Ca -0.06 -0.03 -0.36 0.00 0.00 0.00 0.00 54.91 54.45 1xds h ALA 175 Cb 0.98 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.78 1xds h ALA 175 CO -0.04 -1.14 -2.27 -3.47 0.00 0.00 0.00 179.25 172.33 1xds n ASP 176 N -4.26 1.02 0.11 0.00 2.03 0.52 -4.43 116.55 111.54 1xds n ASP 176 Ca 0.20 0.05 0.12 0.00 0.52 0.00 0.00 54.79 55.67 1xds n ASP 176 Cb 1.00 0.16 0.45 0.00 -0.72 0.00 0.00 41.12 42.02 1xds n ASP 176 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xds n ALA 177 N -2.91 1.95 -2.88 -1.67 0.00 -0.93 -4.88 120.51 109.19 1xds n ALA 177 Ca -0.34 0.03 -0.24 0.00 0.00 0.00 0.00 53.44 52.88 1xds n ALA 177 Cb 1.08 -1.42 -0.16 0.00 0.00 0.00 0.00 19.45 18.95 1xds n ALA 177 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1xds s TYR 178 N -3.20 1.50 -0.87 0.00 5.04 -1.11 -5.07 117.35 113.64 1xds s TYR 178 Ca 0.07 -0.40 -0.25 0.00 -2.44 0.00 0.00 57.07 54.06 1xds s TYR 178 Cb 0.11 -1.01 0.01 0.00 0.35 0.00 0.00 41.96 41.42 1xds s TYR 178 CO 0.48 -0.13 1.58 0.34 -1.34 0.00 0.00 175.55 176.48 1xds s ASP 179 N 0.02 5.93 0.27 4.32 2.15 -1.26 -4.84 116.67 123.25 1xds s ASP 179 Ca -0.02 -0.78 0.26 0.00 0.43 0.00 0.00 52.55 52.44 1xds s ASP 179 Cb -0.10 -2.56 0.81 0.00 -0.30 0.00 0.00 42.92 40.77 1xds s ASP 179 CO 0.01 -2.00 1.75 -0.50 -0.17 0.00 0.00 175.17 174.27 1xds h TRP 180 N 10.94 0.00 -1.02 -5.34 4.06 -1.94 -3.29 115.95 119.36 1xds h TRP 180 Ca -0.00 0.00 0.24 0.00 2.06 0.00 0.00 58.89 61.19 1xds h TRP 180 Cb 1.04 0.00 -0.10 0.00 -1.00 0.00 0.00 29.16 29.10 1xds h TRP 180 CO 1.20 0.00 0.63 0.66 -3.56 0.00 0.00 178.44 177.37 1xds h SER 181 N 0.00 0.57 -0.59 -3.49 4.64 -2.01 -1.57 113.55 111.10 1xds h SER 181 Ca 0.00 0.10 -0.28 0.00 -0.47 0.00 0.00 61.79 61.14 1xds h SER 181 Cb 0.68 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.61 1xds h SER 181 CO 0.00 0.13 0.36 0.00 -0.87 0.00 0.00 176.83 176.45 1xds n ALA 182 N -2.40 4.30 -2.80 5.18 0.00 -1.24 -4.89 120.51 118.66 1xds n ALA 182 Ca 0.25 -1.73 -0.15 0.00 0.00 0.00 0.00 53.44 51.81 1xds n ALA 182 Cb 0.77 -1.25 -0.14 0.00 0.00 0.00 0.00 19.45 18.83 1xds n ALA 182 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xds s VAL 183 N -2.08 0.39 -0.00 0.00 1.01 -0.59 -5.05 120.40 114.07 1xds s VAL 183 Ca 0.36 -0.41 0.00 0.00 0.00 0.00 0.00 61.98 61.93 1xds s VAL 183 Cb 0.30 -0.37 -0.00 0.00 0.00 0.00 0.00 36.38 36.31 1xds s VAL 183 CO 0.07 -0.03 0.00 0.54 0.00 0.00 0.00 175.10 175.69 1xds n ARG 184 N 2.59 2.31 -3.65 2.72 5.12 -1.26 -4.82 116.66 119.66 1xds n ARG 184 Ca -0.15 -0.00 -0.12 0.00 -1.93 0.00 0.00 57.85 55.65 1xds n ARG 184 Cb 0.57 -1.00 -0.12 0.00 -1.16 0.00 0.00 32.46 30.75 1xds n ARG 184 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1xds s HIS 185 N -2.00 -0.54 -0.15 -1.55 2.46 -1.26 -0.60 115.29 111.65 1xds s HIS 185 Ca -0.00 1.13 -0.00 0.00 0.47 0.00 0.00 55.06 56.66 1xds s HIS 185 Cb 0.00 0.06 -0.01 0.00 -0.13 0.00 0.00 32.58 32.50 1xds s HIS 185 CO 0.00 -0.40 -0.14 0.08 -2.47 0.00 0.00 174.74 171.81 1xds s VAL 186 N 2.48 2.87 -0.27 0.89 1.01 -0.56 -1.93 120.40 124.88 1xds s VAL 186 Ca 0.01 -0.71 -0.03 0.00 0.00 0.00 0.00 61.98 61.25 1xds s VAL 186 Cb -0.12 -2.21 0.02 0.00 0.00 0.00 0.00 36.38 34.07 1xds s VAL 186 CO -0.10 0.51 -0.01 -0.22 0.00 0.00 0.00 175.10 175.28 1xds s LEU 187 N 0.65 3.46 -0.41 3.92 0.20 -0.12 -1.25 118.68 125.13 1xds s LEU 187 Ca -0.07 -0.87 -0.16 0.00 0.69 0.00 0.00 54.13 53.71 1xds s LEU 187 Cb -0.16 -1.73 0.02 0.00 -0.43 0.00 0.00 46.19 43.89 1xds s LEU 187 CO 0.02 -0.16 0.36 -0.62 -0.29 0.00 0.00 176.35 175.66 1xds s ASP 188 N 1.37 6.15 -0.25 3.68 2.15 0.10 -0.56 116.67 129.30 1xds s ASP 188 Ca 0.00 -0.79 -0.16 0.00 0.43 0.00 0.00 52.55 52.04 1xds s ASP 188 Cb -0.17 -2.19 -0.04 0.00 -0.30 0.00 0.00 42.92 40.23 1xds s ASP 188 CO -0.02 -0.50 0.41 -0.69 -0.17 0.00 0.00 175.17 174.20 1xds s VAL 189 N 1.88 5.16 -1.10 1.11 1.01 -0.52 -1.48 120.40 126.46 1xds s VAL 189 Ca 0.08 0.67 -0.06 0.00 0.00 0.00 0.00 61.98 62.67 1xds s VAL 189 Cb -0.18 -3.73 0.01 0.00 0.00 0.00 0.00 36.38 32.48 1xds s VAL 189 CO 0.12 0.17 0.95 0.61 0.00 0.00 0.00 175.10 176.95 1xds n GLY 190 N 4.39 -0.28 0.58 4.51 0.00 0.27 -4.45 105.19 110.21 1xds n GLY 190 Ca -0.08 0.08 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1xds n GLY 190 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xds n GLY 191 N -1.61 0.78 7.00 -0.02 0.00 -1.24 -4.82 105.19 105.28 1xds n GLY 191 Ca -0.05 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.74 1xds n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xds n GLY 192 N 0.53 1.70 0.00 -0.02 0.00 -1.26 -2.67 105.19 103.47 1xds n GLY 192 Ca 0.07 -0.61 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1xds n GLY 192 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1xds n ASN 193 N 0.78 0.00 0.00 1.61 2.04 -1.26 -4.51 115.26 113.92 1xds n ASN 193 Ca 0.00 -1.24 0.00 0.00 -0.44 0.00 0.00 54.58 52.90 1xds n ASN 193 Cb 0.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 1xds n ASN 193 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1xds n GLY 194 N 0.14 0.68 0.38 4.83 0.00 -1.09 -3.67 105.19 106.46 1xds n GLY 194 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1xds n GLY 194 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xds n GLY 195 N -2.60 0.10 0.00 -0.02 0.00 -1.26 -0.76 105.19 100.66 1xds n GLY 195 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1xds n GLY 195 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1xds n LEU 197 N 0.22 0.00 -0.12 0.99 7.94 -1.26 -2.13 117.00 122.64 1xds n LEU 197 Ca 0.00 0.00 -0.04 0.00 -1.11 0.00 0.00 56.01 54.86 1xds n LEU 197 Cb 0.02 0.00 0.03 0.00 0.53 0.00 0.00 43.42 44.00 1xds n LEU 197 CO 0.00 0.00 0.86 0.00 -1.11 0.00 0.00 177.39 177.14 1xds h ALA 198 N 0.00 0.38 -0.45 1.96 0.00 -1.35 -1.24 119.26 118.57 1xds h ALA 198 Ca 0.00 0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 1xds h ALA 198 Cb 0.00 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1xds h ALA 198 CO 0.00 -0.38 -0.23 0.00 0.00 0.00 0.00 179.25 178.64 1xds h ALA 199 N 1.34 0.74 -0.57 0.00 0.00 -1.67 0.42 119.26 119.52 1xds h ALA 199 Ca 0.20 -0.39 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1xds h ALA 199 Cb 0.27 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1xds h ALA 199 CO -0.31 0.66 0.25 0.82 0.00 0.00 0.00 179.25 180.67 1xds h ILE 200 N 0.80 1.22 -0.23 0.00 2.04 -1.82 -1.63 117.51 117.89 1xds h ILE 200 Ca 0.10 -0.66 -0.09 0.00 1.00 0.00 0.00 64.86 65.22 1xds h ILE 200 Cb 0.79 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 37.45 1xds h ILE 200 CO 0.07 0.26 -0.21 0.00 0.00 0.00 0.00 178.15 178.26 1xds h ALA 201 N 1.09 0.33 -0.83 1.87 0.00 -0.85 -1.94 119.26 118.92 1xds h ALA 201 Ca 0.19 -0.36 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1xds h ALA 201 Cb 0.17 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1xds h ALA 201 CO -0.02 0.27 0.55 -0.07 0.00 0.00 0.00 179.25 179.98 1xds h LEU 202 N 0.23 0.96 -0.84 0.00 3.38 -0.13 -2.61 115.31 116.30 1xds h LEU 202 Ca 0.04 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.86 1xds h LEU 202 Cb 0.76 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 1xds h LEU 202 CO 0.05 0.70 -0.44 -0.09 0.09 0.00 0.00 178.44 178.75 1xds h ARG 203 N 1.13 0.30 -3.16 1.13 2.43 -1.15 -3.38 114.38 111.68 1xds h ARG 203 Ca 0.31 -0.16 -0.62 0.00 -0.81 0.00 0.00 59.98 58.70 1xds h ARG 203 Cb -0.13 0.00 -0.41 0.00 -0.42 0.00 0.00 29.97 29.02 1xds h ARG 203 CO -0.07 0.69 -0.69 0.00 -1.51 0.00 0.00 179.97 178.40 1xds s ALA 204 N -4.09 2.72 0.58 2.80 0.00 -0.74 -5.00 121.76 118.02 1xds s ALA 204 Ca -0.05 -2.94 0.28 0.00 0.00 0.00 0.00 51.96 49.25 1xds s ALA 204 Cb 0.13 -2.02 1.50 0.00 0.00 0.00 0.00 23.12 22.73 1xds s ALA 204 CO 0.79 -2.04 1.95 -1.35 0.00 0.00 0.00 175.76 175.10 1xds h PRO 205 N 6.57 0.00 0.00 0.00 0.11 -1.76 -2.70 132.00 134.22 1xds h PRO 205 Ca -0.03 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 1xds h PRO 205 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1xds h PRO 205 CO 0.58 0.00 0.00 -2.39 -0.21 0.00 0.00 178.00 175.98 1xds n HIS 206 N -3.85 0.81 -2.98 0.65 1.44 -1.26 -4.92 115.22 105.11 1xds n HIS 206 Ca 0.08 0.28 -0.34 0.00 -2.01 0.00 0.00 57.72 55.73 1xds n HIS 206 Cb 0.61 -0.96 -0.06 0.00 0.12 0.00 0.00 29.99 29.70 1xds n HIS 206 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1xds s LEU 207 N -4.41 4.09 0.07 2.39 1.43 -1.02 -4.96 118.68 116.26 1xds s LEU 207 Ca 0.07 1.51 0.01 0.00 -1.03 0.00 0.00 54.13 54.69 1xds s LEU 207 Cb 0.11 -4.18 -0.04 0.00 0.03 0.00 0.00 46.19 42.11 1xds s LEU 207 CO 0.47 -0.21 0.17 -0.13 0.23 0.00 0.00 176.35 176.87 1xds s ARG 208 N -2.81 3.29 0.06 1.70 1.81 0.23 -4.84 118.95 118.38 1xds s ARG 208 Ca 0.55 -0.51 0.03 0.00 -1.72 0.00 0.00 55.73 54.08 1xds s ARG 208 Cb -0.12 -2.95 -0.03 0.00 -0.45 0.00 0.00 34.95 31.40 1xds s ARG 208 CO 0.17 0.60 -0.09 0.20 -0.68 0.00 0.00 175.30 175.50 1xds s GLY 209 N -2.47 0.64 -0.02 -3.53 0.00 -0.20 -1.50 107.32 100.23 1xds s GLY 209 Ca 0.33 -0.94 0.01 0.00 0.00 0.00 0.00 44.72 44.13 1xds s GLY 209 CO 0.26 -1.00 -0.04 -1.59 0.00 0.00 0.00 173.10 170.74 1xds s THR 210 N -1.83 0.40 -0.11 0.90 2.01 -0.38 -1.15 115.64 115.48 1xds s THR 210 Ca -0.04 -0.13 0.01 0.00 0.31 0.00 0.00 61.69 61.84 1xds s THR 210 Cb -0.07 -0.39 -0.02 0.00 0.01 0.00 0.00 72.50 72.04 1xds s THR 210 CO -0.00 0.15 -0.14 -0.22 -0.69 0.00 0.00 174.62 173.71 1xds s LEU 211 N 0.37 2.66 -0.22 4.42 0.20 -0.41 -0.73 118.68 124.97 1xds s LEU 211 Ca -0.04 -0.31 -0.04 0.00 0.69 0.00 0.00 54.13 54.43 1xds s LEU 211 Cb -0.08 -1.58 -0.00 0.00 -0.43 0.00 0.00 46.19 44.10 1xds s LEU 211 CO -0.00 0.21 -0.04 -0.69 -0.29 0.00 0.00 176.35 175.53 1xds s VAL 212 N 0.07 3.32 0.11 1.68 1.01 -0.55 -0.61 120.40 125.43 1xds s VAL 212 Ca -0.06 -0.56 -0.15 0.00 0.00 0.00 0.00 61.98 61.21 1xds s VAL 212 Cb -0.15 -2.53 0.03 0.00 0.00 0.00 0.00 36.38 33.73 1xds s VAL 212 CO 0.05 0.39 0.37 -1.61 0.00 0.00 0.00 175.10 174.30 1xds s GLU 213 N 1.46 1.01 1.15 2.72 0.41 -1.26 -0.57 118.70 123.62 1xds s GLU 213 Ca 0.05 -0.69 -0.13 0.00 -0.41 0.00 0.00 54.97 53.79 1xds s GLU 213 Cb -0.14 0.44 0.25 0.00 -1.78 0.00 0.00 34.13 32.89 1xds s GLU 213 CO -0.03 -0.38 0.87 1.28 -0.49 0.00 0.00 175.26 176.51 1xds n LEU 214 N -0.08 -1.14 -0.01 1.80 4.77 -1.25 -1.76 117.00 119.34 1xds n LEU 214 Ca -0.16 -0.10 -0.10 0.00 -0.03 0.00 0.00 56.01 55.62 1xds n LEU 214 Cb 0.63 -1.24 -0.04 0.00 -2.33 0.00 0.00 43.42 40.44 1xds n LEU 214 CO 0.18 -3.18 0.84 0.00 -1.33 0.00 0.00 177.39 173.90 1xds h ALA 215 N -2.52 0.08 0.40 -1.18 0.00 -1.98 -1.24 119.26 112.81 1xds h ALA 215 Ca -0.59 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.36 1xds h ALA 215 Cb 1.33 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.23 1xds h ALA 215 CO 0.47 -0.49 -0.30 0.78 0.00 0.00 0.00 179.25 179.71 1xds h GLY 216 N -0.01 -0.97 2.00 0.00 0.00 -1.94 -2.00 103.07 100.15 1xds h GLY 216 Ca 0.07 0.42 -0.02 0.00 0.00 0.00 0.00 47.33 47.79 1xds h GLY 216 CO -0.15 -0.32 -0.11 -2.55 0.00 0.00 0.00 176.54 173.41 1xds h PRO 217 N -0.67 0.00 -0.70 4.80 0.11 -1.88 -2.62 132.00 131.04 1xds h PRO 217 Ca -0.05 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.04 1xds h PRO 217 Cb 0.55 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.63 1xds h PRO 217 CO 0.02 0.11 0.38 0.00 -0.21 0.00 0.00 178.00 178.31 1xds h ALA 218 N 1.89 0.90 -0.36 -0.75 0.00 -0.88 -1.57 119.26 118.49 1xds h ALA 218 Ca -0.00 -0.11 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 1xds h ALA 218 Cb 0.24 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1xds h ALA 218 CO 0.01 0.42 -0.38 1.49 0.00 0.00 0.00 179.25 180.79 1xds h GLU 219 N 0.97 0.85 -0.57 0.00 4.57 -0.98 -1.39 114.58 118.01 1xds h GLU 219 Ca 0.25 -0.44 0.00 0.00 -1.18 0.00 0.00 59.36 57.99 1xds h GLU 219 Cb 0.04 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.61 1xds h GLU 219 CO -0.04 1.08 0.37 0.00 -1.18 0.00 0.00 179.01 179.24 1xds h ARG 220 N 0.70 0.76 -0.19 1.92 3.08 -1.44 -2.72 114.38 116.48 1xds h ARG 220 Ca 0.06 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1xds h ARG 220 Cb 0.95 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 30.82 1xds h ARG 220 CO 0.09 0.51 0.09 0.00 -1.07 0.00 0.00 179.97 179.59 1xds h ALA 221 N 1.63 0.25 -0.87 0.04 0.00 -0.39 -1.86 119.26 118.05 1xds h ALA 221 Ca 0.21 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1xds h ALA 221 Cb -0.08 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 1xds h ALA 221 CO -0.04 -0.18 0.54 0.00 0.00 0.00 0.00 179.25 179.56 1xds h ARG 222 N 0.17 0.94 -0.32 0.00 3.08 -1.14 -0.48 114.38 116.63 1xds h ARG 222 Ca 0.07 -0.06 -0.16 0.00 0.07 0.00 0.00 59.98 59.90 1xds h ARG 222 Cb 0.14 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 29.97 1xds h ARG 222 CO -0.01 0.62 -0.45 0.00 -1.07 0.00 0.00 179.97 179.07 1xds h ARG 223 N 0.97 0.83 -0.23 0.04 3.08 -1.31 -1.72 114.38 116.04 1xds h ARG 223 Ca 0.39 -0.47 -0.14 0.00 0.07 0.00 0.00 59.98 59.83 1xds h ARG 223 Cb 0.21 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 1xds h ARG 223 CO -0.19 1.10 -0.41 -0.09 -1.07 0.00 0.00 179.97 179.32 1xds h ARG 224 N 0.67 0.69 -0.48 0.04 2.43 -1.02 -1.99 114.38 114.71 1xds h ARG 224 Ca 0.04 -0.43 -0.03 0.00 -0.81 0.00 0.00 59.98 58.76 1xds h ARG 224 Cb 1.03 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.60 1xds h ARG 224 CO 0.10 1.05 0.19 0.74 -1.51 0.00 0.00 179.97 180.54 1xds h PHE 225 N 0.40 0.73 -0.40 2.20 0.05 -1.08 -1.44 116.94 117.40 1xds h PHE 225 Ca 0.02 -0.06 -0.02 0.00 3.82 0.00 0.00 57.97 61.73 1xds h PHE 225 Cb 1.00 -0.22 -0.02 0.00 2.00 0.00 0.00 35.95 38.72 1xds h PHE 225 CO 0.08 0.61 0.15 0.00 -0.18 0.00 0.00 178.31 178.98 1xds h ALA 226 N 1.04 0.52 0.00 2.45 0.00 -1.32 -0.41 119.26 121.54 1xds h ALA 226 Ca 0.16 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1xds h ALA 226 Cb 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1xds h ALA 226 CO -0.01 0.13 0.00 -0.44 0.00 0.00 0.00 179.25 178.93 1xds h ASP 227 N 0.50 0.00 0.18 0.00 3.32 -1.30 -2.61 116.42 116.52 1xds h ASP 227 Ca 0.13 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.18 1xds h ASP 227 Cb 0.20 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.75 1xds h ASP 227 CO -0.01 0.00 -0.33 0.00 -1.72 0.00 0.00 179.24 177.18 1xds n ALA 228 N -1.90 3.24 -2.96 3.45 0.00 -0.55 -4.97 120.51 116.82 1xds n ALA 228 Ca 0.03 -0.46 -0.12 0.00 0.00 0.00 0.00 53.44 52.89 1xds n ALA 228 Cb 0.34 -1.05 0.06 0.00 0.00 0.00 0.00 19.45 18.80 1xds n ALA 228 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xds n GLY 229 N 1.37 -0.22 0.00 0.00 0.00 -0.94 -4.97 105.19 100.43 1xds n GLY 229 Ca 0.11 0.02 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1xds n GLY 229 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xds n LEU 230 N -3.12 0.71 0.31 0.99 4.77 -0.21 -4.78 117.00 115.67 1xds n LEU 230 Ca -0.17 -0.74 0.19 0.00 -0.03 0.00 0.00 56.01 55.25 1xds n LEU 230 Cb 0.61 0.00 1.00 0.00 -2.33 0.00 0.00 43.42 42.70 1xds n LEU 230 CO 0.43 0.18 1.11 0.00 -1.33 0.00 0.00 177.39 177.78 1xds h ALA 231 N 0.00 1.19 0.00 -1.18 0.00 -1.75 0.98 119.26 118.49 1xds h ALA 231 Ca 0.00 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1xds h ALA 231 Cb 0.11 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1xds h ALA 231 CO 0.00 0.03 -0.01 0.38 0.00 0.00 0.00 179.25 179.64 1xds h ASP 232 N 0.00 0.00 0.00 0.00 2.03 -1.93 -3.36 116.42 113.16 1xds h ASP 232 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1xds h ASP 232 Cb 0.12 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.62 1xds h ASP 232 CO 0.00 0.01 0.00 -2.11 -1.03 0.00 0.00 179.24 176.12 1xds n ARG 233 N -3.11 0.48 -3.82 4.15 1.85 -0.62 -5.04 116.66 110.55 1xds n ARG 233 Ca 0.01 -0.04 -0.29 0.00 -1.00 0.00 0.00 57.85 56.52 1xds n ARG 233 Cb 0.31 -0.35 -0.16 0.00 -1.05 0.00 0.00 32.46 31.22 1xds n ARG 233 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1xds s VAL 234 N -0.08 0.94 0.29 8.89 1.01 0.24 -1.03 120.40 130.66 1xds s VAL 234 Ca 0.00 -0.87 0.09 0.00 0.00 0.00 0.00 61.98 61.20 1xds s VAL 234 Cb 0.00 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 1xds s VAL 234 CO 0.00 -0.19 0.03 0.42 0.00 0.00 0.00 175.10 175.36 1xds s THR 235 N 1.66 3.26 -0.18 3.92 -4.23 -0.30 -4.34 115.64 115.43 1xds s THR 235 Ca -0.02 -1.87 -0.02 0.00 -1.18 0.00 0.00 61.69 58.60 1xds s THR 235 Cb -0.18 -2.87 -0.01 0.00 1.34 0.00 0.00 72.50 70.78 1xds s THR 235 CO -0.08 -0.31 -0.08 -0.69 -0.54 0.00 0.00 174.62 172.92 1xds s VAL 236 N -2.37 3.20 -0.75 2.29 1.01 -1.26 -1.29 120.40 121.22 1xds s VAL 236 Ca 0.33 -0.57 -0.00 0.00 0.00 0.00 0.00 61.98 61.74 1xds s VAL 236 Cb -0.05 -2.41 0.19 0.00 0.00 0.00 0.00 36.38 34.11 1xds s VAL 236 CO 0.21 0.47 0.59 0.00 0.00 0.00 0.00 175.10 176.36 1xds s ALA 237 N 1.04 3.91 0.32 5.51 0.00 0.22 -4.93 121.76 127.83 1xds s ALA 237 Ca -0.00 -3.65 -0.26 0.00 0.00 0.00 0.00 51.96 48.05 1xds s ALA 237 Cb -0.15 -2.59 -0.14 0.00 0.00 0.00 0.00 23.12 20.24 1xds s ALA 237 CO -0.01 -2.12 0.87 -1.91 0.00 0.00 0.00 175.76 172.59 1xds n GLU 238 N 2.62 1.04 -3.74 0.00 2.13 -1.26 -3.99 120.64 117.44 1xds n GLU 238 Ca 0.16 0.37 0.00 0.00 0.66 0.00 0.00 57.16 58.35 1xds n GLU 238 Cb 0.36 -1.70 0.00 0.00 0.27 0.00 0.00 31.44 30.37 1xds n GLU 238 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1xds n GLY 239 N 1.41 -1.05 2.81 8.31 0.00 -0.72 -4.89 105.19 111.06 1xds n GLY 239 Ca 0.11 -1.07 -0.27 0.00 0.00 0.00 0.00 46.02 44.79 1xds n GLY 239 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xds s ASP 240 N -4.00 2.62 0.00 1.61 -1.08 -1.26 -3.78 116.67 110.77 1xds s ASP 240 Ca 0.00 -0.61 0.18 0.00 -0.52 0.00 0.00 52.55 51.60 1xds s ASP 240 Cb 0.00 -0.70 0.97 0.00 -1.46 0.00 0.00 42.92 41.73 1xds s ASP 240 CO 0.00 -0.23 1.50 2.22 0.52 0.00 0.00 175.17 179.18 1xds n PHE 241 N 4.99 0.00 0.19 -5.34 1.16 -1.26 -0.71 117.46 116.50 1xds n PHE 241 Ca -0.10 0.00 0.08 0.00 -1.87 0.00 0.00 57.45 55.56 1xds n PHE 241 Cb 0.48 -0.16 0.18 0.00 -1.61 0.00 0.00 39.48 38.37 1xds n PHE 241 CO 0.00 0.00 0.00 0.74 -1.87 0.00 0.00 176.76 175.63 1xds h PHE 242 N 0.00 0.00 -3.65 2.97 -1.00 -1.95 -3.43 116.94 109.88 1xds h PHE 242 Ca 0.00 0.00 -0.49 0.00 2.81 0.00 0.00 57.97 60.29 1xds h PHE 242 Cb 0.09 0.00 0.03 0.00 3.61 0.00 0.00 35.95 39.69 1xds h PHE 242 CO 0.00 0.24 0.14 0.15 -1.61 0.00 0.00 178.31 177.23 1xds s LYS 243 N -3.19 3.56 0.47 1.51 -0.14 0.12 -5.00 119.74 117.06 1xds s LYS 243 Ca 0.05 0.27 -0.24 0.00 -1.36 0.00 0.00 55.97 54.68 1xds s LYS 243 Cb 0.07 -2.35 -0.08 0.00 -1.68 0.00 0.00 37.83 33.79 1xds s LYS 243 CO 0.69 -0.23 1.29 -2.30 -0.76 0.00 0.00 175.35 174.04 1xds n PRO 244 N -2.24 1.85 -2.48 -1.68 -0.02 -1.26 -4.89 135.00 124.28 1xds n PRO 244 Ca 0.01 0.67 -0.39 0.00 -2.02 0.00 0.00 63.50 61.76 1xds n PRO 244 Cb 0.55 -2.45 -0.04 0.00 -0.02 0.00 0.00 33.50 31.54 1xds n PRO 244 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1xds s LEU 245 N -2.27 4.45 0.47 2.45 1.43 -1.26 -4.94 118.68 119.01 1xds s LEU 245 Ca 0.65 2.23 0.25 0.00 -1.03 0.00 0.00 54.13 56.23 1xds s LEU 245 Cb -0.47 -3.75 1.15 0.00 0.03 0.00 0.00 46.19 43.15 1xds s LEU 245 CO 0.55 -0.24 1.93 1.55 0.23 0.00 0.00 176.35 180.37 1xds h PRO 246 N 3.50 0.00 -4.92 1.29 0.13 -1.95 -3.45 132.00 126.60 1xds h PRO 246 Ca -0.47 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.37 1xds h PRO 246 Cb 1.21 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.20 1xds h PRO 246 CO 0.66 0.19 -0.70 0.14 -0.23 0.00 0.00 178.00 178.05 1xds s VAL 247 N -3.89 0.99 0.49 1.56 -7.23 -1.26 -5.16 120.40 105.89 1xds s VAL 247 Ca -0.01 -2.02 0.03 0.00 -1.81 0.00 0.00 61.98 58.17 1xds s VAL 247 Cb 0.12 -1.81 0.02 0.00 0.56 0.00 0.00 36.38 35.26 1xds s VAL 247 CO 0.61 -0.77 0.69 0.42 -0.31 0.00 0.00 175.10 175.74 1xds s THR 248 N -3.44 3.10 -0.15 5.32 -4.23 -1.26 -4.77 115.64 110.21 1xds s THR 248 Ca 0.16 -0.73 -0.31 0.00 -1.18 0.00 0.00 61.69 59.63 1xds s THR 248 Cb 0.04 -3.12 0.13 0.00 1.34 0.00 0.00 72.50 70.89 1xds s THR 248 CO -0.01 -0.08 1.06 0.00 -0.54 0.00 0.00 174.62 175.06 1xds s ALA 249 N -2.59 -1.96 -0.86 3.99 0.00 -0.74 -4.96 121.76 114.64 1xds s ALA 249 Ca 0.54 1.50 0.25 0.00 0.00 0.00 0.00 51.96 54.25 1xds s ALA 249 Cb -0.10 -0.43 0.49 0.00 0.00 0.00 0.00 23.12 23.08 1xds s ALA 249 CO 0.37 -0.45 1.41 -0.40 0.00 0.00 0.00 175.76 176.69 1xds n ASP 250 N 0.31 0.54 -3.90 0.00 5.75 -1.06 -1.54 116.55 116.65 1xds n ASP 250 Ca -0.06 -0.06 -0.20 0.00 -0.01 0.00 0.00 54.79 54.46 1xds n ASP 250 Cb 0.59 0.17 -0.16 0.00 -1.03 0.00 0.00 41.12 40.69 1xds n ASP 250 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1xds s VAL 251 N -3.07 0.55 -0.03 2.12 1.01 -0.81 -0.90 120.40 119.28 1xds s VAL 251 Ca 0.09 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.00 1xds s VAL 251 Cb 0.16 -0.57 -0.02 0.00 0.00 0.00 0.00 36.38 35.95 1xds s VAL 251 CO 0.70 0.23 -0.22 -0.69 0.00 0.00 0.00 175.10 175.11 1xds s VAL 252 N 0.85 2.38 -0.17 2.92 1.01 -0.38 -0.94 120.40 126.07 1xds s VAL 252 Ca -0.12 -0.99 -0.01 0.00 0.00 0.00 0.00 61.98 60.86 1xds s VAL 252 Cb -0.14 -1.87 -0.01 0.00 0.00 0.00 0.00 36.38 34.36 1xds s VAL 252 CO 0.00 0.58 -0.12 -0.22 0.00 0.00 0.00 175.10 175.34 1xds s LEU 253 N -0.67 2.64 -0.44 3.92 2.96 0.28 -0.26 118.68 127.10 1xds s LEU 253 Ca 0.11 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.62 1xds s LEU 253 Cb -0.10 -1.62 0.12 0.00 0.50 0.00 0.00 46.19 45.08 1xds s LEU 253 CO -0.00 0.07 0.18 -0.76 -1.32 0.00 0.00 176.35 174.51 1xds s LEU 254 N 0.91 4.65 -0.34 -0.68 1.43 -0.05 -1.44 118.68 123.17 1xds s LEU 254 Ca -0.03 -2.55 -0.11 0.00 -1.03 0.00 0.00 54.13 50.41 1xds s LEU 254 Cb -0.15 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.41 1xds s LEU 254 CO -0.01 -0.33 0.19 -0.55 0.23 0.00 0.00 176.35 175.88 1xds s SER 255 N 0.47 5.70 -1.43 2.29 0.15 -1.26 -1.16 113.70 118.45 1xds s SER 255 Ca 0.14 -0.67 -0.04 0.00 0.70 0.00 0.00 55.95 56.08 1xds s SER 255 Cb -0.22 -2.03 0.00 0.00 -1.71 0.00 0.00 66.02 62.06 1xds s SER 255 CO -0.04 -0.27 0.29 0.49 1.20 0.00 0.00 173.24 174.91 1xds n PHE 256 N 5.01 -1.48 -0.05 3.44 3.01 0.65 -4.88 117.46 123.16 1xds n PHE 256 Ca -0.13 0.61 -0.09 0.00 1.01 0.00 0.00 57.45 58.85 1xds n PHE 256 Cb 0.48 -3.25 -0.04 0.00 -0.01 0.00 0.00 39.48 36.66 1xds n PHE 256 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1xds n VAL 257 N -4.52 0.56 -0.05 -4.37 0.31 -1.26 -4.77 118.33 104.22 1xds n VAL 257 Ca -0.29 -0.18 0.03 0.00 -0.01 0.00 0.00 64.34 63.89 1xds n VAL 257 Cb 0.68 -1.28 0.36 0.00 -0.91 0.00 0.00 33.84 32.69 1xds n VAL 257 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1xds h LEU 258 N -0.20 0.57 -2.10 7.52 3.38 -1.90 -1.77 115.31 120.80 1xds h LEU 258 Ca -0.24 -0.03 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1xds h LEU 258 Cb 1.28 -0.14 -0.00 0.00 0.09 0.00 0.00 40.66 41.88 1xds h LEU 258 CO -0.10 0.44 -0.04 0.17 0.09 0.00 0.00 178.44 179.00 1xds h LEU 259 N 0.66 0.00 -0.51 1.67 -0.00 -1.86 -2.10 115.31 113.17 1xds h LEU 259 Ca 0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.06 1xds h LEU 259 Cb -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.63 1xds h LEU 259 CO -0.03 0.04 0.00 0.59 -0.00 0.00 0.00 178.44 179.04 1xds n ASN 260 N -3.26 0.48 -4.35 0.17 5.03 -0.67 0.03 115.26 112.69 1xds n ASN 260 Ca -0.01 0.62 -0.19 0.00 0.87 0.00 0.00 54.58 55.86 1xds n ASN 260 Cb 0.21 -0.72 -0.10 0.00 -1.02 0.00 0.00 39.78 38.14 1xds n ASN 260 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 1xds s TRP 261 N -3.23 1.78 0.90 3.10 0.52 -0.79 -3.37 118.94 117.85 1xds s TRP 261 Ca 0.05 -0.53 -0.13 0.00 0.02 0.00 0.00 56.10 55.51 1xds s TRP 261 Cb 0.09 -0.83 0.13 0.00 -1.15 0.00 0.00 33.47 31.72 1xds s TRP 261 CO 0.36 0.39 1.16 -1.54 0.02 0.00 0.00 176.95 177.33 1xds s SER 262 N -3.23 3.64 0.12 2.95 1.04 -1.24 -3.19 113.70 113.80 1xds s SER 262 Ca 0.22 0.87 -0.24 0.00 0.48 0.00 0.00 55.95 57.27 1xds s SER 262 Cb -0.02 -1.38 -0.05 0.00 0.10 0.00 0.00 66.02 64.68 1xds s SER 262 CO 0.08 -2.46 1.65 0.44 0.98 0.00 0.00 173.24 173.93 1xds h ASP 263 N -1.43 -0.60 -0.78 7.02 3.32 -1.95 0.73 116.42 122.73 1xds h ASP 263 Ca -0.49 0.09 0.04 0.00 0.02 0.00 0.00 57.03 56.69 1xds h ASP 263 Cb 1.32 0.26 -0.05 0.00 0.22 0.00 0.00 39.33 41.08 1xds h ASP 263 CO 0.61 -0.26 0.48 -0.08 -1.72 0.00 0.00 179.24 178.27 1xds h GLU 264 N -0.30 0.90 -0.20 3.56 4.81 -1.99 0.85 114.58 122.20 1xds h GLU 264 Ca 0.07 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.08 1xds h GLU 264 Cb 0.40 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1xds h GLU 264 CO -0.21 0.59 -0.54 -0.44 -0.73 0.00 0.00 179.01 177.68 1xds h ASP 265 N 0.92 0.66 0.48 1.04 3.32 -1.81 -2.70 116.42 118.33 1xds h ASP 265 Ca 0.32 -0.35 -0.14 0.00 0.02 0.00 0.00 57.03 56.89 1xds h ASP 265 Cb 0.07 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.42 1xds h ASP 265 CO -0.14 1.07 -0.61 0.00 -1.72 0.00 0.00 179.24 177.85 1xds h ALA 266 N 0.94 0.92 -0.68 3.45 0.00 -0.61 -2.45 119.26 120.84 1xds h ALA 266 Ca 0.01 -0.55 -0.05 0.00 0.00 0.00 0.00 54.91 54.32 1xds h ALA 266 Cb 1.09 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1xds h ALA 266 CO 0.10 0.74 0.24 1.25 0.00 0.00 0.00 179.25 181.59 1xds h LEU 267 N 0.09 0.97 -0.28 0.00 5.85 -0.71 -1.60 115.31 119.63 1xds h LEU 267 Ca -0.01 -0.19 -0.15 0.00 0.84 0.00 0.00 57.88 58.37 1xds h LEU 267 Cb 1.09 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 1xds h LEU 267 CO 0.09 0.90 -0.72 0.71 -0.34 0.00 0.00 178.44 179.08 1xds h THR 268 N 0.98 1.35 -0.04 1.05 1.35 -1.31 -1.39 112.91 114.90 1xds h THR 268 Ca 0.22 -2.62 -0.00 0.00 -0.55 0.00 0.00 66.41 63.46 1xds h THR 268 Cb 0.26 2.48 -0.00 0.00 -1.73 0.00 0.00 68.15 69.16 1xds h THR 268 CO -0.01 0.71 0.01 0.40 -0.25 0.00 0.00 175.52 176.38 1xds h ILE 269 N 0.00 1.17 -0.19 6.82 2.04 -1.34 -1.91 117.51 124.10 1xds h ILE 269 Ca -0.01 -0.52 0.05 0.00 1.00 0.00 0.00 64.86 65.39 1xds h ILE 269 Cb 1.43 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 38.91 1xds h ILE 269 CO 0.09 0.14 -0.16 -0.07 0.00 0.00 0.00 178.15 178.15 1xds h LEU 270 N -0.14 -0.51 -1.36 1.44 3.38 -1.26 -0.51 115.31 116.34 1xds h LEU 270 Ca 0.01 0.10 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1xds h LEU 270 Cb 0.22 0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 1xds h LEU 270 CO -0.00 -0.20 0.45 0.03 0.09 0.00 0.00 178.44 178.81 1xds h ARG 271 N -0.17 0.80 -0.52 1.13 3.08 -1.22 0.75 114.38 118.23 1xds h ARG 271 Ca 0.12 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.03 1xds h ARG 271 Cb 0.34 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1xds h ARG 271 CO -0.29 0.53 -0.03 0.78 -1.07 0.00 0.00 179.97 179.89 1xds h GLY 272 N 0.83 0.98 1.01 0.04 0.00 -0.85 -2.77 103.07 102.31 1xds h GLY 272 Ca 0.27 -0.70 -0.04 0.00 0.00 0.00 0.00 47.33 46.86 1xds h GLY 272 CO -0.08 0.65 0.22 0.00 0.00 0.00 0.00 176.54 177.33 1xds h VAL 274 N 0.89 1.03 -0.74 0.00 2.07 -0.97 -2.56 116.25 115.97 1xds h VAL 274 Ca 0.21 -0.14 0.08 0.00 0.82 0.00 0.00 66.70 67.67 1xds h VAL 274 Cb 0.25 0.59 -0.07 0.00 -1.52 0.00 0.00 31.29 30.55 1xds h VAL 274 CO -0.01 0.07 0.40 -0.09 0.02 0.00 0.00 177.57 177.96 1xds h ARG 275 N 0.40 0.67 0.00 1.57 9.65 -1.36 -2.03 114.38 123.28 1xds h ARG 275 Ca 0.14 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 1xds h ARG 275 Cb 0.01 -0.15 0.00 0.00 -1.39 0.00 0.00 29.97 28.44 1xds h ARG 275 CO -0.07 0.44 0.00 0.00 2.80 0.00 0.00 179.97 183.14 1xds n ALA 276 N -2.38 1.98 -2.62 2.80 0.00 -0.99 -4.77 120.51 114.53 1xds n ALA 276 Ca 0.11 -0.08 -0.43 0.00 0.00 0.00 0.00 53.44 53.04 1xds n ALA 276 Cb 0.24 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.36 1xds n ALA 276 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1xds s LEU 277 N -2.71 3.90 0.85 0.00 2.96 -0.76 -1.80 118.68 121.11 1xds s LEU 277 Ca 0.15 0.75 -0.13 0.00 -0.22 0.00 0.00 54.13 54.69 1xds s LEU 277 Cb 0.13 -3.44 0.07 0.00 0.50 0.00 0.00 46.19 43.45 1xds s LEU 277 CO 0.31 -0.95 0.96 -0.62 -1.32 0.00 0.00 176.35 174.74 1xds n GLU 278 N 7.03 -0.04 -1.61 1.98 1.02 -0.59 -4.80 120.64 123.64 1xds n GLU 278 Ca 0.10 0.06 -0.46 0.00 -0.02 0.00 0.00 57.16 56.84 1xds n GLU 278 Cb 0.48 -2.24 -0.03 0.00 -0.02 0.00 0.00 31.44 29.63 1xds n GLU 278 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1xds n PRO 279 N -2.90 1.46 -1.24 3.49 -0.02 -1.26 0.20 135.00 134.74 1xds n PRO 279 Ca 0.12 0.52 -0.08 0.00 -2.02 0.00 0.00 63.50 62.03 1xds n PRO 279 Cb 0.51 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.95 1xds n PRO 279 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xds n GLY 280 N 1.71 0.82 3.78 -1.23 0.00 -1.26 -4.97 105.19 104.04 1xds n GLY 280 Ca 0.12 -0.06 -0.31 0.00 0.00 0.00 0.00 46.02 45.78 1xds n GLY 280 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xds s GLY 281 N -2.35 1.66 -0.05 -0.02 0.00 0.13 -5.02 107.32 101.67 1xds s GLY 281 Ca 0.00 0.15 0.04 0.00 0.00 0.00 0.00 44.72 44.91 1xds s GLY 281 CO 0.00 0.51 -0.16 0.50 0.00 0.00 0.00 173.10 173.94 1xds s ARG 282 N -4.96 1.79 -0.18 2.90 3.00 -0.08 -4.35 118.95 117.07 1xds s ARG 282 Ca 0.61 -0.58 -0.13 0.00 0.00 0.00 0.00 55.73 55.63 1xds s ARG 282 Cb -0.16 -1.53 -0.05 0.00 0.00 0.00 0.00 34.95 33.21 1xds s ARG 282 CO 0.56 0.20 0.27 -1.17 0.00 0.00 0.00 175.30 175.16 1xds s LEU 283 N 0.16 4.21 -0.31 2.53 2.96 -0.00 -1.25 118.68 126.98 1xds s LEU 283 Ca -0.06 0.43 -0.05 0.00 -0.22 0.00 0.00 54.13 54.22 1xds s LEU 283 Cb -0.12 -2.32 0.03 0.00 0.50 0.00 0.00 46.19 44.28 1xds s LEU 283 CO 0.03 0.08 0.06 -0.76 -1.32 0.00 0.00 176.35 174.44 1xds s LEU 284 N 0.64 4.00 -0.42 -0.68 1.43 0.64 -0.49 118.68 123.80 1xds s LEU 284 Ca 0.15 -1.05 -0.17 0.00 -1.03 0.00 0.00 54.13 52.03 1xds s LEU 284 Cb -0.13 -1.81 0.02 0.00 0.03 0.00 0.00 46.19 44.30 1xds s LEU 284 CO 0.04 -0.26 0.45 -0.69 0.23 0.00 0.00 176.35 176.11 1xds s VAL 285 N 1.38 5.07 -0.27 -1.59 1.01 -0.49 -0.87 120.40 124.64 1xds s VAL 285 Ca -0.01 -0.33 -0.17 0.00 0.00 0.00 0.00 61.98 61.46 1xds s VAL 285 Cb -0.19 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.11 1xds s VAL 285 CO 0.01 -0.44 0.48 -0.76 0.00 0.00 0.00 175.10 174.39 1xds s LEU 286 N 2.17 4.08 0.12 3.92 2.01 -0.31 -1.31 118.68 129.37 1xds s LEU 286 Ca 0.13 0.39 -0.26 0.00 0.01 0.00 0.00 54.13 54.40 1xds s LEU 286 Cb -0.17 -2.60 0.07 0.00 0.01 0.00 0.00 46.19 43.51 1xds s LEU 286 CO 0.14 -0.29 1.02 -0.62 1.01 0.00 0.00 176.35 177.61 1xds s ASP 287 N 1.60 -0.16 -0.14 2.29 -1.08 -0.94 -0.26 116.67 117.98 1xds s ASP 287 Ca 0.19 -0.35 -0.29 0.00 -0.52 0.00 0.00 52.55 51.58 1xds s ASP 287 Cb -0.16 0.43 -0.02 0.00 -1.46 0.00 0.00 42.92 41.71 1xds s ASP 287 CO 0.10 -0.79 1.25 -0.60 0.52 0.00 0.00 175.17 175.65 1xds s ARG 288 N -3.13 4.26 -0.43 4.34 6.06 -1.26 -1.05 118.95 127.73 1xds s ARG 288 Ca 0.13 1.66 0.05 0.00 -2.50 0.00 0.00 55.73 55.06 1xds s ARG 288 Cb -0.00 -3.72 0.17 0.00 0.06 0.00 0.00 34.95 31.46 1xds s ARG 288 CO 0.01 -0.65 0.44 0.00 -2.50 0.00 0.00 175.30 172.60 1xds s ALA 289 N 3.23 0.22 0.56 6.12 0.00 -1.26 -4.13 121.76 126.51 1xds s ALA 289 Ca 0.55 -1.71 -0.20 0.00 0.00 0.00 0.00 51.96 50.60 1xds s ALA 289 Cb -0.22 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 20.91 1xds s ALA 289 CO 0.16 -2.07 1.24 -0.51 0.00 0.00 0.00 175.76 174.59 1xds s ASP 290 N 0.48 5.33 0.06 0.00 1.01 -1.26 -3.93 116.67 118.37 1xds s ASP 290 Ca 0.30 2.49 0.06 0.00 0.71 0.00 0.00 52.55 56.11 1xds s ASP 290 Cb -0.01 -2.61 -0.03 0.00 1.01 0.00 0.00 42.92 41.29 1xds s ASP 290 CO -0.13 -1.50 -0.17 -0.69 0.21 0.00 0.00 175.17 172.88 1xds s VAL 291 N -1.50 1.40 0.00 -1.27 1.01 -1.26 -1.52 120.40 117.26 1xds s VAL 291 Ca 0.74 -1.21 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1xds s VAL 291 Cb -0.33 -1.26 0.00 0.00 0.00 0.00 0.00 36.38 34.79 1xds s VAL 291 CO 0.37 0.02 0.19 -0.62 0.00 0.00 0.00 175.10 175.06 1xds n GLU 292 N 1.64 0.00 -1.08 2.72 -0.58 -1.26 -1.11 120.64 120.97 1xds n GLU 292 Ca -0.18 0.19 -0.12 0.00 -0.42 0.00 0.00 57.16 56.62 1xds n GLU 292 Cb 0.54 -0.30 0.25 0.00 -0.57 0.00 0.00 31.44 31.36 1xds n GLU 292 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xds n GLY 293 N -0.85 4.07 0.26 0.62 0.00 -1.26 -4.71 105.19 103.32 1xds n GLY 293 Ca 0.00 -1.05 0.16 0.00 0.00 0.00 0.00 46.02 45.12 1xds n GLY 293 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xds n ASP 294 N -0.60 0.02 0.00 1.61 2.03 -0.27 -4.82 116.55 114.52 1xds n ASP 294 Ca 0.47 1.30 0.00 0.00 0.52 0.00 0.00 54.79 57.08 1xds n ASP 294 Cb 1.47 -0.52 0.00 0.00 -0.72 0.00 0.00 41.12 41.34 1xds n ASP 294 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1xds n GLY 295 N -1.33 0.98 3.75 0.27 0.00 -1.26 -5.03 105.19 102.57 1xds n GLY 295 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.83 1xds n GLY 295 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xds s ALA 296 N -3.92 3.33 -0.17 4.61 0.00 -1.26 -4.96 121.76 119.38 1xds s ALA 296 Ca 0.00 0.57 -0.29 0.00 0.00 0.00 0.00 51.96 52.24 1xds s ALA 296 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 1xds s ALA 296 CO 0.00 0.16 1.84 0.34 0.00 0.00 0.00 175.76 178.10 1xds s ASP 297 N -0.85 6.15 0.42 0.00 -1.08 -1.26 -4.86 116.67 115.19 1xds s ASP 297 Ca 0.42 1.90 0.29 0.00 -0.52 0.00 0.00 52.55 54.64 1xds s ASP 297 Cb -0.25 -2.53 1.17 0.00 -1.46 0.00 0.00 42.92 39.86 1xds s ASP 297 CO 0.30 -1.40 1.86 0.03 0.52 0.00 0.00 175.17 176.48 1xds h ARG 298 N 11.83 0.00 -0.12 4.34 2.47 -1.99 -2.83 114.38 128.07 1xds h ARG 298 Ca -0.39 0.00 0.03 0.00 -1.26 0.00 0.00 59.98 58.37 1xds h ARG 298 Cb 1.19 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.48 1xds h ARG 298 CO 0.98 0.00 -0.10 0.35 0.56 0.00 0.00 179.97 181.76 1xds h PHE 299 N 0.00 -0.24 0.00 3.04 3.57 -1.99 -0.39 116.94 120.92 1xds h PHE 299 Ca 0.00 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.46 1xds h PHE 299 Cb 0.47 0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.33 1xds h PHE 299 CO 0.00 -0.15 -0.29 0.74 -2.23 0.00 0.00 178.31 176.37 1xds h PHE 300 N -0.11 0.00 -0.14 0.41 -1.00 -1.89 0.11 116.94 114.32 1xds h PHE 300 Ca 0.08 0.00 -0.03 0.00 2.81 0.00 0.00 57.97 60.83 1xds h PHE 300 Cb 0.23 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.79 1xds h PHE 300 CO -0.22 0.29 -0.02 0.77 -1.61 0.00 0.00 178.31 177.52 1xds h SER 301 N 0.00 0.26 0.81 2.17 0.02 -1.39 -2.02 113.55 113.40 1xds h SER 301 Ca -0.00 -0.34 -0.13 0.00 -0.84 0.00 0.00 61.79 60.47 1xds h SER 301 Cb 0.79 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.24 1xds h SER 301 CO 0.04 0.54 -0.63 0.71 -1.14 0.00 0.00 176.83 176.35 1xds h THR 302 N -0.03 1.33 0.10 -2.27 1.35 -0.87 -1.57 112.91 110.95 1xds h THR 302 Ca 0.04 -2.25 -0.00 0.00 -0.55 0.00 0.00 66.41 63.64 1xds h THR 302 Cb 0.42 2.25 0.00 0.00 -1.73 0.00 0.00 68.15 69.10 1xds h THR 302 CO 0.01 0.62 -0.05 0.25 -0.25 0.00 0.00 175.52 176.10 1xds h LEU 303 N 0.00 -0.11 -1.05 3.87 5.85 -0.98 -0.50 115.31 122.38 1xds h LEU 303 Ca -0.01 -0.39 0.06 0.00 0.84 0.00 0.00 57.88 58.38 1xds h LEU 303 Cb 1.20 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 42.20 1xds h LEU 303 CO 0.08 0.36 0.63 0.25 -0.34 0.00 0.00 178.44 179.42 1xds h LEU 304 N -0.62 1.01 -0.72 2.25 5.85 -1.40 -0.68 115.31 121.00 1xds h LEU 304 Ca -0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1xds h LEU 304 Cb 0.50 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 1xds h LEU 304 CO 0.02 0.66 0.41 -0.78 -0.34 0.00 0.00 178.44 178.41 1xds h ASP 305 N 1.15 0.88 0.56 1.25 3.58 -1.02 -2.65 116.42 120.17 1xds h ASP 305 Ca 0.41 -0.08 -0.20 0.00 0.42 0.00 0.00 57.03 57.58 1xds h ASP 305 Cb 0.14 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 40.95 1xds h ASP 305 CO -0.15 0.71 -0.87 -0.07 -2.88 0.00 0.00 179.24 175.98 1xds h LEU 306 N 0.98 0.27 -1.12 2.28 3.38 -0.61 -1.94 115.31 118.55 1xds h LEU 306 Ca 0.25 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1xds h LEU 306 Cb 0.01 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1xds h LEU 306 CO -0.04 1.02 0.00 0.54 0.09 0.00 0.00 178.44 180.04 1xds n ARG 307 N -3.67 0.00 0.00 1.13 1.74 -0.31 -0.78 116.66 114.77 1xds n ARG 307 Ca -0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 1xds n ARG 307 Cb 0.80 -1.05 0.00 0.00 -1.02 0.00 0.00 32.46 31.19 1xds n ARG 307 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 1xds n LEU 309 N 0.55 0.00 0.01 0.55 7.94 -0.73 -0.09 117.00 125.23 1xds n LEU 309 Ca 0.00 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.72 1xds n LEU 309 Cb 0.00 0.00 -0.12 0.00 0.53 0.00 0.00 43.42 43.83 1xds n LEU 309 CO 0.00 0.00 0.21 0.74 -1.11 0.00 0.00 177.39 177.23 1xds h THR 310 N 0.00 1.48 0.00 1.96 2.02 -1.23 -2.14 112.91 115.00 1xds h THR 310 Ca 0.00 -2.21 0.00 0.00 0.77 0.00 0.00 66.41 64.97 1xds h THR 310 Cb 0.00 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.24 1xds h THR 310 CO 0.00 0.63 0.00 -0.26 0.37 0.00 0.00 175.52 176.26 1xds h PHE 311 N -0.26 0.00 0.00 3.16 0.05 -0.73 0.15 116.94 119.31 1xds h PHE 311 Ca -0.09 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.70 1xds h PHE 311 Cb 1.37 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.30 1xds h PHE 311 CO 0.17 0.00 -0.23 0.41 -0.18 0.00 0.00 178.31 178.48 1xds n GLY 313 N 0.25 4.48 2.26 -1.45 0.00 -0.80 -4.33 105.19 105.60 1xds n GLY 313 Ca 0.02 -1.09 -0.16 0.00 0.00 0.00 0.00 46.02 44.79 1xds n GLY 313 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xds n GLY 314 N -1.16 -0.48 3.47 -0.02 0.00 -1.22 -3.60 105.19 102.18 1xds n GLY 314 Ca 0.15 -1.82 -0.13 0.00 0.00 0.00 0.00 46.02 44.22 1xds n GLY 314 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1xds s ARG 315 N -4.39 0.65 0.21 1.61 1.70 0.10 -3.10 118.95 115.73 1xds s ARG 315 Ca 0.42 0.82 -0.30 0.00 -0.47 0.00 0.00 55.73 56.20 1xds s ARG 315 Cb -0.02 0.29 -0.09 0.00 -0.57 0.00 0.00 34.95 34.56 1xds s ARG 315 CO 0.29 -0.09 1.22 0.08 -1.08 0.00 0.00 175.30 175.72 1xds s VAL 316 N 0.47 3.41 0.09 4.99 1.01 -1.26 -4.24 120.40 124.87 1xds s VAL 316 Ca -0.01 1.22 0.09 0.00 0.00 0.00 0.00 61.98 63.27 1xds s VAL 316 Cb -0.04 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.53 1xds s VAL 316 CO -0.02 0.21 -0.23 -0.13 0.00 0.00 0.00 175.10 174.93 1xds s ARG 317 N -0.46 1.36 0.89 2.72 0.52 -1.26 -4.99 118.95 117.73 1xds s ARG 317 Ca 0.52 -1.14 -0.13 0.00 -0.52 0.00 0.00 55.73 54.47 1xds s ARG 317 Cb -0.34 -1.63 0.13 0.00 0.52 0.00 0.00 34.95 33.62 1xds s ARG 317 CO 0.39 0.40 1.17 0.95 0.02 0.00 0.00 175.30 178.22 1xds s THR 318 N -0.99 1.99 0.12 0.02 -4.23 -1.26 -3.98 115.64 107.31 1xds s THR 318 Ca 0.09 0.00 -0.29 0.00 -1.18 0.00 0.00 61.69 60.31 1xds s THR 318 Cb -0.10 -2.85 -0.07 0.00 1.34 0.00 0.00 72.50 70.83 1xds s THR 318 CO 0.04 0.00 1.59 -0.09 -0.54 0.00 0.00 174.62 175.62 1xds h ARG 319 N -1.38 -0.51 -0.83 3.99 1.12 -1.39 -1.55 114.38 113.83 1xds h ARG 319 Ca -0.48 0.03 0.06 0.00 -1.11 0.00 0.00 59.98 58.48 1xds h ARG 319 Cb 1.32 0.12 -0.05 0.00 -0.01 0.00 0.00 29.97 31.35 1xds h ARG 319 CO 0.61 -0.34 0.54 -0.44 -3.11 0.00 0.00 179.97 177.23 1xds h ASP 320 N -0.53 0.82 0.08 -3.80 3.32 -1.94 -0.74 116.42 113.64 1xds h ASP 320 Ca 0.06 0.00 -0.15 0.00 0.02 0.00 0.00 57.03 56.95 1xds h ASP 320 Cb 0.62 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1xds h ASP 320 CO -0.32 0.54 -0.54 -0.33 -1.72 0.00 0.00 179.24 176.87 1xds h GLU 321 N 0.94 0.49 -0.09 3.56 5.08 -1.84 -1.57 114.58 121.15 1xds h GLU 321 Ca 0.35 -0.31 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1xds h GLU 321 Cb 0.17 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 1xds h GLU 321 CO -0.12 0.91 -0.02 0.28 -1.00 0.00 0.00 179.01 179.06 1xds h VAL 322 N 0.38 1.29 -0.70 3.13 2.07 -0.69 -1.21 116.25 120.52 1xds h VAL 322 Ca 0.01 -0.94 0.12 0.00 0.82 0.00 0.00 66.70 66.71 1xds h VAL 322 Cb 1.07 1.74 -0.08 0.00 -1.52 0.00 0.00 31.29 32.50 1xds h VAL 322 CO 0.10 0.26 0.29 0.58 0.02 0.00 0.00 177.57 178.82 1xds h VAL 323 N -0.16 0.73 -0.37 2.57 2.07 -1.09 0.15 116.25 120.15 1xds h VAL 323 Ca 0.02 -0.16 -0.16 0.00 0.82 0.00 0.00 66.70 67.22 1xds h VAL 323 Cb 0.42 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 1xds h VAL 323 CO 0.01 0.09 -0.39 0.44 0.02 0.00 0.00 177.57 177.73 1xds h ASP 324 N 0.47 0.95 -0.43 0.57 5.19 -1.14 0.04 116.42 122.08 1xds h ASP 324 Ca 0.37 -0.44 -0.07 0.00 -0.62 0.00 0.00 57.03 56.27 1xds h ASP 324 Cb 0.50 -0.27 -0.02 0.00 0.18 0.00 0.00 39.33 39.72 1xds h ASP 324 CO -0.35 1.23 0.01 0.25 -3.12 0.00 0.00 179.24 177.26 1xds h LEU 325 N 0.73 0.79 -0.48 1.55 5.85 -0.66 -2.40 115.31 120.69 1xds h LEU 325 Ca 0.06 -0.19 -0.11 0.00 0.84 0.00 0.00 57.88 58.48 1xds h LEU 325 Cb 0.98 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 1xds h LEU 325 CO 0.09 0.84 -0.14 0.00 -0.34 0.00 0.00 178.44 178.89 1xds h ALA 326 N 1.25 0.66 -0.72 1.25 0.00 -0.41 -2.70 119.26 118.59 1xds h ALA 326 Ca 0.15 -0.36 0.11 0.00 0.00 0.00 0.00 54.91 54.81 1xds h ALA 326 Cb 0.44 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 17.99 1xds h ALA 326 CO 0.02 0.59 0.33 0.78 0.00 0.00 0.00 179.25 180.97 1xds h GLY 327 N 0.79 1.08 2.00 0.00 0.00 -0.85 -0.83 103.07 105.26 1xds h GLY 327 Ca 0.12 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 1xds h GLY 327 CO 0.05 0.01 -0.09 1.76 0.00 0.00 0.00 176.54 178.27 1xds h SER 328 N 0.54 0.00 -0.11 0.19 0.02 -1.12 -0.95 113.55 112.13 1xds h SER 328 Ca 0.37 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.32 1xds h SER 328 Cb 0.45 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1xds h SER 328 CO -0.31 0.09 0.00 0.00 -1.14 0.00 0.00 176.83 175.47 1xds n ALA 329 N -2.52 2.54 -1.48 3.77 0.00 -0.58 -4.95 120.51 117.29 1xds n ALA 329 Ca -0.03 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 52.92 1xds n ALA 329 Cb 0.17 -1.12 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1xds n ALA 329 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xds n GLY 330 N 1.15 0.98 3.11 0.00 0.00 -0.36 -4.80 105.19 105.26 1xds n GLY 330 Ca 0.17 -0.46 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 1xds n GLY 330 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xds s LEU 331 N -0.46 2.04 0.05 0.99 1.43 -0.42 -1.55 118.68 120.75 1xds s LEU 331 Ca 0.00 -0.27 0.09 0.00 -1.03 0.00 0.00 54.13 52.92 1xds s LEU 331 Cb 0.00 -0.73 -0.03 0.00 0.03 0.00 0.00 46.19 45.46 1xds s LEU 331 CO 0.00 0.17 -0.26 0.00 0.23 0.00 0.00 176.35 176.49 1xds s ALA 332 N -0.36 2.29 0.15 4.21 0.00 -0.72 -2.88 121.76 124.45 1xds s ALA 332 Ca 0.05 -1.27 -0.31 0.00 0.00 0.00 0.00 51.96 50.43 1xds s ALA 332 Cb -0.06 -0.50 -0.08 0.00 0.00 0.00 0.00 23.12 22.49 1xds s ALA 332 CO -0.00 0.54 1.37 -1.17 0.00 0.00 0.00 175.76 176.49 1xds s LEU 333 N -1.30 4.38 -0.13 0.00 2.96 -1.26 -1.93 118.68 121.40 1xds s LEU 333 Ca 0.12 2.37 0.03 0.00 -0.22 0.00 0.00 54.13 56.43 1xds s LEU 333 Cb -0.10 -3.60 -0.10 0.00 0.50 0.00 0.00 46.19 42.89 1xds s LEU 333 CO 0.03 -0.62 -0.09 0.00 -1.32 0.00 0.00 176.35 174.35 1xds n ALA 334 N 3.48 1.71 -3.29 5.97 0.00 -0.49 -4.93 120.51 122.97 1xds n ALA 334 Ca 0.10 -0.63 -0.10 0.00 0.00 0.00 0.00 53.44 52.81 1xds n ALA 334 Cb 0.42 0.14 -0.04 0.00 0.00 0.00 0.00 19.45 19.97 1xds n ALA 334 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1xds s SER 335 N -5.12 -0.27 -0.04 0.00 1.04 -1.19 -5.03 113.70 103.08 1xds s SER 335 Ca -0.16 -0.45 -0.02 0.00 0.48 0.00 0.00 55.95 55.80 1xds s SER 335 Cb 0.04 0.57 0.03 0.00 0.10 0.00 0.00 66.02 66.77 1xds s SER 335 CO 0.35 -1.04 0.10 -0.70 0.98 0.00 0.00 173.24 172.94 1xds s GLU 336 N -3.86 0.05 0.22 4.02 2.12 -1.26 -2.16 118.70 117.82 1xds s GLU 336 Ca 0.08 0.27 -0.04 0.00 0.36 0.00 0.00 54.97 55.64 1xds s GLU 336 Cb -0.01 -0.16 -0.03 0.00 0.26 0.00 0.00 34.13 34.19 1xds s GLU 336 CO -0.04 -0.14 0.24 -0.98 -0.54 0.00 0.00 175.26 173.80 1xds s ARG 337 N 0.93 1.34 0.12 4.30 1.70 -0.90 -5.02 118.95 121.42 1xds s ARG 337 Ca -0.07 -1.55 0.10 0.00 -0.47 0.00 0.00 55.73 53.73 1xds s ARG 337 Cb -0.10 0.33 -0.04 0.00 -0.57 0.00 0.00 34.95 34.57 1xds s ARG 337 CO -0.04 -0.48 -0.24 0.99 -1.08 0.00 0.00 175.30 174.45 1xds s THR 338 N -4.05 1.99 0.04 4.99 2.01 -1.26 -1.55 115.64 117.80 1xds s THR 338 Ca 0.34 -1.66 0.01 0.00 0.31 0.00 0.00 61.69 60.69 1xds s THR 338 Cb 0.05 -1.78 -0.00 0.00 0.01 0.00 0.00 72.50 70.77 1xds s THR 338 CO 0.12 0.01 0.02 -1.20 -0.69 0.00 0.00 174.62 172.88 1xds n SER 339 N 0.97 0.22 0.00 3.53 7.64 -0.71 -4.94 113.62 120.34 1xds n SER 339 Ca -0.19 -1.22 0.00 0.00 1.01 0.00 0.00 58.87 58.47 1xds n SER 339 Cb 0.53 0.15 0.00 0.00 -1.01 0.00 0.00 64.21 63.89 1xds n SER 339 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xds n GLY 340 N 0.52 3.94 3.64 0.23 0.00 -1.26 -2.35 105.19 109.91 1xds n GLY 340 Ca 0.00 -0.33 -0.06 0.00 0.00 0.00 0.00 46.02 45.64 1xds n GLY 340 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1xds s SER 341 N 1.46 -0.77 -1.18 1.61 0.15 -1.25 -4.78 113.70 108.94 1xds s SER 341 Ca 0.00 1.25 -0.04 0.00 0.70 0.00 0.00 55.95 57.86 1xds s SER 341 Cb 0.00 1.32 0.17 0.00 -1.71 0.00 0.00 66.02 65.80 1xds s SER 341 CO 0.00 -0.20 2.25 0.41 1.20 0.00 0.00 173.24 176.90 1xds n THR 342 N 4.00 5.34 0.01 6.45 -1.04 -1.26 -4.23 114.28 123.55 1xds n THR 342 Ca -0.19 -4.69 0.00 0.00 -2.04 0.00 0.00 64.05 57.13 1xds n THR 342 Cb 0.58 -1.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.21 1xds n THR 342 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1xds n THR 343 N 1.14 0.00 -4.45 12.58 -1.04 -1.26 -4.99 114.28 116.27 1xds n THR 343 Ca 0.57 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 62.36 1xds n THR 343 Cb 0.27 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.67 1xds n THR 343 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1xds s LEU 344 N -5.30 2.55 -1.26 -4.42 1.02 -1.26 -4.63 118.68 105.39 1xds s LEU 344 Ca 0.00 -1.16 -0.15 0.00 0.02 0.00 0.00 54.13 52.84 1xds s LEU 344 Cb 0.00 -0.76 0.13 0.00 0.02 0.00 0.00 46.19 45.58 1xds s LEU 344 CO 0.00 -0.26 1.61 -0.81 0.02 0.00 0.00 176.35 176.91 1xds n PRO 345 N -0.60 3.30 -3.45 1.29 -0.04 -1.26 -4.44 135.00 129.79 1xds n PRO 345 Ca -0.06 -3.57 -0.24 0.00 -0.04 0.00 0.00 63.50 59.60 1xds n PRO 345 Cb 0.63 -3.22 -0.11 0.00 -0.04 0.00 0.00 33.50 30.75 1xds n PRO 345 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1xds s PHE 346 N 2.60 0.11 0.03 0.54 5.36 -1.26 -4.90 117.98 120.46 1xds s PHE 346 Ca 0.47 -0.89 -0.29 0.00 -0.96 0.00 0.00 56.93 55.26 1xds s PHE 346 Cb 0.01 -0.70 -0.04 0.00 -0.34 0.00 0.00 43.02 41.95 1xds s PHE 346 CO 0.03 -0.88 0.94 -0.51 -1.46 0.00 0.00 175.22 173.34 1xds s ASP 347 N 1.76 7.36 0.37 6.13 1.01 -1.26 -3.79 116.67 128.25 1xds s ASP 347 Ca 0.13 1.64 0.04 0.00 0.71 0.00 0.00 52.55 55.07 1xds s ASP 347 Cb -0.17 -2.55 -0.05 0.00 1.01 0.00 0.00 42.92 41.16 1xds s ASP 347 CO -0.19 -0.17 0.08 0.72 0.21 0.00 0.00 175.17 175.81 1xds s PHE 348 N 0.64 1.91 0.22 4.23 -0.12 -0.99 -4.81 117.98 119.06 1xds s PHE 348 Ca 0.48 -1.06 0.09 0.00 -0.05 0.00 0.00 56.93 56.40 1xds s PHE 348 Cb -0.21 -1.29 -0.05 0.00 -0.63 0.00 0.00 43.02 40.84 1xds s PHE 348 CO 0.27 -0.06 -0.17 -1.12 -0.05 0.00 0.00 175.22 174.09 1xds s SER 349 N -3.57 2.92 -0.18 1.98 0.01 -0.22 -1.73 113.70 112.92 1xds s SER 349 Ca 0.29 -0.99 0.01 0.00 1.31 0.00 0.00 55.95 56.57 1xds s SER 349 Cb 0.06 -0.19 0.01 0.00 0.21 0.00 0.00 66.02 66.11 1xds s SER 349 CO 0.14 -0.07 -0.18 -0.63 0.41 0.00 0.00 173.24 172.91 1xds s ILE 350 N -2.61 2.26 -0.25 1.44 1.01 -0.59 -2.22 121.20 120.24 1xds s ILE 350 Ca 0.23 -0.88 0.02 0.00 0.00 0.00 0.00 60.65 60.02 1xds s ILE 350 Cb -0.03 -1.95 0.05 0.00 0.01 0.00 0.00 42.46 40.53 1xds s ILE 350 CO 0.09 0.53 -0.11 -0.76 0.00 0.00 0.00 174.94 174.69 1xds s LEU 351 N 1.22 3.26 -0.12 2.97 1.43 -0.43 -2.11 118.68 124.91 1xds s LEU 351 Ca 0.03 -1.22 -0.18 0.00 -1.03 0.00 0.00 54.13 51.73 1xds s LEU 351 Cb -0.14 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.48 1xds s LEU 351 CO -0.10 -0.16 0.48 -0.70 0.23 0.00 0.00 176.35 176.10 1xds s GLU 352 N 1.17 4.34 0.11 1.70 2.12 -0.92 -1.39 118.70 125.81 1xds s GLU 352 Ca -0.06 0.46 0.09 0.00 0.36 0.00 0.00 54.97 55.82 1xds s GLU 352 Cb -0.19 -3.44 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 1xds s GLU 352 CO -0.06 0.14 -0.23 -0.06 -0.54 0.00 0.00 175.26 174.51 1xds s PHE 353 N 0.67 2.00 0.25 5.30 0.40 0.36 -1.39 117.98 125.56 1xds s PHE 353 Ca 0.26 -0.40 0.11 0.00 -0.60 0.00 0.00 56.93 56.30 1xds s PHE 353 Cb -0.15 -1.10 -0.05 0.00 0.51 0.00 0.00 43.02 42.23 1xds s PHE 353 CO 0.10 0.25 -0.16 0.95 0.70 0.00 0.00 175.22 177.06 1xds s THR 354 N -1.09 2.72 0.55 0.64 -4.23 -0.81 -0.82 115.64 112.60 1xds s THR 354 Ca 0.09 -2.16 -0.20 0.00 -1.18 0.00 0.00 61.69 58.25 1xds s THR 354 Cb -0.10 -2.40 -0.05 0.00 1.34 0.00 0.00 72.50 71.29 1xds s THR 354 CO 0.05 -0.31 1.21 0.00 -0.54 0.00 0.00 174.62 175.03 1xds s ALA 355 N -2.22 2.68 -0.02 3.99 0.00 -1.26 -1.75 121.76 123.18 1xds s ALA 355 Ca 0.28 1.01 -0.20 0.00 0.00 0.00 0.00 51.96 53.04 1xds s ALA 355 Cb -0.06 -3.44 -0.32 0.00 0.00 0.00 0.00 23.12 19.29 1xds s ALA 355 CO 0.15 -1.03 0.93 -0.39 0.00 0.00 0.00 175.76 175.42 1xds h VAL 356 N 1.19 1.45 -0.01 0.00 -1.51 -1.64 -3.45 116.25 112.28 1xds h VAL 356 Ca -0.50 -2.57 0.00 0.00 -1.23 0.00 0.00 66.70 62.40 1xds h VAL 356 Cb 1.28 3.15 0.00 0.00 -2.13 0.00 0.00 31.29 33.59 1xds h VAL 356 CO 0.57 0.74 0.00 -0.24 -1.23 0.00 0.00 177.57 177.41