#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d7r h VAL 10 N 0.00 1.11 -0.23 -3.33 3.04 -2.02 -1.60 116.25 113.21 3d7r h VAL 10 Ca 0.00 -0.26 -0.01 0.00 -1.01 0.00 0.00 66.70 65.42 3d7r h VAL 10 Cb 0.00 0.27 -0.01 0.00 -2.01 0.00 0.00 31.29 29.54 3d7r h VAL 10 CO 0.00 0.14 0.10 0.58 -1.01 0.00 0.00 177.57 177.39 3d7r h VAL 11 N 0.77 1.15 -0.15 1.51 2.07 -1.99 -2.44 116.25 117.18 3d7r h VAL 11 Ca 0.24 -0.45 -0.15 0.00 0.82 0.00 0.00 66.70 67.16 3d7r h VAL 11 Cb 0.02 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 3d7r h VAL 11 CO -0.06 0.15 -0.55 0.78 0.02 0.00 0.00 177.57 177.91 3d7r h ASN 12 N 0.24 0.49 -0.82 0.57 2.35 -1.94 -1.54 115.58 114.92 3d7r h ASN 12 Ca 0.08 -0.26 -0.02 0.00 -0.55 0.00 0.00 56.30 55.55 3d7r h ASN 12 Cb 0.14 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.33 3d7r h ASN 12 CO -0.01 0.94 0.46 0.50 -1.65 0.00 0.00 177.43 177.67 3d7r h LYS 13 N 0.34 1.15 -0.27 0.81 3.64 -1.14 -3.04 116.57 118.06 3d7r h LYS 13 Ca 0.01 -0.13 -0.01 0.00 -1.27 0.00 0.00 60.65 59.24 3d7r h LYS 13 Cb 1.07 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.66 3d7r h LYS 13 CO 0.10 0.84 0.00 0.66 -2.27 0.00 0.00 179.45 178.78 3d7r n TYR 14 N -4.34 0.96 -1.68 1.91 4.01 -0.93 -5.05 117.16 112.03 3d7r n TYR 14 Ca 0.09 -0.92 -0.45 0.00 -0.16 0.00 0.00 57.90 56.45 3d7r n TYR 14 Cb 0.10 -0.33 -0.03 0.00 -0.31 0.00 0.00 39.34 38.76 3d7r n TYR 14 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 3d7r n LEU 15 N -0.56 3.31 -4.15 7.72 7.94 -0.59 -5.00 117.00 125.68 3d7r n LEU 15 Ca 0.22 1.10 -0.34 0.00 -1.11 0.00 0.00 56.01 55.89 3d7r n LEU 15 Cb 0.91 -1.46 -0.14 0.00 0.53 0.00 0.00 43.42 43.25 3d7r n LEU 15 CO 0.16 -0.25 -0.42 -0.76 -1.11 0.00 0.00 177.39 175.01 3d7r s LEU 16 N 0.60 3.41 0.34 -1.96 1.43 -1.26 -5.00 118.68 116.24 3d7r s LEU 16 Ca 0.74 -1.14 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 3d7r s LEU 16 Cb -0.64 -1.63 0.66 0.00 0.03 0.00 0.00 46.19 44.62 3d7r s LEU 16 CO 0.41 -0.18 1.96 0.45 0.23 0.00 0.00 176.35 179.22 3d7r h HIS 17 N 7.93 0.85 0.00 0.29 3.86 -1.98 -1.73 115.15 124.36 3d7r h HIS 17 Ca -0.26 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.97 3d7r h HIS 17 Cb 1.07 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 29.26 3d7r h HIS 17 CO 0.60 0.47 0.00 0.27 0.86 0.00 0.00 177.93 180.13 3d7r n ASN 18 N -4.47 0.00 -0.21 2.45 0.23 -1.26 -1.68 115.26 110.31 3d7r n ASN 18 Ca 0.11 -0.71 0.03 0.00 -0.53 0.00 0.00 54.58 53.47 3d7r n ASN 18 Cb 0.18 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 37.90 3d7r n ASN 18 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3d7r n ARG 19 N -0.89 -0.20 -2.45 -3.83 1.74 -0.66 -5.04 116.66 105.34 3d7r n ARG 19 Ca 0.11 -0.84 -0.41 0.00 -0.77 0.00 0.00 57.85 55.94 3d7r n ARG 19 Cb 0.05 -1.10 -0.04 0.00 -1.02 0.00 0.00 32.46 30.35 3d7r n ARG 19 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3d7r s SER 20 N -0.45 7.21 -0.27 0.55 0.15 -0.68 -5.06 113.70 115.14 3d7r s SER 20 Ca 0.06 2.22 -0.02 0.00 0.70 0.00 0.00 55.95 58.92 3d7r s SER 20 Cb 0.04 -2.62 0.03 0.00 -1.71 0.00 0.00 66.02 61.77 3d7r s SER 20 CO 0.07 -0.23 -0.03 0.27 1.20 0.00 0.00 173.24 174.51 3d7r s ILE 21 N -0.63 2.95 0.00 6.45 -4.36 -1.26 -5.09 121.20 119.26 3d7r s ILE 21 Ca 0.48 -1.15 0.00 0.00 -0.26 0.00 0.00 60.65 59.72 3d7r s ILE 21 Cb -0.32 -2.57 0.00 0.00 1.25 0.00 0.00 42.46 40.82 3d7r s ILE 21 CO 0.39 0.08 0.00 0.49 0.24 0.00 0.00 174.94 176.14 3d7r n PHE 23 N 4.66 0.00 0.07 1.37 3.72 -1.26 -4.07 117.46 121.94 3d7r n PHE 23 Ca -0.15 0.00 -0.11 0.00 -0.05 0.00 0.00 57.45 57.14 3d7r n PHE 23 Cb 0.46 0.00 -0.13 0.00 -0.94 0.00 0.00 39.48 38.87 3d7r n PHE 23 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 3d7r h LYS 24 N 0.00 0.11 0.00 -1.08 1.57 -2.00 -3.46 116.57 111.72 3d7r h LYS 24 Ca 0.00 -0.19 0.11 0.00 -1.87 0.00 0.00 60.65 58.69 3d7r h LYS 24 Cb 0.00 0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.36 3d7r h LYS 24 CO 0.00 1.06 0.41 0.27 -0.57 0.00 0.00 179.45 180.62 3d7r n ASN 25 N -3.41 -1.28 -0.03 0.86 0.23 -1.26 -5.04 115.26 105.34 3d7r n ASN 25 Ca -0.05 -1.68 0.01 0.00 -0.53 0.00 0.00 54.58 52.32 3d7r n ASN 25 Cb 0.98 2.08 0.32 0.00 -2.08 0.00 0.00 39.78 41.08 3d7r n ASN 25 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 3d7r h ASP 26 N 1.42 0.54 -0.52 0.53 3.32 -2.00 -2.66 116.42 117.06 3d7r h ASP 26 Ca -0.20 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 56.75 3d7r h ASP 26 Cb 0.87 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.26 3d7r h ASP 26 CO 0.27 0.53 0.20 1.56 -1.72 0.00 0.00 179.24 180.07 3d7r h GLN 27 N 0.58 0.78 -0.84 3.56 7.50 -1.99 0.27 115.11 124.96 3d7r h GLN 27 Ca 0.14 -0.15 -0.01 0.00 0.50 0.00 0.00 58.65 59.13 3d7r h GLN 27 Cb 0.20 -0.12 -0.04 0.00 0.05 0.00 0.00 27.48 27.56 3d7r h GLN 27 CO -0.01 0.69 0.50 -0.44 -1.50 0.00 0.00 178.83 178.07 3d7r h ASP 28 N 0.70 1.01 -0.13 1.46 3.32 -1.91 -1.72 116.42 119.14 3d7r h ASP 28 Ca 0.17 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 3d7r h ASP 28 Cb 0.21 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 3d7r h ASP 28 CO -0.01 0.78 0.04 0.58 -1.72 0.00 0.00 179.24 178.91 3d7r h VAL 29 N 1.16 1.17 -0.28 -1.35 2.07 -1.00 -1.39 116.25 116.63 3d7r h VAL 29 Ca 0.30 -0.53 0.02 0.00 0.82 0.00 0.00 66.70 67.32 3d7r h VAL 29 Cb -0.04 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 3d7r h VAL 29 CO -0.06 0.16 0.12 -0.33 0.02 0.00 0.00 177.57 177.48 3d7r h GLU 30 N 0.04 0.25 -0.90 1.57 5.08 -0.82 -0.76 114.58 119.03 3d7r h GLU 30 Ca 0.04 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.41 3d7r h GLU 30 Cb 0.21 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 3d7r h GLU 30 CO -0.00 0.17 0.59 0.00 -1.00 0.00 0.00 179.01 178.77 3d7r h ARG 31 N 0.26 1.14 0.21 2.33 3.08 -1.25 0.38 114.38 120.54 3d7r h ARG 31 Ca 0.12 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 3d7r h ARG 31 Cb 0.06 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.85 3d7r h ARG 31 CO -0.10 0.76 -0.11 0.35 -1.07 0.00 0.00 179.97 179.80 3d7r h PHE 32 N 1.18 -0.28 -0.62 3.04 3.57 -0.93 -1.25 116.94 121.65 3d7r h PHE 32 Ca 0.35 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.86 3d7r h PHE 32 Cb -0.06 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 38.73 3d7r h PHE 32 CO -0.01 -0.17 0.39 0.74 -2.23 0.00 0.00 178.31 177.02 3d7r h PHE 33 N -0.30 0.72 -0.07 0.41 0.04 -0.70 0.10 116.94 117.15 3d7r h PHE 33 Ca -0.03 0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.80 3d7r h PHE 33 Cb 0.23 -0.24 -0.05 0.00 2.20 0.00 0.00 35.95 38.10 3d7r h PHE 33 CO -0.07 0.42 -0.21 -0.92 -0.60 0.00 0.00 178.31 176.94 3d7r h TYR 34 N 0.77 -0.55 -0.37 -0.55 3.20 -0.87 -0.68 116.97 117.92 3d7r h TYR 34 Ca 0.24 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.16 3d7r h TYR 34 Cb -0.00 0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 3d7r h TYR 34 CO -0.05 -0.29 0.20 -0.22 -1.64 0.00 0.00 178.16 176.16 3d7r h LYS 35 N -0.29 0.39 -0.32 1.82 3.64 -0.85 -3.12 116.57 117.84 3d7r h LYS 35 Ca 0.08 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 3d7r h LYS 35 Cb 0.41 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 3d7r h LYS 35 CO -0.24 0.26 -0.30 0.00 -2.27 0.00 0.00 179.45 176.90 3d7r h ARG 36 N 0.41 0.69 -0.60 1.90 2.47 -0.58 -0.84 114.38 117.83 3d7r h ARG 36 Ca 0.15 -0.31 0.11 0.00 -1.26 0.00 0.00 59.98 58.68 3d7r h ARG 36 Cb 0.04 -0.02 -0.08 0.00 -1.65 0.00 0.00 29.97 28.26 3d7r h ARG 36 CO -0.09 0.90 0.15 1.49 0.56 0.00 0.00 179.97 182.98 3d7r h GLU 37 N 0.59 0.28 -0.06 0.04 4.81 -1.06 0.91 114.58 120.08 3d7r h GLU 37 Ca 0.07 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 3d7r h GLU 37 Cb 0.81 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.12 3d7r h GLU 37 CO 0.07 0.18 -0.12 0.82 -0.73 0.00 0.00 179.01 179.23 3d7r h ILE 38 N 0.29 1.42 -0.45 2.32 2.04 -1.46 -3.25 117.51 118.41 3d7r h ILE 38 Ca 0.31 -1.42 -0.11 0.00 1.00 0.00 0.00 64.86 64.64 3d7r h ILE 38 Cb 0.45 2.21 -0.02 0.00 -0.74 0.00 0.00 36.82 38.72 3d7r h ILE 38 CO -0.38 0.40 -0.14 -0.33 0.00 0.00 0.00 178.15 177.70 3d7r h GLU 39 N -0.30 0.85 0.00 2.37 4.39 -0.97 -3.10 114.58 117.82 3d7r h GLU 39 Ca 0.00 -0.31 -0.03 0.00 0.34 0.00 0.00 59.36 59.36 3d7r h GLU 39 Cb 0.70 -0.06 -0.00 0.00 -0.10 0.00 0.00 28.75 29.29 3d7r h GLU 39 CO 0.03 0.94 -0.15 -0.91 -1.16 0.00 0.00 179.01 177.75 3d7r h ASN 40 N 0.75 0.00 1.22 1.42 2.35 -0.89 -2.74 115.58 117.70 3d7r h ASN 40 Ca 0.12 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.83 3d7r h ASN 40 Cb 0.65 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.02 3d7r h ASN 40 CO 0.05 0.15 -0.21 0.03 -1.65 0.00 0.00 177.43 175.80 3d7r h ARG 41 N 0.00 0.00 -7.03 0.81 3.08 -1.57 -3.46 114.38 106.21 3d7r h ARG 41 Ca -0.00 0.00 -0.49 0.00 0.07 0.00 0.00 59.98 59.56 3d7r h ARG 41 Cb 0.53 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.62 3d7r h ARG 41 CO 0.02 0.21 0.42 0.15 -1.07 0.00 0.00 179.97 179.70 3d7r s LYS 42 N -3.45 3.79 0.18 0.04 1.02 -1.03 -4.96 119.74 115.33 3d7r s LYS 42 Ca 0.02 1.55 -0.32 0.00 0.02 0.00 0.00 55.97 57.24 3d7r s LYS 42 Cb 0.09 -2.26 -0.11 0.00 -0.52 0.00 0.00 37.83 35.03 3d7r s LYS 42 CO 0.65 -0.47 1.65 0.15 -0.92 0.00 0.00 175.35 176.41 3d7r s LYS 43 N -2.93 4.17 0.16 1.68 -0.14 -1.26 -4.95 119.74 116.47 3d7r s LYS 43 Ca 0.65 2.49 -0.30 0.00 -1.36 0.00 0.00 55.97 57.45 3d7r s LYS 43 Cb -0.22 -3.13 -0.07 0.00 -1.68 0.00 0.00 37.83 32.73 3d7r s LYS 43 CO 0.27 -0.68 1.08 -1.58 -0.76 0.00 0.00 175.35 173.67 3d7r s HIS 44 N 1.20 3.62 0.06 3.18 5.65 -1.26 -5.04 115.29 122.70 3d7r s HIS 44 Ca 0.73 1.62 0.07 0.00 0.25 0.00 0.00 55.06 57.73 3d7r s HIS 44 Cb -0.47 -3.24 -0.03 0.00 -1.18 0.00 0.00 32.58 27.66 3d7r s HIS 44 CO 0.32 -0.50 -0.19 0.15 -0.65 0.00 0.00 174.74 173.86 3d7r s LYS 45 N -0.25 1.20 0.56 2.88 1.02 -1.26 -5.13 119.74 118.76 3d7r s LYS 45 Ca 0.49 -0.98 -0.20 0.00 0.02 0.00 0.00 55.97 55.30 3d7r s LYS 45 Cb -0.28 -1.34 -0.05 0.00 -0.52 0.00 0.00 37.83 35.63 3d7r s LYS 45 CO 0.34 0.33 1.13 0.00 -0.92 0.00 0.00 175.35 176.22 3d7r n GLN 46 N 1.60 1.25 -1.72 1.68 10.64 -1.26 -4.90 117.38 124.66 3d7r n GLN 46 Ca -0.18 0.47 -0.43 0.00 -1.83 0.00 0.00 57.00 55.03 3d7r n GLN 46 Cb 0.54 -2.31 -0.02 0.00 -0.86 0.00 0.00 30.24 27.59 3d7r n GLN 46 CO 0.00 0.00 0.00 -2.30 -1.83 0.00 0.00 177.06 172.93 3d7r n PRO 47 N -0.90 2.44 0.29 2.61 -0.02 -1.26 -4.87 135.00 133.29 3d7r n PRO 47 Ca 0.12 0.87 0.15 0.00 -2.02 0.00 0.00 63.50 62.62 3d7r n PRO 47 Cb 0.45 -2.58 0.87 0.00 -0.02 0.00 0.00 33.50 32.21 3d7r n PRO 47 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3d7r h SER 48 N 4.17 0.00 -0.00 2.55 4.64 -2.04 -2.95 113.55 119.92 3d7r h SER 48 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 3d7r h SER 48 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3d7r h SER 48 CO 0.75 0.05 -0.75 0.35 -0.87 0.00 0.00 176.83 176.36 3d7r n THR 49 N -3.60 0.00 -2.85 2.95 -2.24 -1.26 -4.95 114.28 102.32 3d7r n THR 49 Ca -0.02 -0.13 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 3d7r n THR 49 Cb 0.16 1.05 -0.04 0.00 -2.10 0.00 0.00 70.33 69.40 3d7r n THR 49 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3d7r s LEU 50 N -2.71 4.16 -0.49 3.22 2.96 -1.12 -5.01 118.68 119.70 3d7r s LEU 50 Ca 0.09 1.21 -0.28 0.00 -0.22 0.00 0.00 54.13 54.93 3d7r s LEU 50 Cb 0.14 -3.29 0.03 0.00 0.50 0.00 0.00 46.19 43.57 3d7r s LEU 50 CO 0.68 -0.44 1.12 0.21 -1.32 0.00 0.00 176.35 176.60 3d7r s ASN 51 N 1.18 6.58 -0.26 3.68 2.47 -1.26 -4.90 114.94 122.43 3d7r s ASN 51 Ca 0.39 0.36 -0.22 0.00 0.42 0.00 0.00 52.86 53.81 3d7r s ASN 51 Cb -0.16 -2.54 -0.01 0.00 -1.45 0.00 0.00 41.25 37.09 3d7r s ASN 51 CO 0.12 -1.27 0.70 -0.69 -3.72 0.00 0.00 177.10 172.24 3d7r s VAL 52 N 4.45 4.92 0.07 -5.21 1.01 -1.26 -4.95 120.40 119.43 3d7r s VAL 52 Ca 0.46 1.26 -0.03 0.00 0.00 0.00 0.00 61.98 63.68 3d7r s VAL 52 Cb -0.07 -4.01 -0.27 0.00 0.00 0.00 0.00 36.38 32.02 3d7r s VAL 52 CO 0.30 -0.03 1.11 0.11 0.00 0.00 0.00 175.10 176.60 3d7r h LYS 53 N 7.85 0.24 -7.28 2.72 1.57 -1.95 -3.45 116.57 116.27 3d7r h LYS 53 Ca -0.25 -0.40 -0.51 0.00 -1.87 0.00 0.00 60.65 57.61 3d7r h LYS 53 Cb 1.11 0.15 0.12 0.00 0.08 0.00 0.00 32.23 33.69 3d7r h LYS 53 CO 0.81 1.17 0.34 0.00 -0.57 0.00 0.00 179.45 181.20 3d7r s ALA 54 N -2.66 2.35 0.26 3.86 0.00 -1.26 -5.00 121.76 119.32 3d7r s ALA 54 Ca -0.04 0.33 -0.29 0.00 0.00 0.00 0.00 51.96 51.96 3d7r s ALA 54 Cb 0.07 -3.28 -0.09 0.00 0.00 0.00 0.00 23.12 19.82 3d7r s ALA 54 CO 0.87 -1.57 1.15 -0.80 0.00 0.00 0.00 175.76 175.41 3d7r s ASN 55 N -3.19 7.16 -0.12 0.00 -0.87 0.14 -4.86 114.94 113.21 3d7r s ASN 55 Ca 0.63 2.31 0.01 0.00 -1.57 0.00 0.00 52.86 54.24 3d7r s ASN 55 Cb -0.18 -2.62 -0.01 0.00 -0.02 0.00 0.00 41.25 38.41 3d7r s ASN 55 CO 0.52 -0.25 -0.16 -0.22 -2.57 0.00 0.00 177.10 174.42 3d7r s LEU 56 N -1.20 2.57 -0.19 0.60 2.96 -1.26 -0.98 118.68 121.18 3d7r s LEU 56 Ca 0.47 -0.37 -0.04 0.00 -0.22 0.00 0.00 54.13 53.97 3d7r s LEU 56 Cb -0.33 -1.56 -0.02 0.00 0.50 0.00 0.00 46.19 44.78 3d7r s LEU 56 CO 0.42 0.18 -0.04 -1.61 -1.32 0.00 0.00 176.35 173.98 3d7r s GLU 57 N 0.25 3.51 -0.62 1.98 2.02 0.13 -4.96 118.70 121.00 3d7r s GLU 57 Ca -0.11 -0.58 -0.10 0.00 0.02 0.00 0.00 54.97 54.21 3d7r s GLU 57 Cb -0.16 -2.97 0.16 0.00 0.10 0.00 0.00 34.13 31.26 3d7r s GLU 57 CO 0.06 -0.00 0.51 0.15 0.02 0.00 0.00 175.26 176.00 3d7r s LYS 58 N 0.99 2.88 0.50 1.61 1.02 -1.26 -0.88 119.74 124.59 3d7r s LYS 58 Ca 0.00 -2.17 0.05 0.00 0.02 0.00 0.00 55.97 53.88 3d7r s LYS 58 Cb -0.15 -4.06 0.01 0.00 -0.52 0.00 0.00 37.83 33.11 3d7r s LYS 58 CO 0.01 -1.23 0.29 -0.51 -0.92 0.00 0.00 175.35 172.99 3d7r s LEU 59 N 0.66 2.78 0.04 3.17 1.43 0.71 -4.98 118.68 122.48 3d7r s LEU 59 Ca 0.12 -1.24 -0.00 0.00 -1.03 0.00 0.00 54.13 51.98 3d7r s LEU 59 Cb -0.20 -1.23 -0.03 0.00 0.03 0.00 0.00 46.19 44.75 3d7r s LEU 59 CO -0.04 -0.91 -0.04 -0.94 0.23 0.00 0.00 176.35 174.66 3d7r s SER 60 N -4.12 0.48 -0.19 2.29 1.04 -1.26 -0.67 113.70 111.27 3d7r s SER 60 Ca 0.32 -0.77 -0.04 0.00 0.48 0.00 0.00 55.95 55.94 3d7r s SER 60 Cb -0.00 0.14 0.06 0.00 0.10 0.00 0.00 66.02 66.32 3d7r s SER 60 CO 0.19 -0.44 0.06 -0.22 0.98 0.00 0.00 173.24 173.81 3d7r s LEU 61 N -2.25 0.87 -1.37 2.42 2.96 -1.26 -4.84 118.68 115.20 3d7r s LEU 61 Ca -0.03 -0.77 -0.03 0.00 -0.22 0.00 0.00 54.13 53.08 3d7r s LEU 61 Cb -0.01 -0.46 0.02 0.00 0.50 0.00 0.00 46.19 46.24 3d7r s LEU 61 CO -0.05 -0.33 0.74 0.47 -1.32 0.00 0.00 176.35 175.86 3d7r n ASP 62 N 5.14 -1.87 -2.02 3.68 8.00 -1.26 -4.77 116.55 123.44 3d7r n ASP 62 Ca -0.08 -0.83 -0.01 0.00 0.71 0.00 0.00 54.79 54.58 3d7r n ASP 62 Cb 0.48 -3.93 0.00 0.00 -0.02 0.00 0.00 41.12 37.65 3d7r n ASP 62 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3d7r n ASP 63 N -3.00 -4.06 -4.16 -2.24 10.43 -1.26 -5.21 116.55 107.06 3d7r n ASP 63 Ca -0.23 0.04 -0.29 0.00 2.57 0.00 0.00 54.79 56.88 3d7r n ASP 63 Cb 0.65 -2.52 -0.17 0.00 1.84 0.00 0.00 41.12 40.91 3d7r n ASP 63 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 3d7r s GLN 65 N -2.56 2.50 -0.12 -1.24 -0.21 -1.26 -5.06 119.66 111.71 3d7r s GLN 65 Ca 0.03 -0.72 -0.00 0.00 0.02 0.00 0.00 55.36 54.69 3d7r s GLN 65 Cb -0.01 -1.96 0.02 0.00 1.00 0.00 0.00 33.01 32.07 3d7r s GLN 65 CO 0.27 0.15 -0.08 0.08 -2.12 0.00 0.00 175.29 173.59 3d7r s VAL 66 N 0.38 1.06 -0.03 1.09 1.01 0.16 -0.83 120.40 123.24 3d7r s VAL 66 Ca -0.15 -0.31 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 3d7r s VAL 66 Cb -0.17 -1.07 -0.05 0.00 0.00 0.00 0.00 36.38 35.09 3d7r s VAL 66 CO 0.07 0.37 0.29 -0.36 0.00 0.00 0.00 175.10 175.47 3d7r s PHE 67 N 1.69 3.65 -0.05 5.22 0.08 -0.40 -0.21 117.98 127.96 3d7r s PHE 67 Ca 0.05 0.75 0.05 0.00 0.12 0.00 0.00 56.93 57.90 3d7r s PHE 67 Cb -0.13 -2.11 -0.01 0.00 -0.57 0.00 0.00 43.02 40.21 3d7r s PHE 67 CO -0.08 0.66 -0.21 1.03 -0.10 0.00 0.00 175.22 176.52 3d7r s ARG 68 N -1.24 2.11 -0.11 0.44 0.52 -0.06 -0.17 118.95 120.43 3d7r s ARG 68 Ca 0.22 -0.75 -0.01 0.00 -0.52 0.00 0.00 55.73 54.68 3d7r s ARG 68 Cb -0.14 -1.82 -0.02 0.00 0.52 0.00 0.00 34.95 33.48 3d7r s ARG 68 CO 0.11 0.32 -0.09 -0.06 0.02 0.00 0.00 175.30 175.60 3d7r s PHE 69 N -0.09 2.90 0.06 -0.53 0.08 0.19 0.17 117.98 120.76 3d7r s PHE 69 Ca -0.03 -0.32 -0.06 0.00 0.12 0.00 0.00 56.93 56.64 3d7r s PHE 69 Cb -0.12 -1.82 -0.01 0.00 -0.57 0.00 0.00 43.02 40.49 3d7r s PHE 69 CO 0.03 0.02 0.11 0.54 -0.10 0.00 0.00 175.22 175.81 3d7r s ASN 70 N -0.04 0.22 -0.02 1.36 2.20 -0.15 -0.80 114.94 117.71 3d7r s ASN 70 Ca -0.01 -0.68 0.03 0.00 -0.94 0.00 0.00 52.86 51.25 3d7r s ASN 70 Cb -0.14 0.27 -0.00 0.00 -2.00 0.00 0.00 41.25 39.38 3d7r s ASN 70 CO 0.03 -0.62 -0.09 0.12 -2.94 0.00 0.00 177.10 173.60 3d7r s PHE 71 N -3.41 0.89 -1.40 1.54 5.36 -1.26 0.26 117.98 119.95 3d7r s PHE 71 Ca 0.02 -0.20 -0.10 0.00 -0.96 0.00 0.00 56.93 55.69 3d7r s PHE 71 Cb 0.03 -0.61 0.07 0.00 -0.34 0.00 0.00 43.02 42.18 3d7r s PHE 71 CO -0.08 -0.06 0.62 0.54 -1.46 0.00 0.00 175.22 174.78 3d7r n ARG 72 N 3.08 -3.97 -1.79 10.12 1.74 -1.26 -1.36 116.66 123.22 3d7r n ARG 72 Ca -0.16 0.55 -0.19 0.00 -0.77 0.00 0.00 57.85 57.28 3d7r n ARG 72 Cb 0.55 -5.32 -0.06 0.00 -1.02 0.00 0.00 32.46 26.62 3d7r n ARG 72 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 3d7r n HIS 73 N -4.18 -0.26 -2.97 -1.55 8.25 -1.26 -4.95 115.22 108.29 3d7r n HIS 73 Ca -0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 3d7r n HIS 73 Cb 0.55 -3.38 -0.05 0.00 1.12 0.00 0.00 29.99 28.23 3d7r n HIS 73 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3d7r s GLN 74 N -4.01 3.24 0.00 -0.41 -1.52 -0.46 -4.79 119.66 111.71 3d7r s GLN 74 Ca 0.00 -0.53 0.00 0.00 -1.95 0.00 0.00 55.36 52.88 3d7r s GLN 74 Cb 0.00 -4.07 0.00 0.00 -0.22 0.00 0.00 33.01 28.72 3d7r s GLN 74 CO 0.00 -1.38 0.11 0.44 -0.25 0.00 0.00 175.29 174.21 3d7r n ILE 75 N 5.95 0.00 0.31 1.08 -5.35 -1.26 -3.59 119.36 116.50 3d7r n ILE 75 Ca -0.02 -0.11 0.14 0.00 -0.27 0.00 0.00 62.75 62.50 3d7r n ILE 75 Cb 0.47 1.78 0.64 0.00 -1.74 0.00 0.00 39.64 40.79 3d7r n ILE 75 CO 0.00 0.00 0.00 -2.24 -1.76 0.00 0.00 176.55 172.55 3d7r h ASP 76 N 0.00 0.00 -4.25 7.28 2.03 -1.90 -3.43 116.42 116.15 3d7r h ASP 76 Ca 0.00 0.00 -0.48 0.00 -0.73 0.00 0.00 57.03 55.82 3d7r h ASP 76 Cb 0.39 0.00 -0.27 0.00 -0.83 0.00 0.00 39.33 38.61 3d7r h ASP 76 CO 0.00 0.00 -0.81 -0.54 -1.03 0.00 0.00 179.24 176.86 3d7r s LYS 77 N -3.54 1.09 0.06 4.15 1.02 -1.26 -4.91 119.74 116.34 3d7r s LYS 77 Ca 0.01 -0.61 0.09 0.00 0.02 0.00 0.00 55.97 55.48 3d7r s LYS 77 Cb 0.09 -1.08 -0.03 0.00 -0.52 0.00 0.00 37.83 36.29 3d7r s LYS 77 CO 0.39 0.29 -0.25 0.15 -0.92 0.00 0.00 175.35 175.01 3d7r s LYS 78 N -0.64 1.62 -0.26 1.68 -0.14 0.06 -0.77 119.74 121.30 3d7r s LYS 78 Ca 0.04 -1.10 -0.04 0.00 -1.36 0.00 0.00 55.97 53.52 3d7r s LYS 78 Cb -0.06 -1.83 0.01 0.00 -1.68 0.00 0.00 37.83 34.27 3d7r s LYS 78 CO 0.00 0.47 -0.01 0.42 -0.76 0.00 0.00 175.35 175.47 3d7r s ILE 79 N -0.85 3.36 -0.50 2.17 1.01 0.10 -0.63 121.20 125.87 3d7r s ILE 79 Ca 0.11 -0.81 -0.28 0.00 0.00 0.00 0.00 60.65 59.66 3d7r s ILE 79 Cb -0.10 -2.69 0.03 0.00 0.01 0.00 0.00 42.46 39.71 3d7r s ILE 79 CO 0.03 0.19 1.12 -0.22 0.00 0.00 0.00 174.94 176.06 3d7r s LEU 80 N 1.42 3.65 -0.27 2.97 2.96 0.36 -0.09 118.68 129.68 3d7r s LEU 80 Ca 0.02 0.32 -0.10 0.00 -0.22 0.00 0.00 54.13 54.15 3d7r s LEU 80 Cb -0.16 -3.40 -0.04 0.00 0.50 0.00 0.00 46.19 43.08 3d7r s LEU 80 CO -0.02 -1.28 0.16 -0.47 -1.32 0.00 0.00 176.35 173.42 3d7r s TYR 81 N 4.47 3.19 -0.43 5.38 5.04 0.56 -4.50 117.35 131.06 3d7r s TYR 81 Ca 0.45 -0.01 -0.11 0.00 -2.44 0.00 0.00 57.07 54.96 3d7r s TYR 81 Cb -0.08 -2.34 0.07 0.00 0.35 0.00 0.00 41.96 39.97 3d7r s TYR 81 CO 0.29 -0.20 0.29 0.42 -1.34 0.00 0.00 175.55 175.02 3d7r s ILE 82 N 1.68 4.56 0.46 3.14 -1.09 -1.26 -4.25 121.20 124.43 3d7r s ILE 82 Ca 0.07 -1.25 -0.21 0.00 -2.23 0.00 0.00 60.65 57.03 3d7r s ILE 82 Cb -0.16 -3.75 -0.09 0.00 -1.58 0.00 0.00 42.46 36.89 3d7r s ILE 82 CO 0.09 -0.50 1.03 -1.38 -1.23 0.00 0.00 174.94 172.94 3d7r s HIS 83 N 1.50 3.11 1.00 3.97 -3.43 -1.26 -2.70 115.29 117.47 3d7r s HIS 83 Ca 0.03 1.60 -0.14 0.00 -0.80 0.00 0.00 55.06 55.75 3d7r s HIS 83 Cb -0.23 -3.05 0.19 0.00 -1.43 0.00 0.00 32.58 28.06 3d7r s HIS 83 CO 0.04 -0.68 1.15 0.20 -2.00 0.00 0.00 174.74 173.45 3d7r s GLY 84 N -1.91 1.61 0.00 -1.38 0.00 -1.04 -3.94 107.32 100.65 3d7r s GLY 84 Ca 0.64 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.66 3d7r s GLY 84 CO 0.21 -0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.88 3d7r n GLY 85 N -2.00 -0.14 2.49 0.20 0.00 -1.26 -4.71 105.19 99.76 3d7r n GLY 85 Ca 0.09 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 3d7r n GLY 85 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3d7r n PHE 86 N 0.00 0.00 -1.60 1.61 3.72 -1.26 -0.65 117.46 119.28 3d7r n PHE 86 Ca 0.00 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.25 3d7r n PHE 86 Cb 0.00 -2.86 -0.05 0.00 -0.94 0.00 0.00 39.48 35.63 3d7r n PHE 86 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3d7r n ASN 87 N -0.68 -4.70 0.00 4.37 3.02 -1.26 -4.80 115.26 111.20 3d7r n ASN 87 Ca -0.16 0.29 0.00 0.00 -0.03 0.00 0.00 54.58 54.67 3d7r n ASN 87 Cb 0.54 -3.57 0.00 0.00 -0.61 0.00 0.00 39.78 36.15 3d7r n ASN 87 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3d7r n ALA 88 N 0.67 1.71 -2.61 5.41 0.00 -0.82 0.40 120.51 125.28 3d7r n ALA 88 Ca -0.15 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 52.96 3d7r n ALA 88 Cb 0.51 0.17 -0.05 0.00 0.00 0.00 0.00 19.45 20.08 3d7r n ALA 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3d7r s LEU 89 N -3.11 4.29 0.83 0.00 1.43 0.18 -4.83 118.68 117.47 3d7r s LEU 89 Ca 0.00 0.71 -0.10 0.00 -1.03 0.00 0.00 54.13 53.71 3d7r s LEU 89 Cb 0.00 -3.19 0.14 0.00 0.03 0.00 0.00 46.19 43.16 3d7r s LEU 89 CO 0.00 0.09 1.16 -1.10 0.23 0.00 0.00 176.35 176.73 3d7r s GLN 90 N -2.33 1.38 0.38 1.70 -1.52 -1.26 -4.66 119.66 113.35 3d7r s GLN 90 Ca 0.38 -0.50 -0.28 0.00 -1.95 0.00 0.00 55.36 53.01 3d7r s GLN 90 Cb -0.13 -2.05 -0.11 0.00 -0.22 0.00 0.00 33.01 30.50 3d7r s GLN 90 CO 0.21 -1.82 1.44 -2.30 -0.25 0.00 0.00 175.29 172.57 3d7r n PRO 91 N -3.30 2.53 -1.94 2.91 -0.02 -1.26 -4.90 135.00 129.02 3d7r n PRO 91 Ca 0.13 0.89 -0.33 0.00 -2.02 0.00 0.00 63.50 62.16 3d7r n PRO 91 Cb 0.60 -2.60 0.03 0.00 -0.02 0.00 0.00 33.50 31.51 3d7r n PRO 91 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3d7r s SER 92 N -0.20 5.43 0.56 2.55 0.15 -1.26 -4.93 113.70 116.01 3d7r s SER 92 Ca 0.54 1.98 0.25 0.00 0.70 0.00 0.00 55.95 59.42 3d7r s SER 92 Cb -0.49 -2.55 1.59 0.00 -1.71 0.00 0.00 66.02 62.85 3d7r s SER 92 CO 0.63 -1.41 2.18 1.55 1.20 0.00 0.00 173.24 177.39 3d7r h PRO 93 N 0.38 0.00 0.00 5.44 0.13 -1.98 -0.66 132.00 135.31 3d7r h PRO 93 Ca -0.47 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.58 3d7r h PRO 93 Cb 1.24 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 3d7r h PRO 93 CO 0.56 0.00 -0.37 0.74 -0.23 0.00 0.00 178.00 178.70 3d7r h PHE 94 N 0.00 0.00 -0.39 1.56 -1.00 -1.92 -2.46 116.94 112.73 3d7r h PHE 94 Ca 0.03 0.00 -0.09 0.00 2.81 0.00 0.00 57.97 60.73 3d7r h PHE 94 Cb 0.16 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 3d7r h PHE 94 CO 0.00 0.37 -0.09 0.45 -1.61 0.00 0.00 178.31 177.43 3d7r h HIS 95 N 0.00 0.84 -0.60 -0.55 3.86 -1.45 -0.75 115.15 116.50 3d7r h HIS 95 Ca -0.00 -0.18 0.07 0.00 -1.16 0.00 0.00 60.37 59.09 3d7r h HIS 95 Cb 0.91 -0.21 -0.06 0.00 1.06 0.00 0.00 27.41 29.12 3d7r h HIS 95 CO 0.00 0.88 0.29 -1.49 0.86 0.00 0.00 177.93 178.47 3d7r h TRP 96 N 0.56 0.53 -0.37 2.45 4.06 -1.20 -1.10 115.95 120.88 3d7r h TRP 96 Ca 0.10 0.03 -0.10 0.00 2.06 0.00 0.00 58.89 60.97 3d7r h TRP 96 Cb 0.61 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.61 3d7r h TRP 96 CO 0.05 0.22 -0.16 -0.09 -3.56 0.00 0.00 178.44 174.90 3d7r h ARG 97 N 0.54 0.76 -0.28 0.49 2.43 -1.35 -1.76 114.38 115.21 3d7r h ARG 97 Ca 0.28 -0.33 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 3d7r h ARG 97 Cb 0.24 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 3d7r h ARG 97 CO -0.22 0.94 0.18 1.25 -1.51 0.00 0.00 179.97 180.61 3d7r h LEU 98 N 0.55 0.31 -0.72 3.80 5.85 -0.86 -2.07 115.31 122.16 3d7r h LEU 98 Ca 0.08 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 3d7r h LEU 98 Cb 0.70 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.63 3d7r h LEU 98 CO 0.05 0.22 0.32 -0.07 -0.34 0.00 0.00 178.44 178.62 3d7r h LEU 99 N 0.37 0.97 -0.15 2.25 4.07 -1.10 -0.73 115.31 120.99 3d7r h LEU 99 Ca 0.10 -0.15 0.04 0.00 0.08 0.00 0.00 57.88 57.95 3d7r h LEU 99 Cb -0.04 -0.25 -0.05 0.00 1.08 0.00 0.00 40.66 41.40 3d7r h LEU 99 CO -0.03 0.86 -0.14 -0.78 -1.08 0.00 0.00 178.44 177.27 3d7r h ASP 100 N 1.02 -0.44 -0.62 -0.43 3.58 -1.18 -0.23 116.42 118.12 3d7r h ASP 100 Ca 0.24 0.09 0.03 0.00 0.42 0.00 0.00 57.03 57.81 3d7r h ASP 100 Cb 0.17 0.22 -0.04 0.00 1.72 0.00 0.00 39.33 41.39 3d7r h ASP 100 CO -0.03 -0.18 0.37 0.11 -2.88 0.00 0.00 179.24 176.64 3d7r h LYS 101 N -0.16 0.71 -0.67 0.28 1.57 -0.99 -1.68 116.57 115.62 3d7r h LYS 101 Ca 0.10 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.79 3d7r h LYS 101 Cb 0.31 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.43 3d7r h LYS 101 CO -0.25 0.47 0.23 0.82 -0.57 0.00 0.00 179.45 180.15 3d7r h ILE 102 N 0.73 1.25 -0.10 1.86 2.04 -0.88 -0.23 117.51 122.17 3d7r h ILE 102 Ca 0.25 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.31 3d7r h ILE 102 Cb 0.05 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 36.62 3d7r h ILE 102 CO -0.12 0.32 -0.11 0.74 0.00 0.00 0.00 178.15 178.99 3d7r h THR 103 N 0.97 0.69 -0.13 -0.27 2.02 -0.63 0.11 112.91 115.67 3d7r h THR 103 Ca 0.22 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.32 3d7r h THR 103 Cb 0.27 0.69 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 3d7r h THR 103 CO -0.01 0.00 -0.28 -0.07 0.37 0.00 0.00 175.52 175.53 3d7r h LEU 104 N -0.14 0.23 0.25 2.58 4.07 -1.04 -0.05 115.31 121.21 3d7r h LEU 104 Ca 0.07 -0.07 -0.33 0.00 0.08 0.00 0.00 57.88 57.63 3d7r h LEU 104 Cb 0.25 -0.06 0.04 0.00 1.08 0.00 0.00 40.66 41.96 3d7r h LEU 104 CO -0.18 0.52 -1.46 0.28 -1.08 0.00 0.00 178.44 176.51 3d7r h SER 105 N 0.21 0.82 0.65 -0.43 0.02 -0.78 -3.37 113.55 110.67 3d7r h SER 105 Ca 0.03 -0.87 -0.18 0.00 -0.84 0.00 0.00 61.79 59.93 3d7r h SER 105 Cb 0.62 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 3d7r h SER 105 CO 0.04 1.68 -1.48 0.35 -1.14 0.00 0.00 176.83 176.29 3d7r n THR 106 N -3.70 1.20 -2.55 -2.27 -2.24 0.35 -4.86 114.28 100.21 3d7r n THR 106 Ca -0.16 -0.70 -0.17 0.00 -2.27 0.00 0.00 64.05 60.74 3d7r n THR 106 Cb 1.10 -0.74 -0.00 0.00 -2.10 0.00 0.00 70.33 68.59 3d7r n THR 106 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3d7r n LEU 107 N -2.88 -1.65 -4.90 3.22 4.77 -0.04 -5.02 117.00 110.50 3d7r n LEU 107 Ca -0.11 0.02 -0.28 0.00 -0.03 0.00 0.00 56.01 55.61 3d7r n LEU 107 Cb 0.86 -2.55 -0.03 0.00 -2.33 0.00 0.00 43.42 39.37 3d7r n LEU 107 CO 0.43 -0.11 0.23 -0.31 -1.33 0.00 0.00 177.39 176.30 3d7r s TYR 108 N -2.87 3.48 -0.18 -1.77 1.51 -1.26 -4.66 117.35 111.60 3d7r s TYR 108 Ca 0.06 0.67 -0.29 0.00 -1.01 0.00 0.00 57.07 56.49 3d7r s TYR 108 Cb -0.03 -2.13 0.00 0.00 -0.11 0.00 0.00 41.96 39.69 3d7r s TYR 108 CO 0.07 0.13 1.06 -2.00 -1.11 0.00 0.00 175.55 173.71 3d7r s GLU 109 N -3.64 4.31 -0.17 -0.62 2.12 0.05 -4.67 118.70 116.07 3d7r s GLU 109 Ca 0.44 1.41 -0.17 0.00 0.36 0.00 0.00 54.97 57.02 3d7r s GLU 109 Cb -0.11 -3.62 -0.04 0.00 0.26 0.00 0.00 34.13 30.62 3d7r s GLU 109 CO 0.31 -0.54 0.43 0.08 -0.54 0.00 0.00 175.26 175.00 3d7r s VAL 110 N 2.86 5.19 -0.21 3.70 1.01 0.02 -0.72 120.40 132.24 3d7r s VAL 110 Ca 0.47 0.81 -0.03 0.00 0.00 0.00 0.00 61.98 63.23 3d7r s VAL 110 Cb -0.17 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 3d7r s VAL 110 CO 0.11 0.28 -0.06 -0.69 0.00 0.00 0.00 175.10 174.74 3d7r s VAL 111 N 1.03 3.22 -0.59 2.92 1.01 0.88 -0.64 120.40 128.22 3d7r s VAL 111 Ca 0.22 -0.55 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 3d7r s VAL 111 Cb -0.15 -2.45 0.15 0.00 0.00 0.00 0.00 36.38 33.93 3d7r s VAL 111 CO 0.08 0.44 0.38 -0.22 0.00 0.00 0.00 175.10 175.79 3d7r s LEU 112 N 1.43 4.95 0.09 3.92 2.96 0.76 -0.33 118.68 132.46 3d7r s LEU 112 Ca 0.05 -2.90 -0.30 0.00 -0.22 0.00 0.00 54.13 50.76 3d7r s LEU 112 Cb -0.14 -1.79 -0.06 0.00 0.50 0.00 0.00 46.19 44.70 3d7r s LEU 112 CO -0.04 -0.32 1.17 -2.16 -1.32 0.00 0.00 176.35 173.68 3d7r s PRO 113 N -0.14 4.47 -1.18 0.98 0.04 -1.26 -1.27 135.00 136.64 3d7r s PRO 113 Ca 0.17 1.76 -0.14 0.00 0.04 0.00 0.00 61.00 62.82 3d7r s PRO 113 Cb -0.22 -3.33 0.17 0.00 0.04 0.00 0.00 34.50 31.16 3d7r s PRO 113 CO -0.02 -0.18 1.40 0.42 0.04 0.00 0.00 177.00 178.66 3d7r s ILE 114 N 0.73 4.99 0.60 0.56 -1.09 -0.01 -4.83 121.20 122.16 3d7r s ILE 114 Ca 0.56 -2.52 -0.15 0.00 -2.23 0.00 0.00 60.65 56.31 3d7r s ILE 114 Cb -0.29 -4.90 -0.03 0.00 -1.58 0.00 0.00 42.46 35.65 3d7r s ILE 114 CO 0.31 -1.61 1.06 -0.72 -1.23 0.00 0.00 174.94 172.75 3d7r s TYR 115 N 1.72 2.96 0.27 3.97 -0.85 -1.26 -4.52 117.35 119.64 3d7r s TYR 115 Ca 0.42 1.51 -0.30 0.00 -0.52 0.00 0.00 57.07 58.18 3d7r s TYR 115 Cb -0.03 -3.02 -0.14 0.00 0.38 0.00 0.00 41.96 39.16 3d7r s TYR 115 CO -0.01 -1.18 1.22 -2.30 -1.52 0.00 0.00 175.55 171.77 3d7r n PRO 116 N -2.12 1.72 -4.29 -3.49 -0.02 -1.26 -4.99 135.00 120.55 3d7r n PRO 116 Ca 0.09 0.61 -0.29 0.00 -2.02 0.00 0.00 63.50 61.88 3d7r n PRO 116 Cb 0.53 -2.14 -0.11 0.00 -0.02 0.00 0.00 33.50 31.76 3d7r n PRO 116 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 3d7r s LYS 117 N -1.11 1.82 0.66 -0.52 -0.14 -1.26 -4.54 119.74 114.65 3d7r s LYS 117 Ca 0.63 -1.16 -0.12 0.00 -1.36 0.00 0.00 55.97 53.96 3d7r s LYS 117 Cb -0.68 -2.14 -0.01 0.00 -1.68 0.00 0.00 37.83 33.33 3d7r s LYS 117 CO 0.56 0.48 1.05 -0.08 -0.76 0.00 0.00 175.35 176.60 3d7r s THR 118 N -1.15 4.18 -0.88 2.17 -1.32 0.16 -1.31 115.64 117.49 3d7r s THR 118 Ca 0.18 0.76 0.27 0.00 -1.21 0.00 0.00 61.69 61.69 3d7r s THR 118 Cb -0.11 -3.52 0.22 0.00 -1.51 0.00 0.00 72.50 67.59 3d7r s THR 118 CO 0.11 -0.88 1.79 -0.81 -2.21 0.00 0.00 174.62 172.62 3d7r n PRO 119 N -2.85 0.11 -0.03 7.08 -0.04 -1.26 -4.27 135.00 133.73 3d7r n PRO 119 Ca 0.07 0.08 -0.16 0.00 -0.04 0.00 0.00 63.50 63.45 3d7r n PRO 119 Cb 0.54 -1.62 -0.07 0.00 -0.04 0.00 0.00 33.50 32.30 3d7r n PRO 119 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3d7r h GLU 120 N 0.00 0.68 -6.12 0.54 4.81 -1.93 -3.46 114.58 109.10 3d7r h GLU 120 Ca 0.00 -0.53 -0.52 0.00 -0.13 0.00 0.00 59.36 58.18 3d7r h GLU 120 Cb 0.60 0.10 -0.06 0.00 0.63 0.00 0.00 28.75 30.02 3d7r h GLU 120 CO 0.00 1.15 -0.48 -0.06 -0.73 0.00 0.00 179.01 178.89 3d7r s PHE 121 N -3.79 2.76 0.35 0.92 0.08 -0.43 -5.07 117.98 112.80 3d7r s PHE 121 Ca -0.12 -0.40 0.04 0.00 0.12 0.00 0.00 56.93 56.57 3d7r s PHE 121 Cb 0.07 -1.82 -0.03 0.00 -0.57 0.00 0.00 43.02 40.67 3d7r s PHE 121 CO 0.87 0.19 0.16 -1.01 -0.10 0.00 0.00 175.22 175.33 3d7r s HIS 122 N -2.42 1.71 0.25 0.36 3.76 -1.26 -3.09 115.29 114.60 3d7r s HIS 122 Ca 0.41 -1.37 -0.12 0.00 -0.15 0.00 0.00 55.06 53.82 3d7r s HIS 122 Cb -0.03 -0.96 0.35 0.00 1.11 0.00 0.00 32.58 33.05 3d7r s HIS 122 CO 0.25 -0.48 1.56 0.97 -0.85 0.00 0.00 174.74 176.19 3d7r h ILE 123 N 2.04 0.03 -0.44 0.60 2.10 -1.46 -1.27 117.51 119.10 3d7r h ILE 123 Ca -0.33 0.00 -0.08 0.00 1.08 0.00 0.00 64.86 65.53 3d7r h ILE 123 Cb 1.26 0.03 -0.02 0.00 -1.09 0.00 0.00 36.82 36.99 3d7r h ILE 123 CO 0.52 0.00 -0.04 0.44 -1.08 0.00 0.00 178.15 177.99 3d7r h ASP 124 N -0.01 0.72 -0.49 2.19 3.32 -1.95 -1.18 116.42 119.03 3d7r h ASP 124 Ca 0.41 -0.18 0.01 0.00 0.02 0.00 0.00 57.03 57.29 3d7r h ASP 124 Cb 0.66 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.99 3d7r h ASP 124 CO -0.98 0.81 0.31 0.44 -1.72 0.00 0.00 179.24 178.10 3d7r h ASP 125 N 0.69 0.52 0.03 6.45 3.32 -1.66 -1.01 116.42 124.77 3d7r h ASP 125 Ca 0.13 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.17 3d7r h ASP 125 Cb 0.48 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.91 3d7r h ASP 125 CO 0.02 0.37 -0.02 0.74 -1.72 0.00 0.00 179.24 178.64 3d7r h THR 126 N 0.62 1.13 -0.29 0.35 2.02 -0.85 -2.66 112.91 113.25 3d7r h THR 126 Ca 0.19 -0.53 -0.12 0.00 0.77 0.00 0.00 66.41 66.72 3d7r h THR 126 Cb -0.03 1.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 3d7r h THR 126 CO -0.06 0.13 -0.34 -0.26 0.37 0.00 0.00 175.52 175.37 3d7r h PHE 127 N -0.27 0.73 -0.72 3.16 0.04 -1.19 -2.49 116.94 116.20 3d7r h PHE 127 Ca -0.00 -0.19 -0.05 0.00 2.80 0.00 0.00 57.97 60.53 3d7r h PHE 127 Cb 0.25 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.21 3d7r h PHE 127 CO 0.00 0.88 0.27 1.96 -0.60 0.00 0.00 178.31 180.82 3d7r h GLN 128 N 0.53 1.07 -0.42 1.51 4.20 -1.18 -1.58 115.11 119.24 3d7r h GLN 128 Ca 0.06 -0.20 -0.04 0.00 0.06 0.00 0.00 58.65 58.53 3d7r h GLN 128 Cb 0.83 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.42 3d7r h GLN 128 CO 0.07 0.89 0.12 0.00 -0.67 0.00 0.00 178.83 179.23 3d7r h ALA 129 N 1.24 0.55 -0.62 3.87 0.00 -1.32 -1.89 119.26 121.09 3d7r h ALA 129 Ca 0.24 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 3d7r h ALA 129 Cb 0.23 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3d7r h ALA 129 CO -0.02 0.22 0.30 0.82 0.00 0.00 0.00 179.25 180.57 3d7r h ILE 130 N 0.54 1.22 -0.55 0.00 2.04 -1.21 -2.31 117.51 117.24 3d7r h ILE 130 Ca 0.13 -0.61 0.10 0.00 1.00 0.00 0.00 64.86 65.49 3d7r h ILE 130 Cb 0.29 0.47 -0.08 0.00 -0.74 0.00 0.00 36.82 36.75 3d7r h ILE 130 CO -0.00 0.25 0.07 -0.61 0.00 0.00 0.00 178.15 177.86 3d7r h GLN 131 N 0.85 0.19 -0.41 2.37 5.75 -1.17 0.11 115.11 122.80 3d7r h GLN 131 Ca 0.21 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.69 3d7r h GLN 131 Cb 0.12 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.60 3d7r h GLN 131 CO -0.03 0.13 0.19 0.00 -2.65 0.00 0.00 178.83 176.47 3d7r h ARG 132 N 0.19 0.59 -0.34 1.69 3.08 -0.90 0.53 114.38 119.23 3d7r h ARG 132 Ca 0.28 -0.09 -0.15 0.00 0.07 0.00 0.00 59.98 60.09 3d7r h ARG 132 Cb 0.42 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 3d7r h ARG 132 CO -0.40 0.53 -0.40 -0.24 -1.07 0.00 0.00 179.97 178.39 3d7r h VAL 133 N 0.52 1.28 -0.36 2.04 3.04 -1.16 -1.72 116.25 119.89 3d7r h VAL 133 Ca 0.14 -1.58 0.03 0.00 -1.01 0.00 0.00 66.70 64.28 3d7r h VAL 133 Cb 0.14 1.44 -0.03 0.00 -2.01 0.00 0.00 31.29 30.83 3d7r h VAL 133 CO -0.02 0.52 0.17 0.22 -1.01 0.00 0.00 177.57 177.45 3d7r h TYR 134 N 0.67 0.32 -0.53 3.17 3.20 -0.75 -1.49 116.97 121.55 3d7r h TYR 134 Ca 0.05 0.01 0.03 0.00 3.14 0.00 0.00 58.73 61.97 3d7r h TYR 134 Cb 0.97 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 39.11 3d7r h TYR 134 CO 0.06 0.17 0.31 -0.44 -1.64 0.00 0.00 178.16 176.61 3d7r h ASP 135 N 0.36 0.49 -0.15 -2.11 3.32 -0.78 -1.15 116.42 116.39 3d7r h ASP 135 Ca 0.15 0.01 0.05 0.00 0.02 0.00 0.00 57.03 57.26 3d7r h ASP 135 Cb 0.07 -0.09 -0.07 0.00 0.22 0.00 0.00 39.33 39.46 3d7r h ASP 135 CO -0.11 0.34 -0.35 -0.61 -1.72 0.00 0.00 179.24 176.79 3d7r h GLN 136 N 0.61 -0.40 -0.44 3.56 4.15 -0.89 -1.56 115.11 120.14 3d7r h GLN 136 Ca 0.22 0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.67 3d7r h GLN 136 Cb 0.05 0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 3d7r h GLN 136 CO -0.11 -0.27 0.28 -0.07 -1.93 0.00 0.00 178.83 176.73 3d7r h LEU 137 N -0.42 0.51 -1.13 -2.39 3.38 -0.97 -2.53 115.31 111.76 3d7r h LEU 137 Ca 0.10 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.10 3d7r h LEU 137 Cb 0.57 -0.13 -0.06 0.00 0.09 0.00 0.00 40.66 41.14 3d7r h LEU 137 CO -0.38 0.37 0.60 0.58 0.09 0.00 0.00 178.44 179.70 3d7r h VAL 138 N 0.59 1.11 0.00 1.22 2.07 -1.10 -0.54 116.25 119.60 3d7r h VAL 138 Ca 0.16 -0.37 -0.05 0.00 0.82 0.00 0.00 66.70 67.25 3d7r h VAL 138 Cb -0.06 -0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 29.63 3d7r h VAL 138 CO -0.03 0.20 -0.25 0.77 0.02 0.00 0.00 177.57 178.28 3d7r h SER 139 N 1.09 0.00 0.06 0.57 4.64 -0.89 0.42 113.55 119.45 3d7r h SER 139 Ca 0.38 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.59 3d7r h SER 139 Cb 0.12 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.22 3d7r h SER 139 CO -0.13 0.25 -0.46 -0.33 -0.87 0.00 0.00 176.83 175.28 3d7r h GLU 140 N 0.00 0.20 0.00 4.77 5.08 -0.73 -3.42 114.58 120.48 3d7r h GLU 140 Ca -0.00 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 3d7r h GLU 140 Cb 0.59 0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.94 3d7r h GLU 140 CO 0.03 1.10 0.00 1.33 -1.00 0.00 0.00 179.01 180.48 3d7r n VAL 141 N -4.34 0.00 0.00 3.13 0.24 -0.70 -5.12 118.33 111.54 3d7r n VAL 141 Ca -0.12 -0.21 0.00 0.00 -2.04 0.00 0.00 64.34 61.97 3d7r n VAL 141 Cb 0.66 1.52 0.00 0.00 -1.47 0.00 0.00 33.84 34.55 3d7r n VAL 141 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3d7r n GLY 142 N 0.04 -1.29 0.25 7.63 0.00 0.13 -4.41 105.19 107.53 3d7r n GLY 142 Ca 0.00 -1.43 0.05 0.00 0.00 0.00 0.00 46.02 44.63 3d7r n GLY 142 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 3d7r h HIS 143 N 0.00 0.15 0.00 1.61 2.07 -1.88 -1.85 115.15 115.25 3d7r h HIS 143 Ca 0.00 -0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.51 3d7r h HIS 143 Cb 0.00 -0.05 0.00 0.00 2.57 0.00 0.00 27.41 29.93 3d7r h HIS 143 CO 0.00 0.22 0.00 0.00 -3.07 0.00 0.00 177.93 175.08 3d7r n GLN 144 N -4.38 0.16 -0.33 5.12 0.00 -1.26 -2.10 117.38 114.59 3d7r n GLN 144 Ca -0.01 0.49 0.07 0.00 0.00 0.00 0.00 57.00 57.55 3d7r n GLN 144 Cb 0.19 -1.87 0.22 0.00 0.00 0.00 0.00 30.24 28.78 3d7r n GLN 144 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 3d7r n ASN 145 N -2.18 3.50 -4.28 2.61 3.02 -0.69 -4.48 115.26 112.75 3d7r n ASN 145 Ca 0.01 -2.46 -0.32 0.00 -0.03 0.00 0.00 54.58 51.78 3d7r n ASN 145 Cb 0.15 -0.39 -0.16 0.00 -0.61 0.00 0.00 39.78 38.77 3d7r n ASN 145 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3d7r s VAL 146 N -1.84 2.31 0.01 2.41 1.01 -0.89 -0.76 120.40 122.66 3d7r s VAL 146 Ca 0.34 -0.95 0.07 0.00 0.00 0.00 0.00 61.98 61.43 3d7r s VAL 146 Cb 0.23 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 3d7r s VAL 146 CO 0.14 0.56 -0.19 -0.69 0.00 0.00 0.00 175.10 174.92 3d7r s VAL 147 N 0.09 2.70 0.37 2.92 1.01 0.20 -0.54 120.40 127.13 3d7r s VAL 147 Ca -0.10 -1.07 0.08 0.00 0.00 0.00 0.00 61.98 60.88 3d7r s VAL 147 Cb -0.16 -2.08 -0.03 0.00 0.00 0.00 0.00 36.38 34.11 3d7r s VAL 147 CO 0.06 0.44 0.30 -0.69 0.00 0.00 0.00 175.10 175.20 3d7r s VAL 148 N -0.82 3.10 0.00 2.92 1.01 -0.83 -0.49 120.40 125.29 3d7r s VAL 148 Ca 0.13 -1.42 0.00 0.00 0.00 0.00 0.00 61.98 60.69 3d7r s VAL 148 Cb -0.10 -3.08 0.00 0.00 0.00 0.00 0.00 36.38 33.19 3d7r s VAL 148 CO 0.03 -0.11 0.00 0.61 0.00 0.00 0.00 175.10 175.63 3d7r n GLY 150 N -1.40 2.74 3.21 4.51 0.00 -0.92 -0.29 105.19 113.04 3d7r n GLY 150 Ca -0.00 -0.83 -0.23 0.00 0.00 0.00 0.00 46.02 44.96 3d7r n GLY 150 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 3d7r s ASP 151 N 0.00 2.13 1.43 1.61 -4.77 -1.10 -0.86 116.67 115.12 3d7r s ASP 151 Ca 0.00 -0.54 0.00 0.00 -3.30 0.00 0.00 52.55 48.71 3d7r s ASP 151 Cb 0.00 -0.14 0.00 0.00 -1.09 0.00 0.00 42.92 41.69 3d7r s ASP 151 CO 0.00 0.08 0.00 0.61 0.70 0.00 0.00 175.17 176.56 3d7r n GLY 152 N 1.68 2.85 0.33 2.12 0.00 0.55 -0.35 105.19 112.37 3d7r n GLY 152 Ca -0.18 -0.30 0.16 0.00 0.00 0.00 0.00 46.02 45.69 3d7r n GLY 152 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3d7r h SER 153 N 3.86 0.00 0.27 1.61 4.64 -1.90 -0.06 113.55 121.97 3d7r h SER 153 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 3d7r h SER 153 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 3d7r h SER 153 CO 0.00 0.00 -0.35 1.23 -0.87 0.00 0.00 176.83 176.84 3d7r h GLY 154 N 0.00 0.13 1.09 -0.77 0.00 -0.81 -0.20 103.07 102.50 3d7r h GLY 154 Ca 0.10 -0.11 -0.14 0.00 0.00 0.00 0.00 47.33 47.18 3d7r h GLY 154 CO -0.00 0.10 -0.26 -1.33 0.00 0.00 0.00 176.54 175.05 3d7r h GLY 155 N 1.10 1.01 0.97 4.60 0.00 -0.74 0.12 103.07 110.14 3d7r h GLY 155 Ca 0.01 -0.94 0.01 0.00 0.00 0.00 0.00 47.33 46.41 3d7r h GLY 155 CO 0.05 0.86 0.20 0.00 0.00 0.00 0.00 176.54 177.64 3d7r h ALA 156 N 0.82 0.39 -0.60 3.60 0.00 -1.08 -1.29 119.26 121.09 3d7r h ALA 156 Ca 0.09 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.99 3d7r h ALA 156 Cb 0.84 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 3d7r h ALA 156 CO 0.07 -0.16 0.40 -0.07 0.00 0.00 0.00 179.25 179.50 3d7r h LEU 157 N 0.40 0.69 0.01 0.00 3.38 -0.89 -0.07 115.31 118.84 3d7r h LEU 157 Ca 0.12 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3d7r h LEU 157 Cb -0.03 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.55 3d7r h LEU 157 CO -0.04 0.50 -0.00 0.00 0.09 0.00 0.00 178.44 178.99 3d7r h ALA 158 N 1.22 -0.01 -0.01 1.53 0.00 -0.61 0.20 119.26 121.58 3d7r h ALA 158 Ca 0.22 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3d7r h ALA 158 Cb -0.09 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3d7r h ALA 158 CO -0.05 -0.47 0.01 1.25 0.00 0.00 0.00 179.25 179.98 3d7r h LEU 159 N -0.07 0.02 -1.03 0.00 5.85 -1.09 -1.68 115.31 117.32 3d7r h LEU 159 Ca -0.00 -0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.66 3d7r h LEU 159 Cb 0.07 -0.00 -0.07 0.00 0.37 0.00 0.00 40.66 41.02 3d7r h LEU 159 CO 0.00 0.15 0.64 -1.28 -0.34 0.00 0.00 178.44 177.62 3d7r h SER 160 N -0.12 0.99 -0.42 1.25 0.87 -0.92 -0.26 113.55 114.94 3d7r h SER 160 Ca 0.00 0.02 -0.07 0.00 -1.23 0.00 0.00 61.79 60.52 3d7r h SER 160 Cb 0.14 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 61.90 3d7r h SER 160 CO -0.00 0.60 -0.00 0.15 -0.53 0.00 0.00 176.83 177.05 3d7r h PHE 161 N 1.11 0.81 -0.31 2.24 3.57 -0.44 -0.31 116.94 123.61 3d7r h PHE 161 Ca 0.45 -0.14 -0.08 0.00 3.53 0.00 0.00 57.97 61.72 3d7r h PHE 161 Cb 0.27 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 3d7r h PHE 161 CO -0.00 0.81 -0.16 0.28 -2.23 0.00 0.00 178.31 177.01 3d7r h VAL 162 N 0.58 1.25 -0.75 1.41 2.07 -0.89 -1.29 116.25 118.63 3d7r h VAL 162 Ca 0.12 -1.14 -0.04 0.00 0.82 0.00 0.00 66.70 66.46 3d7r h VAL 162 Cb 0.49 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.41 3d7r h VAL 162 CO 0.02 0.37 0.29 1.56 0.02 0.00 0.00 177.57 179.84 3d7r h GLN 163 N 0.51 1.12 -0.33 1.57 4.20 -0.86 -0.43 115.11 120.89 3d7r h GLN 163 Ca 0.09 -0.20 0.01 0.00 0.06 0.00 0.00 58.65 58.60 3d7r h GLN 163 Cb 0.57 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.15 3d7r h GLN 163 CO 0.04 0.91 0.21 1.03 -0.67 0.00 0.00 178.83 180.35 3d7r h SER 164 N 1.09 0.36 -0.31 1.46 0.87 -0.51 0.73 113.55 117.24 3d7r h SER 164 Ca 0.25 -0.01 0.04 0.00 -1.23 0.00 0.00 61.79 60.85 3d7r h SER 164 Cb 0.22 -0.08 -0.04 0.00 -0.44 0.00 0.00 62.40 62.05 3d7r h SER 164 CO -0.02 0.26 0.07 -0.07 -0.53 0.00 0.00 176.83 176.54 3d7r h LEU 165 N 0.43 0.02 -0.10 2.23 3.38 -0.88 -0.45 115.31 119.94 3d7r h LEU 165 Ca 0.13 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.15 3d7r h LEU 165 Cb -0.03 0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3d7r h LEU 165 CO -0.04 0.05 0.06 0.25 0.09 0.00 0.00 178.44 178.85 3d7r h LEU 166 N 0.18 0.10 -1.93 1.67 5.85 -0.88 0.21 115.31 120.50 3d7r h LEU 166 Ca 0.15 -0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.85 3d7r h LEU 166 Cb 0.16 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.16 3d7r h LEU 166 CO -0.19 0.07 -0.07 0.44 -0.34 0.00 0.00 178.44 178.35 3d7r h ASP 167 N 0.12 0.00 -0.70 1.25 3.32 -0.68 -2.82 116.42 116.91 3d7r h ASP 167 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3d7r h ASP 167 Cb -0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.54 3d7r h ASP 167 CO -0.01 0.07 0.00 0.59 -1.72 0.00 0.00 179.24 178.17 3d7r n ASN 168 N -4.29 4.42 -2.32 6.45 3.02 -0.19 -4.96 115.26 117.38 3d7r n ASN 168 Ca -0.03 -2.24 -0.16 0.00 -0.03 0.00 0.00 54.58 52.12 3d7r n ASN 168 Cb 0.16 -0.54 -0.01 0.00 -0.61 0.00 0.00 39.78 38.77 3d7r n ASN 168 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3d7r n GLN 169 N 1.39 -1.95 -2.96 3.52 6.02 -0.64 -4.97 117.38 117.79 3d7r n GLN 169 Ca 0.25 0.77 -0.35 0.00 -0.01 0.00 0.00 57.00 57.67 3d7r n GLN 169 Cb 0.77 -5.37 -0.06 0.00 1.02 0.00 0.00 30.24 26.60 3d7r n GLN 169 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 3d7r s GLN 170 N -4.86 4.26 0.14 -1.09 -1.52 0.64 -5.00 119.66 112.24 3d7r s GLN 170 Ca 0.00 1.00 -0.34 0.00 -1.95 0.00 0.00 55.36 54.06 3d7r s GLN 170 Cb 0.00 -2.55 -0.16 0.00 -0.22 0.00 0.00 33.01 30.08 3d7r s GLN 170 CO 0.00 0.19 1.34 -2.30 -0.25 0.00 0.00 175.29 174.27 3d7r n PRO 171 N 0.03 1.43 -3.64 2.91 -0.02 -1.26 -4.58 135.00 129.87 3d7r n PRO 171 Ca 0.03 0.51 -0.29 0.00 -2.02 0.00 0.00 63.50 61.73 3d7r n PRO 171 Cb 0.52 -2.14 -0.04 0.00 -0.02 0.00 0.00 33.50 31.83 3d7r n PRO 171 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3d7r s LEU 172 N 0.56 4.22 0.75 2.45 1.43 -1.26 -4.99 118.68 121.84 3d7r s LEU 172 Ca 0.78 0.53 -0.12 0.00 -1.03 0.00 0.00 54.13 54.29 3d7r s LEU 172 Cb -0.84 -3.28 0.05 0.00 0.03 0.00 0.00 46.19 42.15 3d7r s LEU 172 CO 0.47 -0.02 1.12 -2.16 0.23 0.00 0.00 176.35 175.99 3d7r s PRO 173 N -3.05 2.23 0.34 1.29 0.04 -1.26 -4.48 135.00 130.11 3d7r s PRO 173 Ca 0.40 1.36 0.03 0.00 0.04 0.00 0.00 61.00 62.83 3d7r s PRO 173 Cb -0.11 -1.88 0.61 0.00 0.04 0.00 0.00 34.50 33.15 3d7r s PRO 173 CO 0.27 -1.69 1.95 -0.97 0.04 0.00 0.00 177.00 176.60 3d7r h ASN 174 N -0.79 0.65 -5.10 6.66 -0.73 -0.79 -3.45 115.58 112.03 3d7r h ASN 174 Ca -0.45 -0.06 -0.08 0.00 1.87 0.00 0.00 56.30 57.59 3d7r h ASN 174 Cb 1.25 -0.16 -0.14 0.00 0.27 0.00 0.00 38.32 39.53 3d7r h ASN 174 CO 0.51 0.56 -0.24 -0.54 -0.37 0.00 0.00 177.43 177.35 3d7r s LYS 175 N -5.41 0.91 -0.11 6.67 1.02 -1.26 -4.33 119.74 117.24 3d7r s LYS 175 Ca -0.09 -0.76 0.01 0.00 0.02 0.00 0.00 55.97 55.15 3d7r s LYS 175 Cb 0.17 0.39 0.02 0.00 -0.52 0.00 0.00 37.83 37.88 3d7r s LYS 175 CO 0.77 -0.32 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.58 3d7r s LEU 176 N -2.65 1.61 -0.14 3.17 2.96 -0.45 -1.97 118.68 121.22 3d7r s LEU 176 Ca 0.02 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.52 3d7r s LEU 176 Cb 0.02 -1.01 -0.02 0.00 0.50 0.00 0.00 46.19 45.68 3d7r s LEU 176 CO -0.10 -0.01 -0.09 -0.31 -1.32 0.00 0.00 176.35 174.52 3d7r s TYR 177 N 1.13 2.90 -0.15 5.38 2.02 0.60 -0.94 117.35 128.28 3d7r s TYR 177 Ca -0.04 -0.50 0.01 0.00 -0.37 0.00 0.00 57.07 56.17 3d7r s TYR 177 Cb -0.14 -1.89 0.02 0.00 -0.40 0.00 0.00 41.96 39.55 3d7r s TYR 177 CO -0.03 -0.13 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.15 3d7r s LEU 178 N 0.34 1.81 -0.29 -1.29 1.43 0.04 -2.17 118.68 118.54 3d7r s LEU 178 Ca -0.08 -0.52 -0.05 0.00 -1.03 0.00 0.00 54.13 52.44 3d7r s LEU 178 Cb -0.15 -1.25 0.02 0.00 0.03 0.00 0.00 46.19 44.83 3d7r s LEU 178 CO 0.05 -0.03 0.04 -0.63 0.23 0.00 0.00 176.35 176.01 3d7r s ILE 179 N 1.37 3.62 -1.40 -0.59 1.01 -0.03 -0.40 121.20 124.77 3d7r s ILE 179 Ca 0.03 -0.87 -0.06 0.00 0.00 0.00 0.00 60.65 59.75 3d7r s ILE 179 Cb -0.13 -2.90 0.00 0.00 0.01 0.00 0.00 42.46 39.44 3d7r s ILE 179 CO -0.10 0.06 0.36 -1.20 0.00 0.00 0.00 174.94 174.06 3d7r n SER 180 N 4.80 -0.90 -4.77 3.58 7.64 0.19 -0.33 113.62 123.82 3d7r n SER 180 Ca -0.15 -1.13 -0.39 0.00 1.01 0.00 0.00 58.87 58.21 3d7r n SER 180 Cb 0.47 -2.47 -0.01 0.00 -1.01 0.00 0.00 64.21 61.18 3d7r n SER 180 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3d7r s PRO 181 N -6.85 4.08 -1.11 1.43 0.04 -1.26 -2.58 135.00 128.74 3d7r s PRO 181 Ca 0.11 2.05 -0.14 0.00 0.04 0.00 0.00 61.00 63.05 3d7r s PRO 181 Cb -0.05 -2.80 0.17 0.00 0.04 0.00 0.00 34.50 31.87 3d7r s PRO 181 CO 0.93 -0.36 1.29 0.42 0.04 0.00 0.00 177.00 179.32 3d7r s ILE 182 N -1.29 5.09 0.33 0.56 1.01 -0.94 -4.87 121.20 121.09 3d7r s ILE 182 Ca 0.55 -2.45 0.18 0.00 0.00 0.00 0.00 60.65 58.93 3d7r s ILE 182 Cb -0.36 -4.83 0.16 0.00 0.01 0.00 0.00 42.46 37.45 3d7r s ILE 182 CO 0.46 -1.52 1.87 -0.07 0.00 0.00 0.00 174.94 175.68 3d7r h LEU 183 N 9.46 0.00 -7.49 2.97 3.38 -1.91 -3.40 115.31 118.33 3d7r h LEU 183 Ca 0.25 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.66 3d7r h LEU 183 Cb 0.92 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.28 3d7r h LEU 183 CO 1.16 0.30 -0.78 -0.62 0.09 0.00 0.00 178.44 178.60 3d7r s ASP 184 N -6.60 3.34 0.30 -0.43 -1.08 -1.26 -2.25 116.67 108.69 3d7r s ASP 184 Ca -0.02 -0.96 0.25 0.00 -0.52 0.00 0.00 52.55 51.30 3d7r s ASP 184 Cb 0.13 -0.91 1.06 0.00 -1.46 0.00 0.00 42.92 41.74 3d7r s ASP 184 CO 0.68 -0.26 1.75 0.00 0.52 0.00 0.00 175.17 177.86 3d7r h ALA 185 N 8.09 1.00 0.00 3.66 0.00 -1.79 -2.73 119.26 127.49 3d7r h ALA 185 Ca -0.18 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 3d7r h ALA 185 Cb 1.10 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 3d7r h ALA 185 CO 0.38 0.00 -0.53 1.79 0.00 0.00 0.00 179.25 180.89 3d7r h THR 186 N 0.00 1.01 -6.56 0.00 1.35 -1.96 -3.37 112.91 103.38 3d7r h THR 186 Ca 0.00 -2.15 -0.52 0.00 -0.55 0.00 0.00 66.41 63.20 3d7r h THR 186 Cb 0.35 2.30 -0.11 0.00 -1.73 0.00 0.00 68.15 68.96 3d7r h THR 186 CO 0.00 0.52 -0.84 0.18 -0.25 0.00 0.00 175.52 175.13 3d7r n LEU 187 N -3.37 -2.08 -0.61 3.87 4.77 -1.03 -4.88 117.00 113.68 3d7r n LEU 187 Ca 0.01 -0.97 0.07 0.00 -0.03 0.00 0.00 56.01 55.09 3d7r n LEU 187 Cb 0.68 -2.23 0.08 0.00 -2.33 0.00 0.00 43.42 39.62 3d7r n LEU 187 CO 0.40 0.38 0.50 -1.54 -1.33 0.00 0.00 177.39 175.80 3d7r n SER 188 N -2.82 2.33 -4.69 -1.43 3.41 -1.26 -4.98 113.62 104.18 3d7r n SER 188 Ca -0.09 -1.65 -0.57 0.00 -0.26 0.00 0.00 58.87 56.30 3d7r n SER 188 Cb 0.58 -0.04 -0.07 0.00 -0.26 0.00 0.00 64.21 64.42 3d7r n SER 188 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3d7r n ASN 189 N 0.81 2.24 0.09 4.04 2.85 -1.26 -4.80 115.26 119.23 3d7r n ASN 189 Ca 0.09 1.08 0.09 0.00 -0.11 0.00 0.00 54.58 55.74 3d7r n ASN 189 Cb 0.38 -1.14 0.42 0.00 1.24 0.00 0.00 39.78 40.67 3d7r n ASN 189 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 3d7r n LYS 190 N 4.89 0.12 0.00 1.20 2.85 -1.26 -1.29 118.16 124.67 3d7r n LYS 190 Ca 0.25 0.43 0.15 0.00 -1.05 0.00 0.00 58.31 58.09 3d7r n LYS 190 Cb 0.14 -1.76 0.77 0.00 -0.65 0.00 0.00 35.03 33.52 3d7r n LYS 190 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3d7r n ASP 191 N -2.00 0.18 -4.58 -5.58 8.00 -1.26 -4.62 116.55 106.68 3d7r n ASP 191 Ca 0.02 -0.57 -0.42 0.00 0.71 0.00 0.00 54.79 54.53 3d7r n ASP 191 Cb 0.16 -0.13 -0.02 0.00 -0.02 0.00 0.00 41.12 41.10 3d7r n ASP 191 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3d7r s ILE 192 N -2.35 3.90 0.62 0.53 1.01 -0.41 -4.89 121.20 119.61 3d7r s ILE 192 Ca 0.35 0.80 -0.05 0.00 0.00 0.00 0.00 60.65 61.75 3d7r s ILE 192 Cb 0.21 -4.55 0.02 0.00 0.01 0.00 0.00 42.46 38.15 3d7r s ILE 192 CO 0.43 -1.21 0.92 -0.94 0.00 0.00 0.00 174.94 174.13 3d7r s SER 193 N 3.70 5.36 0.24 3.58 1.04 -1.26 -4.92 113.70 121.43 3d7r s SER 193 Ca 0.49 0.58 -0.06 0.00 0.48 0.00 0.00 55.95 57.43 3d7r s SER 193 Cb -0.09 -1.47 0.28 0.00 0.10 0.00 0.00 66.02 64.83 3d7r s SER 193 CO 0.26 -1.21 1.89 0.44 0.98 0.00 0.00 173.24 175.60 3d7r h ASP 194 N -0.26 0.98 -0.63 7.02 3.32 -1.97 -1.05 116.42 123.83 3d7r h ASP 194 Ca -0.45 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 56.65 3d7r h ASP 194 Cb 1.28 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 40.55 3d7r h ASP 194 CO 0.60 0.68 0.33 0.00 -1.72 0.00 0.00 179.24 179.13 3d7r h ALA 195 N 1.37 0.84 -0.39 3.45 0.00 -1.99 -0.13 119.26 122.41 3d7r h ALA 195 Ca 0.36 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 55.23 3d7r h ALA 195 Cb -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3d7r h ALA 195 CO -0.12 -0.02 -0.01 1.25 0.00 0.00 0.00 179.25 180.36 3d7r h LEU 196 N 0.61 0.69 -0.83 0.00 5.85 -1.82 -2.70 115.31 117.10 3d7r h LEU 196 Ca 0.29 -0.31 0.07 0.00 0.84 0.00 0.00 57.88 58.76 3d7r h LEU 196 Cb 0.21 -0.19 -0.06 0.00 0.37 0.00 0.00 40.66 40.99 3d7r h LEU 196 CO -0.20 0.84 0.51 0.40 -0.34 0.00 0.00 178.44 179.65 3d7r h ILE 197 N 0.53 1.00 0.00 4.05 2.04 -0.71 -1.62 117.51 122.80 3d7r h ILE 197 Ca 0.11 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 3d7r h ILE 197 Cb 0.49 0.02 -0.00 0.00 -0.74 0.00 0.00 36.82 36.59 3d7r h ILE 197 CO 0.02 0.16 -0.00 -0.33 0.00 0.00 0.00 178.15 178.01 3d7r h GLU 198 N 0.90 0.00 0.00 2.37 4.39 -0.91 -2.71 114.58 118.62 3d7r h GLU 198 Ca 0.37 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.07 3d7r h GLU 198 Cb 0.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 3d7r h GLU 198 CO -0.19 0.00 -0.44 1.96 -1.16 0.00 0.00 179.01 179.19 3d7r h GLN 199 N 0.00 0.00 -4.44 2.33 1.08 -0.97 -3.45 115.11 109.66 3d7r h GLN 199 Ca -0.00 0.00 -0.73 0.00 -1.45 0.00 0.00 58.65 56.47 3d7r h GLN 199 Cb 0.40 0.00 -0.22 0.00 -0.05 0.00 0.00 27.48 27.61 3d7r h GLN 199 CO 0.00 0.00 -0.16 0.34 -0.95 0.00 0.00 178.83 178.06 3d7r s ASP 200 N -5.10 6.18 -0.01 1.46 -1.08 -1.02 -4.84 116.67 112.25 3d7r s ASP 200 Ca 0.06 -1.38 0.15 0.00 -0.52 0.00 0.00 52.55 50.85 3d7r s ASP 200 Cb 0.10 -2.23 0.44 0.00 -1.46 0.00 0.00 42.92 39.76 3d7r s ASP 200 CO 0.70 -0.82 1.35 0.00 0.52 0.00 0.00 175.17 176.92 3d7r n ALA 201 N 5.59 2.49 -0.01 3.66 0.00 -1.26 -4.37 120.51 126.60 3d7r n ALA 201 Ca -0.11 -0.88 -0.04 0.00 0.00 0.00 0.00 53.44 52.41 3d7r n ALA 201 Cb 0.43 -0.97 -0.01 0.00 0.00 0.00 0.00 19.45 18.90 3d7r n ALA 201 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3d7r n VAL 202 N 0.89 0.44 -3.01 0.00 0.31 -1.26 -5.05 118.33 110.65 3d7r n VAL 202 Ca 0.16 0.03 -0.32 0.00 -0.01 0.00 0.00 64.34 64.20 3d7r n VAL 202 Cb 0.44 -1.59 -0.06 0.00 -0.91 0.00 0.00 33.84 31.73 3d7r n VAL 202 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3d7r s LEU 203 N -6.41 3.98 -0.05 7.52 1.43 -1.26 -4.64 118.68 119.25 3d7r s LEU 203 Ca -0.05 1.33 -0.01 0.00 -1.03 0.00 0.00 54.13 54.37 3d7r s LEU 203 Cb 0.02 -4.16 0.03 0.00 0.03 0.00 0.00 46.19 42.11 3d7r s LEU 203 CO 0.07 -0.28 0.00 -0.55 0.23 0.00 0.00 176.35 175.82 3d7r s SER 204 N -2.46 1.15 0.12 2.29 0.15 -1.26 -4.97 113.70 108.72 3d7r s SER 204 Ca 0.55 -0.06 -0.22 0.00 0.70 0.00 0.00 55.95 56.93 3d7r s SER 204 Cb -0.10 -0.35 -0.05 0.00 -1.71 0.00 0.00 66.02 63.81 3d7r s SER 204 CO 0.20 -0.16 1.70 -0.61 1.20 0.00 0.00 173.24 175.57 3d7r h GLN 205 N 7.90 -0.08 -0.27 5.44 4.15 -1.94 0.05 115.11 130.37 3d7r h GLN 205 Ca -0.27 0.01 0.06 0.00 0.77 0.00 0.00 58.65 59.22 3d7r h GLN 205 Cb 1.13 0.02 -0.07 0.00 0.21 0.00 0.00 27.48 28.77 3d7r h GLN 205 CO 0.33 -0.05 -0.19 0.35 -1.93 0.00 0.00 178.83 177.33 3d7r h PHE 206 N -0.08 -0.49 -0.19 3.99 3.57 -1.95 0.41 116.94 122.20 3d7r h PHE 206 Ca 0.07 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.61 3d7r h PHE 206 Cb 0.19 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.18 3d7r h PHE 206 CO -0.20 -0.27 0.12 0.78 -2.23 0.00 0.00 178.31 176.51 3d7r h GLY 207 N -0.18 0.26 0.80 2.40 0.00 -1.63 -1.27 103.07 103.46 3d7r h GLY 207 Ca 0.15 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 3d7r h GLY 207 CO -0.37 0.10 0.02 -2.08 0.00 0.00 0.00 176.54 174.21 3d7r h VAL 208 N 0.25 1.20 -0.20 4.60 2.07 -0.86 -1.28 116.25 122.03 3d7r h VAL 208 Ca 0.07 -0.62 0.06 0.00 0.82 0.00 0.00 66.70 67.02 3d7r h VAL 208 Cb -0.02 1.44 -0.07 0.00 -1.52 0.00 0.00 31.29 31.12 3d7r h VAL 208 CO -0.01 0.18 -0.30 0.78 0.02 0.00 0.00 177.57 178.24 3d7r h ASN 209 N -0.07 -0.94 -0.38 0.57 -0.26 -0.86 -3.03 115.58 110.61 3d7r h ASN 209 Ca 0.03 0.15 -0.05 0.00 -0.56 0.00 0.00 56.30 55.87 3d7r h ASN 209 Cb 0.26 0.42 -0.01 0.00 -1.06 0.00 0.00 38.32 37.92 3d7r h ASN 209 CO 0.00 -0.33 0.04 -0.33 -1.06 0.00 0.00 177.43 175.75 3d7r h GLU 210 N -0.33 0.64 -0.46 0.81 4.39 -1.16 0.81 114.58 119.28 3d7r h GLU 210 Ca 0.12 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.63 3d7r h GLU 210 Cb 0.52 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 3d7r h GLU 210 CO -0.39 0.72 0.00 -0.89 -1.16 0.00 0.00 179.01 177.29 3d7r n ILE 211 N -4.51 0.03 0.00 3.13 5.41 -0.49 -2.36 119.36 120.57 3d7r n ILE 211 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.74 3d7r n ILE 211 Cb 0.25 -0.19 0.00 0.00 -0.71 0.00 0.00 39.64 38.99 3d7r n ILE 211 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 3d7r n LYS 213 N 0.45 0.00 -0.05 0.38 5.02 0.28 -2.04 118.16 122.20 3d7r n LYS 213 Ca 0.00 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 3d7r n LYS 213 Cb 0.07 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 35.04 3d7r n LYS 213 CO 0.00 0.00 0.00 -0.22 -0.52 0.00 0.00 177.40 176.66 3d7r h LYS 214 N 0.00 0.27 -0.76 1.97 1.63 -1.72 -2.79 116.57 115.17 3d7r h LYS 214 Ca 0.00 -0.03 -0.06 0.00 -0.85 0.00 0.00 60.65 59.72 3d7r h LYS 214 Cb 0.00 -0.05 -0.03 0.00 -0.60 0.00 0.00 32.23 31.54 3d7r h LYS 214 CO 0.00 0.25 0.26 2.35 -3.45 0.00 0.00 179.45 178.86 3d7r h TRP 215 N 0.22 1.20 0.00 1.91 7.01 -1.70 -3.00 115.95 121.60 3d7r h TRP 215 Ca 0.07 -0.11 -0.03 0.00 2.11 0.00 0.00 58.89 60.93 3d7r h TRP 215 Cb 0.05 -0.35 -0.00 0.00 -2.10 0.00 0.00 29.16 26.76 3d7r h TRP 215 CO -0.04 0.94 -0.15 0.00 -2.79 0.00 0.00 178.44 176.40 3d7r h ALA 216 N 1.13 1.32 -6.15 2.65 0.00 -1.81 -0.89 119.26 115.52 3d7r h ALA 216 Ca 0.25 -0.13 -0.44 0.00 0.00 0.00 0.00 54.91 54.58 3d7r h ALA 216 Cb 0.28 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.07 3d7r h ALA 216 CO -0.01 0.18 -0.78 -1.71 0.00 0.00 0.00 179.25 176.93 3d7r n ASN 217 N -3.73 -3.55 0.00 0.00 5.15 -1.07 -2.26 115.26 109.81 3d7r n ASN 217 Ca -0.02 -0.76 0.00 0.00 -0.60 0.00 0.00 54.58 53.20 3d7r n ASN 217 Cb 0.26 -4.12 0.00 0.00 -0.53 0.00 0.00 39.78 35.39 3d7r n ASN 217 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3d7r n GLY 218 N -1.66 2.29 3.76 8.20 0.00 -1.26 -5.08 105.19 111.43 3d7r n GLY 218 Ca -0.10 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 3d7r n GLY 218 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d7r s LEU 219 N 0.00 4.55 0.46 0.99 1.43 -0.96 -5.02 118.68 120.12 3d7r s LEU 219 Ca 0.00 2.14 -0.25 0.00 -1.03 0.00 0.00 54.13 54.99 3d7r s LEU 219 Cb 0.00 -3.68 -0.08 0.00 0.03 0.00 0.00 46.19 42.47 3d7r s LEU 219 CO 0.00 -0.07 1.35 -2.84 0.23 0.00 0.00 176.35 175.02 3d7r s PRO 220 N -1.46 3.66 0.64 1.29 0.02 -1.26 -4.85 135.00 133.03 3d7r s PRO 220 Ca 0.45 2.25 0.36 0.00 0.02 0.00 0.00 61.00 64.07 3d7r s PRO 220 Cb -0.29 -2.58 2.01 0.00 0.02 0.00 0.00 34.50 33.66 3d7r s PRO 220 CO 0.37 -0.78 2.21 -0.07 -0.33 0.00 0.00 177.00 178.40 3d7r h LEU 221 N 2.22 0.00 0.00 -5.54 3.38 -1.98 -1.07 115.31 112.32 3d7r h LEU 221 Ca -0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3d7r h LEU 221 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 3d7r h LEU 221 CO 0.61 0.00 -0.07 0.35 0.09 0.00 0.00 178.44 179.42 3d7r n THR 222 N -3.36 0.19 -1.59 0.22 -2.24 -1.26 -3.82 114.28 102.42 3d7r n THR 222 Ca -0.02 -0.10 -0.51 0.00 -2.27 0.00 0.00 64.05 61.16 3d7r n THR 222 Cb 0.19 -0.45 -0.05 0.00 -2.10 0.00 0.00 70.33 67.92 3d7r n THR 222 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3d7r n ASP 223 N -1.75 1.66 0.30 3.42 2.03 -0.41 -4.66 116.55 117.14 3d7r n ASP 223 Ca 0.06 1.12 0.17 0.00 0.52 0.00 0.00 54.79 56.67 3d7r n ASP 223 Cb 0.37 -1.22 0.99 0.00 -0.72 0.00 0.00 41.12 40.54 3d7r n ASP 223 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 3d7r h LYS 224 N 4.27 0.00 0.00 -0.67 2.10 -1.87 0.30 116.57 120.71 3d7r h LYS 224 Ca -0.46 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.12 3d7r h LYS 224 Cb 1.33 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.65 3d7r h LYS 224 CO 0.76 0.00 -0.34 0.00 -2.00 0.00 0.00 179.45 177.87 3d7r h ARG 225 N 0.00 0.00 0.08 0.07 3.08 -1.95 -2.94 114.38 112.71 3d7r h ARG 225 Ca 0.01 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.72 3d7r h ARG 225 Cb 0.08 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 3d7r h ARG 225 CO -0.00 0.34 -1.88 -0.89 -1.07 0.00 0.00 179.97 176.47 3d7r n ILE 226 N -3.50 1.68 -3.87 2.04 5.41 -0.19 -4.66 119.36 116.27 3d7r n ILE 226 Ca -0.00 -0.48 -0.31 0.00 1.00 0.00 0.00 62.75 62.97 3d7r n ILE 226 Cb 0.50 -1.79 -0.12 0.00 -0.71 0.00 0.00 39.64 37.51 3d7r n ILE 226 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 3d7r s SER 227 N -6.97 4.84 0.00 4.38 0.01 -0.08 -4.53 113.70 111.34 3d7r s SER 227 Ca -0.26 -3.45 0.07 0.00 1.31 0.00 0.00 55.95 53.62 3d7r s SER 227 Cb 0.07 -1.70 0.29 0.00 0.21 0.00 0.00 66.02 64.89 3d7r s SER 227 CO 0.70 -0.18 1.19 -0.81 0.41 0.00 0.00 173.24 174.55 3d7r n PRO 228 N 2.56 0.01 0.16 12.44 -0.04 -1.11 -1.43 135.00 147.59 3d7r n PRO 228 Ca 0.14 0.36 0.18 0.00 -0.04 0.00 0.00 63.50 64.14 3d7r n PRO 228 Cb 0.34 -1.50 0.79 0.00 -0.04 0.00 0.00 33.50 33.09 3d7r n PRO 228 CO 0.00 0.00 0.00 0.97 -0.04 0.00 0.00 175.50 176.43 3d7r h ILE 229 N 0.00 0.49 -0.03 0.52 2.10 -1.74 0.41 117.51 119.26 3d7r h ILE 229 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 3d7r h ILE 229 Cb 0.11 0.79 0.00 0.00 -1.09 0.00 0.00 36.82 36.62 3d7r h ILE 229 CO 0.00 0.00 0.00 0.59 -1.08 0.00 0.00 178.15 177.66 3d7r n ASN 230 N -3.86 1.85 -2.94 2.19 3.02 -0.52 -4.98 115.26 110.02 3d7r n ASN 230 Ca 0.04 -1.62 -0.10 0.00 -0.03 0.00 0.00 54.58 52.87 3d7r n ASN 230 Cb 0.41 -0.01 0.05 0.00 -0.61 0.00 0.00 39.78 39.63 3d7r n ASN 230 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3d7r n GLY 231 N 1.22 0.29 3.75 7.41 0.00 0.13 -4.78 105.19 113.21 3d7r n GLY 231 Ca 0.18 -1.92 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 3d7r n GLY 231 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d7r s THR 232 N -1.29 2.55 -0.09 2.61 2.01 -1.26 -4.93 115.64 115.23 3d7r s THR 232 Ca 0.27 0.47 -0.05 0.00 0.31 0.00 0.00 61.69 62.69 3d7r s THR 232 Cb -0.01 -3.30 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 3d7r s THR 232 CO 0.18 0.08 -0.12 -0.38 -0.69 0.00 0.00 174.62 173.68 3d7r n ILE 233 N 2.19 0.55 -1.70 1.82 2.08 -1.26 -4.87 119.36 118.17 3d7r n ILE 233 Ca 0.07 -0.12 -0.42 0.00 0.56 0.00 0.00 62.75 62.83 3d7r n ILE 233 Cb 0.40 -1.64 -0.03 0.00 -0.75 0.00 0.00 39.64 37.62 3d7r n ILE 233 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 3d7r s GLU 234 N -2.18 4.14 0.00 0.38 2.02 -1.26 -2.32 118.70 119.48 3d7r s GLU 234 Ca -0.13 2.59 0.00 0.00 0.02 0.00 0.00 54.97 57.45 3d7r s GLU 234 Cb 0.05 -4.00 0.00 0.00 0.10 0.00 0.00 34.13 30.28 3d7r s GLU 234 CO 0.17 -0.92 0.00 0.41 0.02 0.00 0.00 175.26 174.94 3d7r n GLY 235 N 4.44 0.33 3.73 -1.39 0.00 -1.26 -5.07 105.19 105.97 3d7r n GLY 235 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 3d7r n GLY 235 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d7r s LEU 236 N 0.00 3.46 0.94 0.99 1.43 -0.98 -5.02 118.68 119.50 3d7r s LEU 236 Ca 0.00 2.50 -0.12 0.00 -1.03 0.00 0.00 54.13 55.48 3d7r s LEU 236 Cb 0.00 -4.61 0.15 0.00 0.03 0.00 0.00 46.19 41.77 3d7r s LEU 236 CO 0.00 -2.11 1.11 -2.16 0.23 0.00 0.00 176.35 173.42 3d7r s PRO 237 N -3.60 0.94 0.21 1.29 0.04 -1.26 -4.91 135.00 127.71 3d7r s PRO 237 Ca 0.79 0.46 -0.32 0.00 0.04 0.00 0.00 61.00 61.97 3d7r s PRO 237 Cb -0.33 -1.80 -0.14 0.00 0.04 0.00 0.00 34.50 32.26 3d7r s PRO 237 CO 0.42 -2.37 1.29 -2.30 0.04 0.00 0.00 177.00 174.08 3d7r n PRO 238 N -3.91 1.63 -4.82 0.56 -0.02 -1.26 -4.72 135.00 122.45 3d7r n PRO 238 Ca 0.06 0.58 -0.33 0.00 -2.02 0.00 0.00 63.50 61.79 3d7r n PRO 238 Cb 0.58 -2.16 -0.13 0.00 -0.02 0.00 0.00 33.50 31.77 3d7r n PRO 238 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3d7r s VAL 239 N -0.11 3.17 0.23 -1.45 1.01 -0.87 -1.34 120.40 121.03 3d7r s VAL 239 Ca 0.71 -0.67 0.06 0.00 0.00 0.00 0.00 61.98 62.08 3d7r s VAL 239 Cb -0.74 -2.27 -0.05 0.00 0.00 0.00 0.00 36.38 33.32 3d7r s VAL 239 CO 0.51 0.58 -0.09 -0.31 0.00 0.00 0.00 175.10 175.78 3d7r s TYR 240 N -0.50 1.75 -0.30 5.22 2.02 -0.12 -1.20 117.35 124.22 3d7r s TYR 240 Ca 0.07 -0.68 -0.21 0.00 -0.37 0.00 0.00 57.07 55.88 3d7r s TYR 240 Cb -0.12 -0.92 0.19 0.00 -0.40 0.00 0.00 41.96 40.72 3d7r s TYR 240 CO 0.02 0.25 1.31 -0.06 -1.57 0.00 0.00 175.55 175.50 3d7r s PHE 242 N -3.07 -0.13 0.24 2.71 0.08 0.46 -0.78 117.98 117.49 3d7r s PHE 242 Ca 0.25 0.28 -0.22 0.00 0.12 0.00 0.00 56.93 57.37 3d7r s PHE 242 Cb 0.02 0.28 0.05 0.00 -0.57 0.00 0.00 43.02 42.80 3d7r s PHE 242 CO 0.08 -0.06 0.85 0.20 -0.10 0.00 0.00 175.22 176.19 3d7r s GLY 243 N 0.56 -0.04 0.23 4.36 0.00 -0.97 0.53 107.32 111.98 3d7r s GLY 243 Ca -0.00 -0.23 0.11 0.00 0.00 0.00 0.00 44.72 44.59 3d7r s GLY 243 CO -0.13 0.17 -0.14 -0.32 0.00 0.00 0.00 173.10 172.68 3d7r s GLY 244 N -3.00 1.76 0.08 0.20 0.00 -1.26 -0.86 107.32 104.23 3d7r s GLY 244 Ca 0.13 -1.67 0.26 0.00 0.00 0.00 0.00 44.72 43.45 3d7r s GLY 244 CO 0.06 -1.72 1.83 0.61 0.00 0.00 0.00 173.10 173.87 3d7r n GLY 245 N -0.29 -1.51 2.03 0.20 0.00 -0.11 -3.61 105.19 101.90 3d7r n GLY 245 Ca -0.09 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 3d7r n GLY 245 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d7r n ARG 246 N -1.78 3.21 0.00 1.61 1.74 -1.24 -4.96 116.66 115.24 3d7r n ARG 246 Ca 0.06 -3.07 0.00 0.00 -0.77 0.00 0.00 57.85 54.07 3d7r n ARG 246 Cb 0.35 -2.19 0.00 0.00 -1.02 0.00 0.00 32.46 29.60 3d7r n ARG 246 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 3d7r n GLU 247 N -0.50 2.38 -0.03 5.56 0.28 -1.24 -3.77 120.64 123.32 3d7r n GLU 247 Ca 0.46 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.46 3d7r n GLU 247 Cb 1.46 0.00 0.00 0.00 1.43 0.00 0.00 31.44 34.33 3d7r n GLU 247 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 3d7r n THR 249 N 0.00 0.00 -0.07 3.84 -2.24 -1.26 -4.68 114.28 109.87 3d7r n THR 249 Ca 0.00 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 3d7r n THR 249 Cb 0.00 -0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.16 3d7r n THR 249 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 3d7r h HIS 250 N 0.00 0.35 -0.80 4.78 2.76 -1.93 -2.42 115.15 117.89 3d7r h HIS 250 Ca 0.00 -0.03 0.13 0.00 -2.20 0.00 0.00 60.37 58.27 3d7r h HIS 250 Cb 0.00 -0.11 -0.09 0.00 1.55 0.00 0.00 27.41 28.77 3d7r h HIS 250 CO 0.00 0.39 0.40 -1.35 -1.30 0.00 0.00 177.93 176.07 3d7r h PRO 251 N 0.22 0.59 -1.63 5.26 0.11 -1.90 -1.26 132.00 133.39 3d7r h PRO 251 Ca 0.08 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.15 3d7r h PRO 251 Cb 0.18 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.16 3d7r h PRO 251 CO -0.01 0.39 0.00 -0.25 -0.21 0.00 0.00 178.00 177.92 3d7r n ASP 252 N -4.88 0.25 0.00 -2.05 8.00 -0.91 -0.80 116.55 116.16 3d7r n ASP 252 Ca 0.15 -0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.46 3d7r n ASP 252 Cb 0.38 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 3d7r n ASP 252 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3d7r n LYS 254 N 0.88 0.00 -0.05 -1.24 4.76 -0.47 -0.46 118.16 121.57 3d7r n LYS 254 Ca 0.00 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.33 3d7r n LYS 254 Cb 0.04 0.00 -0.05 0.00 -1.84 0.00 0.00 35.03 33.19 3d7r n LYS 254 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3d7r h LEU 255 N 0.00 0.24 -0.61 -0.35 5.85 -1.22 -1.67 115.31 117.55 3d7r h LEU 255 Ca 0.00 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.62 3d7r h LEU 255 Cb 0.00 -0.06 -0.06 0.00 0.37 0.00 0.00 40.66 40.91 3d7r h LEU 255 CO 0.00 0.34 0.31 0.15 -0.34 0.00 0.00 178.44 178.90 3d7r h PHE 256 N 0.13 0.57 -0.67 1.25 3.57 -1.03 -2.37 116.94 118.40 3d7r h PHE 256 Ca 0.06 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.62 3d7r h PHE 256 Cb 0.17 -0.17 -0.05 0.00 2.79 0.00 0.00 35.95 38.70 3d7r h PHE 256 CO -0.01 0.25 0.41 1.49 -2.23 0.00 0.00 178.31 178.21 3d7r h GLU 257 N 0.58 0.76 -5.02 1.11 4.81 -1.76 -3.42 114.58 111.64 3d7r h GLU 257 Ca 0.28 -0.05 -0.43 0.00 -0.13 0.00 0.00 59.36 59.04 3d7r h GLU 257 Cb 0.22 -0.17 0.11 0.00 0.63 0.00 0.00 28.75 29.53 3d7r h GLU 257 CO -0.20 0.50 1.00 1.04 -0.73 0.00 0.00 179.01 180.62 3d7r n GLN 258 N -4.71 0.05 0.00 1.92 1.13 -0.65 -4.64 117.38 110.48 3d7r n GLN 258 Ca 0.07 -1.21 0.00 0.00 -1.94 0.00 0.00 57.00 53.92 3d7r n GLN 258 Cb 0.11 -2.91 0.00 0.00 0.11 0.00 0.00 30.24 27.54 3d7r n GLN 258 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3d7r n LEU 261 N 12.10 0.00 -0.24 1.08 4.77 -1.26 -4.63 117.00 128.82 3d7r n LEU 261 Ca 0.45 0.00 0.09 0.00 -0.03 0.00 0.00 56.01 56.52 3d7r n LEU 261 Cb 0.43 0.00 0.34 0.00 -2.33 0.00 0.00 43.42 41.87 3d7r n LEU 261 CO 1.03 0.00 1.22 -0.61 -1.33 0.00 0.00 177.39 177.70 3d7r h GLN 262 N 0.00 0.75 -0.58 3.23 4.15 -1.93 -0.88 115.11 119.85 3d7r h GLN 262 Ca 0.00 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.37 3d7r h GLN 262 Cb 0.00 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 27.52 3d7r h GLN 262 CO 0.00 0.50 0.00 0.72 -1.93 0.00 0.00 178.83 178.12 3d7r n HIS 263 N -4.52 0.88 -3.91 3.99 8.25 -1.26 -4.93 115.22 113.73 3d7r n HIS 263 Ca 0.14 -0.35 -0.28 0.00 -0.26 0.00 0.00 57.72 56.97 3d7r n HIS 263 Cb 0.33 -0.16 0.01 0.00 1.12 0.00 0.00 29.99 31.30 3d7r n HIS 263 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3d7r n HIS 264 N 0.60 -2.00 -4.14 4.41 8.25 -0.33 -4.90 115.22 117.11 3d7r n HIS 264 Ca 0.15 0.84 -0.34 0.00 -0.26 0.00 0.00 57.72 58.11 3d7r n HIS 264 Cb 0.57 -3.91 -0.11 0.00 1.12 0.00 0.00 29.99 27.66 3d7r n HIS 264 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3d7r s GLN 265 N -6.48 3.79 -0.08 -0.41 -1.52 -1.26 -5.03 119.66 108.67 3d7r s GLN 265 Ca 0.37 -0.44 -0.35 0.00 -1.95 0.00 0.00 55.36 52.98 3d7r s GLN 265 Cb -0.19 -3.10 -0.13 0.00 -0.22 0.00 0.00 33.01 29.38 3d7r s GLN 265 CO 0.85 0.19 1.81 0.98 -0.25 0.00 0.00 175.29 178.87 3d7r n TYR 266 N 3.75 2.26 -3.77 0.91 9.36 -1.26 -4.25 117.16 124.17 3d7r n TYR 266 Ca -0.17 0.12 -0.14 0.00 3.32 0.00 0.00 57.90 61.03 3d7r n TYR 266 Cb 0.52 -2.61 -0.15 0.00 -0.63 0.00 0.00 39.34 36.47 3d7r n TYR 266 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 3d7r s ILE 267 N 3.51 -0.05 -0.20 2.97 2.07 -1.26 -2.06 121.20 126.19 3d7r s ILE 267 Ca 0.92 0.17 -0.04 0.00 -1.41 0.00 0.00 60.65 60.28 3d7r s ILE 267 Cb -0.75 -0.16 -0.02 0.00 0.13 0.00 0.00 42.46 41.66 3d7r s ILE 267 CO 0.52 0.07 -0.02 -1.61 -1.91 0.00 0.00 174.94 171.99 3d7r s GLU 268 N 0.98 3.54 -0.26 3.50 2.02 -0.34 -5.00 118.70 123.13 3d7r s GLU 268 Ca -0.08 -0.56 -0.03 0.00 0.02 0.00 0.00 54.97 54.32 3d7r s GLU 268 Cb -0.11 -3.03 0.02 0.00 0.10 0.00 0.00 34.13 31.11 3d7r s GLU 268 CO -0.04 -0.02 -0.01 0.12 0.02 0.00 0.00 175.26 175.33 3d7r s PHE 269 N 1.07 3.09 -0.53 1.61 5.36 -1.26 -4.28 117.98 123.04 3d7r s PHE 269 Ca 0.02 -1.34 -0.18 0.00 -0.96 0.00 0.00 56.93 54.47 3d7r s PHE 269 Cb -0.14 -2.13 0.08 0.00 -0.34 0.00 0.00 43.02 40.49 3d7r s PHE 269 CO 0.01 -0.67 0.61 0.71 -1.46 0.00 0.00 175.22 174.42 3d7r s TYR 270 N 1.39 3.07 -0.28 10.12 2.02 -1.26 -5.02 117.35 127.38 3d7r s TYR 270 Ca 0.01 -0.80 -0.07 0.00 -0.37 0.00 0.00 57.07 55.85 3d7r s TYR 270 Cb -0.17 -3.67 0.00 0.00 -0.40 0.00 0.00 41.96 37.72 3d7r s TYR 270 CO -0.02 -1.09 0.07 0.34 -1.57 0.00 0.00 175.55 173.28 3d7r s ASP 271 N 3.07 5.08 -0.54 2.29 -1.08 -1.26 -2.30 116.67 121.94 3d7r s ASP 271 Ca 0.11 -0.60 -0.14 0.00 -0.52 0.00 0.00 52.55 51.40 3d7r s ASP 271 Cb -0.22 -1.88 0.13 0.00 -1.46 0.00 0.00 42.92 39.49 3d7r s ASP 271 CO 0.08 -0.16 0.48 -0.31 0.52 0.00 0.00 175.17 175.79 3d7r s TYR 272 N 1.52 3.33 0.40 -5.34 2.02 -0.04 -4.97 117.35 114.27 3d7r s TYR 272 Ca 0.03 -1.50 0.16 0.00 -0.37 0.00 0.00 57.07 55.39 3d7r s TYR 272 Cb -0.17 -3.72 1.02 0.00 -0.40 0.00 0.00 41.96 38.70 3d7r s TYR 272 CO 0.02 -1.01 1.85 -1.35 -1.57 0.00 0.00 175.55 173.49 3d7r h PRO 273 N 8.69 0.46 -2.31 -1.71 0.11 -1.92 -0.27 132.00 135.04 3d7r h PRO 273 Ca -0.25 -0.03 -0.80 0.00 0.11 0.00 0.00 66.00 65.03 3d7r h PRO 273 Cb 1.09 -0.10 -0.28 0.00 0.11 0.00 0.00 31.00 31.82 3d7r h PRO 273 CO 0.97 0.30 0.96 1.63 -0.21 0.00 0.00 178.00 181.66 3d7r n LYS 274 N -4.54 5.30 -4.30 1.05 5.02 -1.26 -2.87 118.16 116.56 3d7r n LYS 274 Ca 0.19 -4.67 -0.16 0.00 -2.02 0.00 0.00 58.31 51.65 3d7r n LYS 274 Cb 0.66 -2.47 -0.10 0.00 -0.02 0.00 0.00 35.03 33.11 3d7r n LYS 274 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3d7r s VAL 276 N -4.21 0.36 0.06 -0.18 -7.23 -1.26 -4.72 120.40 103.22 3d7r s VAL 276 Ca 0.39 -2.00 -0.35 0.00 -1.81 0.00 0.00 61.98 58.21 3d7r s VAL 276 Cb 0.18 -2.56 -0.14 0.00 0.56 0.00 0.00 36.38 34.42 3d7r s VAL 276 CO -0.11 0.00 1.64 1.57 -0.31 0.00 0.00 175.10 177.89 3d7r n HIS 277 N -0.47 2.17 -2.05 2.82 -0.00 -1.26 -2.23 115.22 114.19 3d7r n HIS 277 Ca 0.01 0.26 -0.10 0.00 0.46 0.00 0.00 57.72 58.34 3d7r n HIS 277 Cb 0.66 -2.54 -0.01 0.00 -0.12 0.00 0.00 29.99 27.97 3d7r n HIS 277 CO 0.00 0.00 0.00 -3.47 0.46 0.00 0.00 176.34 173.33 3d7r n ASP 278 N 4.28 -3.60 -0.25 0.26 2.03 -1.26 -4.89 116.55 113.12 3d7r n ASP 278 Ca 0.19 0.03 0.17 0.00 0.52 0.00 0.00 54.79 55.71 3d7r n ASP 278 Cb 0.27 -2.72 0.48 0.00 -0.72 0.00 0.00 41.12 38.43 3d7r n ASP 278 CO 0.00 0.00 0.00 2.19 -1.92 0.00 0.00 177.20 177.47 3d7r h PHE 279 N 0.00 0.61 0.00 -0.67 -5.15 -1.86 -2.07 116.94 107.80 3d7r h PHE 279 Ca -0.24 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.55 3d7r h PHE 279 Cb 1.10 -0.19 0.00 0.00 0.22 0.00 0.00 35.95 37.09 3d7r h PHE 279 CO 0.28 0.17 0.00 -2.30 -2.00 0.00 0.00 178.31 174.46 3d7r n PRO 280 N -4.53 0.09 0.25 6.09 -0.02 -1.26 -1.26 135.00 134.36 3d7r n PRO 280 Ca 0.19 0.58 0.15 0.00 -2.02 0.00 0.00 63.50 62.40 3d7r n PRO 280 Cb 0.65 -1.79 0.46 0.00 -0.02 0.00 0.00 33.50 32.79 3d7r n PRO 280 CO 0.00 0.00 0.00 -0.84 1.98 0.00 0.00 175.50 176.64 3d7r h ILE 281 N 0.00 0.00 -3.66 4.25 3.07 -1.70 -3.45 117.51 116.02 3d7r h ILE 281 Ca 0.00 -0.70 -0.51 0.00 1.55 0.00 0.00 64.86 65.20 3d7r h ILE 281 Cb 0.01 1.70 -0.03 0.00 -0.27 0.00 0.00 36.82 38.23 3d7r h ILE 281 CO 0.00 0.00 0.22 -0.31 -1.05 0.00 0.00 178.15 177.01 3d7r s TYR 282 N -3.45 3.80 -1.31 0.16 2.02 -0.39 -4.85 117.35 113.33 3d7r s TYR 282 Ca 0.04 1.64 -0.15 0.00 -0.37 0.00 0.00 57.07 58.23 3d7r s TYR 282 Cb 0.07 -2.80 -0.01 0.00 -0.40 0.00 0.00 41.96 38.82 3d7r s TYR 282 CO 0.59 0.38 2.22 -0.35 -1.57 0.00 0.00 175.55 176.83 3d7r n PRO 283 N 1.09 2.61 -4.25 -1.71 -0.04 -1.26 -4.65 135.00 126.79 3d7r n PRO 283 Ca -0.02 -2.38 -0.15 0.00 -0.04 0.00 0.00 63.50 60.90 3d7r n PRO 283 Cb 0.49 -3.15 -0.10 0.00 -0.04 0.00 0.00 33.50 30.70 3d7r n PRO 283 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 3d7r s ILE 284 N 3.50 1.23 0.36 0.52 -4.36 -1.26 -5.06 121.20 116.13 3d7r s ILE 284 Ca 0.51 -1.99 0.04 0.00 -0.26 0.00 0.00 60.65 58.95 3d7r s ILE 284 Cb 0.14 -1.78 0.28 0.00 1.25 0.00 0.00 42.46 42.35 3d7r s ILE 284 CO -0.04 -0.67 1.99 0.03 0.24 0.00 0.00 174.94 176.49 3d7r h ARG 285 N 2.93 0.78 -0.40 0.37 3.08 -2.01 -2.01 114.38 117.12 3d7r h ARG 285 Ca -0.37 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.61 3d7r h ARG 285 Cb 1.19 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 31.05 3d7r h ARG 285 CO 0.61 0.52 0.17 1.96 -1.07 0.00 0.00 179.97 182.15 3d7r h GLN 286 N 0.80 0.57 -0.35 0.04 7.50 -1.97 -0.56 115.11 121.14 3d7r h GLN 286 Ca 0.26 -0.07 -0.01 0.00 0.50 0.00 0.00 58.65 59.33 3d7r h GLN 286 Cb 0.04 -0.11 -0.02 0.00 0.05 0.00 0.00 27.48 27.44 3d7r h GLN 286 CO -0.07 0.46 0.18 1.03 -1.50 0.00 0.00 178.83 178.93 3d7r h SER 287 N 0.57 0.44 -0.51 1.46 0.87 -1.63 0.46 113.55 115.21 3d7r h SER 287 Ca 0.14 -0.11 -0.06 0.00 -1.23 0.00 0.00 61.79 60.53 3d7r h SER 287 Cb 0.10 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 61.92 3d7r h SER 287 CO -0.02 0.42 0.09 0.45 -0.53 0.00 0.00 176.83 177.25 3d7r h HIS 288 N 0.43 0.94 -0.64 2.24 3.86 -1.18 0.09 115.15 120.89 3d7r h HIS 288 Ca 0.12 -0.11 -0.05 0.00 -1.16 0.00 0.00 60.37 59.17 3d7r h HIS 288 Cb 0.09 -0.27 -0.03 0.00 1.06 0.00 0.00 27.41 28.26 3d7r h HIS 288 CO -0.02 0.81 0.21 -0.22 0.86 0.00 0.00 177.93 179.57 3d7r h LYS 289 N 0.85 0.98 -0.59 2.45 3.64 -0.93 -0.99 116.57 121.98 3d7r h LYS 289 Ca 0.18 -0.20 -0.05 0.00 -1.27 0.00 0.00 60.65 59.30 3d7r h LYS 289 Cb 0.38 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 3d7r h LYS 289 CO 0.01 0.85 0.17 0.00 -2.27 0.00 0.00 179.45 178.21 3d7r h ALA 290 N 1.08 0.77 -0.68 5.00 0.00 -0.43 -1.39 119.26 123.62 3d7r h ALA 290 Ca 0.21 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.89 3d7r h ALA 290 Cb 0.27 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 3d7r h ALA 290 CO -0.01 0.45 0.35 0.82 0.00 0.00 0.00 179.25 180.87 3d7r h ILE 291 N 0.84 1.22 -0.67 0.00 2.04 -0.83 -0.69 117.51 119.41 3d7r h ILE 291 Ca 0.19 -0.57 -0.03 0.00 1.00 0.00 0.00 64.86 65.44 3d7r h ILE 291 Cb 0.31 0.36 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 3d7r h ILE 291 CO -0.00 0.24 0.29 0.11 0.00 0.00 0.00 178.15 178.79 3d7r h LYS 292 N 0.93 0.97 -0.69 2.37 1.57 -0.91 -0.74 116.57 120.07 3d7r h LYS 292 Ca 0.24 -0.15 -0.07 0.00 -1.87 0.00 0.00 60.65 58.79 3d7r h LYS 292 Cb 0.07 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.18 3d7r h LYS 292 CO -0.03 0.78 0.14 1.96 -0.57 0.00 0.00 179.45 181.72 3d7r h GLN 293 N 0.96 1.12 -0.01 3.15 4.20 -0.74 0.36 115.11 124.14 3d7r h GLN 293 Ca 0.23 -0.28 0.02 0.00 0.06 0.00 0.00 58.65 58.68 3d7r h GLN 293 Cb 0.16 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.77 3d7r h GLN 293 CO -0.02 1.00 -0.11 0.82 -0.67 0.00 0.00 178.83 179.85 3d7r h ILE 294 N 1.05 0.73 -0.44 2.54 2.04 -0.72 -1.28 117.51 121.43 3d7r h ILE 294 Ca 0.21 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.09 3d7r h ILE 294 Cb 0.41 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 3d7r h ILE 294 CO 0.01 0.00 0.26 0.00 0.00 0.00 0.00 178.15 178.42 3d7r h ALA 295 N 0.81 0.56 -0.62 1.87 0.00 -0.83 0.75 119.26 121.80 3d7r h ALA 295 Ca 0.04 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 3d7r h ALA 295 Cb 0.23 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3d7r h ALA 295 CO -0.12 -0.06 0.05 -0.22 0.00 0.00 0.00 179.25 178.90 3d7r h LYS 296 N 0.52 1.04 0.00 0.00 3.11 -0.91 -3.27 116.57 117.06 3d7r h LYS 296 Ca 0.18 -0.30 -0.20 0.00 -2.81 0.00 0.00 60.65 57.52 3d7r h LYS 296 Cb 0.02 -0.11 -0.03 0.00 -1.00 0.00 0.00 32.23 31.11 3d7r h LYS 296 CO -0.09 0.99 -1.12 0.66 -2.81 0.00 0.00 179.45 177.08 3d7r h SER 297 N 0.97 0.00 0.13 4.20 4.64 -0.86 -3.38 113.55 119.25 3d7r h SER 297 Ca 0.18 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.49 3d7r h SER 297 Cb 0.49 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 3d7r h SER 297 CO 0.02 0.82 -0.08 -0.29 -0.87 0.00 0.00 176.83 176.43 3d7r h ILE 298 N 0.00 0.81 -0.49 0.95 2.10 -0.91 -1.56 117.51 118.40 3d7r h ILE 298 Ca -0.10 -0.30 0.00 0.00 1.08 0.00 0.00 64.86 65.54 3d7r h ILE 298 Cb 1.71 1.17 0.00 0.00 -1.09 0.00 0.00 36.82 38.61 3d7r h ILE 298 CO 0.09 0.08 0.00 0.47 -1.08 0.00 0.00 178.15 177.71 3d7r n ASP 299 N -4.08 3.26 -4.63 2.19 8.00 -1.26 -4.96 116.55 115.07 3d7r n ASP 299 Ca -0.03 -1.97 -0.44 0.00 0.71 0.00 0.00 54.79 53.06 3d7r n ASP 299 Cb 0.17 -0.32 -0.02 0.00 -0.02 0.00 0.00 41.12 40.93 3d7r n ASP 299 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3d7r n GLU 300 N 1.31 1.65 -2.04 -1.24 1.02 -0.59 -4.92 120.64 115.84 3d7r n GLU 300 Ca 0.20 0.58 -0.42 0.00 -0.02 0.00 0.00 57.16 57.50 3d7r n GLU 300 Cb 0.54 -2.06 -0.03 0.00 -0.02 0.00 0.00 31.44 29.88 3d7r n GLU 300 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3d7r s ASP 301 N -0.34 6.69 -0.50 1.62 -0.00 -1.26 -4.96 116.67 117.91 3d7r s ASP 301 Ca 0.60 2.40 -0.24 0.00 -0.00 0.00 0.00 52.55 55.30 3d7r s ASP 301 Cb -0.67 -2.57 0.03 0.00 -0.00 0.00 0.00 42.92 39.72 3d7r s ASP 301 CO 0.59 -0.80 0.89 -0.69 -0.00 0.00 0.00 175.17 175.16 3d7r s VAL 302 N 2.08 4.49 -0.85 -1.27 1.01 -1.26 -4.85 120.40 119.75 3d7r s VAL 302 Ca 0.69 0.42 0.07 0.00 0.00 0.00 0.00 61.98 63.16 3d7r s VAL 302 Cb -0.38 -4.45 0.04 0.00 0.00 0.00 0.00 36.38 31.59 3d7r s VAL 302 CO 0.30 -0.93 0.68 0.35 0.00 0.00 0.00 175.10 175.50 3d7r n THR 303 N 6.23 0.00 1.30 3.92 -2.24 -1.26 -5.17 114.28 117.06 3d7r n THR 303 Ca 0.03 -0.48 0.10 0.00 -2.27 0.00 0.00 64.05 61.43 3d7r n THR 303 Cb 0.48 1.14 0.62 0.00 -2.10 0.00 0.00 70.33 70.46 3d7r n THR 303 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17