#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 1.25 -0.40 2.46 3.04 -2.03 -1.46 116.25 119.12 3d7r h VAL 10 Ca 0.00 -1.13 -0.00 0.00 -1.01 0.00 0.00 66.70 64.56 3d7r h VAL 10 Cb 0.00 1.05 -0.02 0.00 -2.01 0.00 0.00 31.29 30.31 3d7r h VAL 10 CO 0.00 0.38 0.25 0.58 -1.01 0.00 0.00 177.57 177.77 3d7r h VAL 11 N 0.66 1.12 -0.13 1.51 2.07 -1.98 -2.64 116.25 116.86 3d7r h VAL 11 Ca 0.11 -0.26 -0.19 0.00 0.82 0.00 0.00 66.70 67.18 3d7r h VAL 11 Cb 0.56 0.58 -0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3d7r h VAL 11 CO 0.03 0.12 -0.71 0.78 0.02 0.00 0.00 177.57 177.82 3d7r h ASN 12 N 0.53 0.67 -0.78 0.57 2.35 -1.95 -2.25 115.58 114.71 3d7r h ASN 12 Ca 0.14 -0.42 0.04 0.00 -0.55 0.00 0.00 56.30 55.52 3d7r h ASN 12 Cb -0.02 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.11 3d7r h ASN 12 CO -0.03 1.18 0.51 0.50 -1.65 0.00 0.00 177.43 177.94 3d7r h LYS 13 N 0.40 0.90 -0.16 0.81 3.64 -1.12 -2.90 116.57 118.14 3d7r h LYS 13 Ca -0.03 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.29 3d7r h LYS 13 Cb 1.29 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 3d7r h LYS 13 CO 0.13 0.60 -0.02 0.66 -2.27 0.00 0.00 179.45 178.56 3d7r n TYR 14 N -4.46 0.57 -1.68 1.91 4.01 -1.01 -5.05 117.16 111.46 3d7r n TYR 14 Ca 0.10 -0.98 -0.45 0.00 -0.16 0.00 0.00 57.90 56.41 3d7r n TYR 14 Cb 0.14 -0.26 -0.04 0.00 -0.31 0.00 0.00 39.34 38.87 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 -0.92 3.52 -4.27 7.72 7.94 -0.85 -4.98 117.00 125.16 3d7r n LEU 15 Ca 0.20 1.03 -0.36 0.00 -1.11 0.00 0.00 56.01 55.77 3d7r n LEU 15 Cb 0.80 -1.46 -0.13 0.00 0.53 0.00 0.00 43.42 43.16 3d7r n LEU 15 CO 0.10 -0.07 -0.32 -0.76 -1.11 0.00 0.00 177.39 175.23 3d7r s LEU 16 N 2.05 3.75 0.41 -1.96 1.43 -1.26 -4.99 118.68 118.11 3d7r s LEU 16 Ca 0.82 -0.91 0.08 0.00 -1.03 0.00 0.00 54.13 53.09 3d7r s LEU 16 Cb -0.61 -1.79 0.85 0.00 0.03 0.00 0.00 46.19 44.67 3d7r s LEU 16 CO 0.40 -0.21 2.01 0.45 0.23 0.00 0.00 176.35 179.23 3d7r h HIS 17 N 8.13 0.41 0.00 0.29 3.86 -1.98 -1.82 115.15 124.04 3d7r h HIS 17 Ca -0.29 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 3d7r h HIS 17 Cb 1.10 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 29.44 3d7r h HIS 17 CO 0.60 0.33 0.00 0.27 0.86 0.00 0.00 177.93 179.99 3d7r n ASN 18 N -4.41 0.00 -0.30 2.45 0.23 -1.26 -2.27 115.26 109.71 3d7r n ASN 18 Ca 0.01 -0.11 0.04 0.00 -0.53 0.00 0.00 54.58 53.99 3d7r n ASN 18 Cb 0.13 -0.20 0.03 0.00 -2.08 0.00 0.00 39.78 37.66 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 -1.20 0.03 -2.34 -3.83 1.74 -0.69 -5.02 116.66 105.34 3d7r n ARG 19 Ca 0.09 -0.94 -0.41 0.00 -0.77 0.00 0.00 57.85 55.82 3d7r n ARG 19 Cb 0.11 -1.14 -0.03 0.00 -1.02 0.00 0.00 32.46 30.37 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 -0.62 7.05 -0.30 0.55 0.15 -0.96 -5.06 113.70 114.51 3d7r s SER 20 Ca 0.09 2.28 -0.03 0.00 0.70 0.00 0.00 55.95 58.98 3d7r s SER 20 Cb 0.06 -2.61 0.04 0.00 -1.71 0.00 0.00 66.02 61.80 3d7r s SER 20 CO 0.09 -0.39 0.02 0.27 1.20 0.00 0.00 173.24 174.43 3d7r s ILE 21 N -0.12 3.22 0.00 6.45 -4.36 -1.26 -5.09 121.20 120.04 3d7r s ILE 21 Ca 0.53 -1.20 0.00 0.00 -0.26 0.00 0.00 60.65 59.72 3d7r s ILE 21 Cb -0.33 -2.79 0.00 0.00 1.25 0.00 0.00 42.46 40.59 3d7r s ILE 21 CO 0.38 -0.05 0.00 0.49 0.24 0.00 0.00 174.94 176.00 3d7r n PHE 23 N 4.69 0.00 0.06 1.37 3.72 -1.26 -4.05 117.46 121.99 3d7r n PHE 23 Ca -0.14 0.00 -0.15 0.00 -0.05 0.00 0.00 57.45 57.11 3d7r n PHE 23 Cb 0.45 0.00 -0.14 0.00 -0.94 0.00 0.00 39.48 38.85 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 0.21 0.00 -1.08 1.57 -2.00 -3.46 116.57 111.81 3d7r h LYS 24 Ca 0.00 -0.36 0.12 0.00 -1.87 0.00 0.00 60.65 58.54 3d7r h LYS 24 Cb 0.00 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.42 3d7r h LYS 24 CO 0.00 1.07 0.53 0.27 -0.57 0.00 0.00 179.45 180.74 3d7r n ASN 25 N -3.42 -1.83 0.09 0.86 0.23 -1.26 -5.04 115.26 104.89 3d7r n ASN 25 Ca -0.14 -2.03 0.02 0.00 -0.53 0.00 0.00 54.58 51.90 3d7r n ASN 25 Cb 1.03 2.99 0.39 0.00 -2.08 0.00 0.00 39.78 42.11 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 1.95 0.29 -0.30 0.53 3.32 -2.00 -2.60 116.42 117.62 3d7r h ASP 26 Ca -0.28 -0.05 0.02 0.00 0.02 0.00 0.00 57.03 56.73 3d7r h ASP 26 Cb 1.19 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.65 3d7r h ASP 26 CO 0.37 0.39 0.16 1.56 -1.72 0.00 0.00 179.24 180.01 3d7r h GLN 27 N 0.31 0.33 -0.59 3.56 7.50 -1.99 -0.62 115.11 123.61 3d7r h GLN 27 Ca 0.07 -0.02 0.06 0.00 0.50 0.00 0.00 58.65 59.25 3d7r h GLN 27 Cb 0.29 -0.07 -0.05 0.00 0.05 0.00 0.00 27.48 27.70 3d7r h GLN 27 CO 0.01 0.22 0.30 -0.44 -1.50 0.00 0.00 178.83 177.42 3d7r h ASP 28 N 0.34 0.43 -0.16 1.46 5.19 -1.88 -1.08 116.42 120.72 3d7r h ASP 28 Ca 0.12 0.03 0.01 0.00 -0.62 0.00 0.00 57.03 56.57 3d7r h ASP 28 Cb 0.02 -0.05 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 3d7r h ASP 28 CO -0.07 0.28 0.08 0.58 -3.12 0.00 0.00 179.24 176.99 3d7r h VAL 29 N 0.57 1.00 -0.11 -1.35 2.07 -1.20 -0.69 116.25 116.54 3d7r h VAL 29 Ca 0.26 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.75 3d7r h VAL 29 Cb 0.18 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 3d7r h VAL 29 CO -0.18 0.03 -0.03 -0.33 0.02 0.00 0.00 177.57 177.08 3d7r h GLU 30 N 0.17 0.00 -0.93 1.57 5.08 -0.91 -0.81 114.58 118.75 3d7r h GLU 30 Ca 0.06 -0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.46 3d7r h GLU 30 Cb 0.01 -0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 3d7r h GLU 30 CO -0.04 0.00 0.61 0.00 -1.00 0.00 0.00 179.01 178.58 3d7r h ARG 31 N 0.00 1.14 0.23 2.33 3.08 -1.04 -0.31 114.38 119.80 3d7r h ARG 31 Ca 0.05 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 3d7r h ARG 31 Cb 0.08 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.88 3d7r h ARG 31 CO -0.12 0.75 -0.11 0.35 -1.07 0.00 0.00 179.97 179.78 3d7r h PHE 32 N 1.17 -0.28 -1.00 3.04 3.57 -0.78 -1.04 116.94 121.62 3d7r h PHE 32 Ca 0.37 -0.01 0.06 0.00 3.53 0.00 0.00 57.97 61.92 3d7r h PHE 32 Cb 0.01 0.09 -0.06 0.00 2.79 0.00 0.00 35.95 38.78 3d7r h PHE 32 CO -0.00 -0.15 0.65 0.74 -2.23 0.00 0.00 178.31 177.32 3d7r h PHE 33 N -0.34 1.20 -0.53 0.41 0.04 -0.69 -0.03 116.94 117.01 3d7r h PHE 33 Ca -0.03 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 3d7r h PHE 33 Cb 0.26 -0.40 -0.02 0.00 2.20 0.00 0.00 35.95 37.99 3d7r h PHE 33 CO -0.05 0.64 0.22 1.88 -0.60 0.00 0.00 178.31 180.40 3d7r h TYR 34 N 1.20 0.81 -0.49 -0.55 0.05 -0.90 0.38 116.97 117.47 3d7r h TYR 34 Ca 0.42 -0.06 -0.03 0.00 0.05 0.00 0.00 58.73 59.11 3d7r h TYR 34 Cb 0.12 -0.24 -0.02 0.00 1.01 0.00 0.00 36.73 37.60 3d7r h TYR 34 CO -0.00 0.66 0.18 -0.22 -1.05 0.00 0.00 178.16 177.73 3d7r h LYS 35 N 0.72 0.75 -0.24 4.88 3.64 -0.75 -3.08 116.57 122.50 3d7r h LYS 35 Ca 0.18 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 3d7r h LYS 35 Cb 0.19 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 3d7r h LYS 35 CO -0.02 0.69 -0.24 0.00 -2.27 0.00 0.00 179.45 177.62 3d7r h ARG 36 N 0.66 0.44 -0.46 1.90 2.47 -0.76 -1.03 114.38 117.61 3d7r h ARG 36 Ca 0.16 -0.16 0.08 0.00 -1.26 0.00 0.00 59.98 58.81 3d7r h ARG 36 Cb 0.24 -0.03 -0.07 0.00 -1.65 0.00 0.00 29.97 28.46 3d7r h ARG 36 CO -0.01 0.65 0.06 1.49 0.56 0.00 0.00 179.97 182.72 3d7r h GLU 37 N 0.39 0.18 0.08 0.04 4.57 -0.84 0.60 114.58 119.61 3d7r h GLU 37 Ca 0.06 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.23 3d7r h GLU 37 Cb 0.63 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 29.18 3d7r h GLU 37 CO 0.04 0.12 -0.04 0.82 -1.18 0.00 0.00 179.01 178.77 3d7r h ILE 38 N 0.18 1.15 -0.39 2.32 1.08 -1.44 -3.20 117.51 117.22 3d7r h ILE 38 Ca 0.23 -0.94 -0.09 0.00 -0.39 0.00 0.00 64.86 63.67 3d7r h ILE 38 Cb 0.31 1.75 -0.02 0.00 -3.07 0.00 0.00 36.82 35.79 3d7r h ILE 38 CO -0.33 0.23 -0.12 -0.33 -0.69 0.00 0.00 178.15 176.91 3d7r h GLU 39 N -0.55 0.68 0.00 2.37 4.39 -0.95 -2.51 114.58 118.01 3d7r h GLU 39 Ca -0.01 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.47 3d7r h GLU 39 Cb 0.46 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.05 3d7r h GLU 39 CO 0.02 0.78 0.00 -0.91 -1.16 0.00 0.00 179.01 177.74 3d7r h ASN 40 N 0.62 0.00 1.56 1.42 2.35 -1.00 -2.76 115.58 117.76 3d7r h ASN 40 Ca 0.11 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.81 3d7r h ASN 40 Cb 0.56 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.93 3d7r h ASN 40 CO 0.04 0.00 -0.23 -0.09 -1.65 0.00 0.00 177.43 175.50 3d7r h ARG 41 N 0.00 0.00 -7.05 0.81 9.65 -1.44 -3.46 114.38 112.89 3d7r h ARG 41 Ca 0.00 0.00 -0.46 0.00 -1.10 0.00 0.00 59.98 58.42 3d7r h ARG 41 Cb 0.55 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 29.14 3d7r h ARG 41 CO 0.00 0.23 0.38 0.15 2.80 0.00 0.00 179.97 183.52 3d7r s LYS 42 N -3.22 3.99 0.29 0.20 1.02 -1.04 -4.99 119.74 115.98 3d7r s LYS 42 Ca 0.04 1.32 -0.30 0.00 0.02 0.00 0.00 55.97 57.05 3d7r s LYS 42 Cb 0.07 -2.20 -0.11 0.00 -0.52 0.00 0.00 37.83 35.06 3d7r s LYS 42 CO 0.68 -0.26 1.60 0.15 -0.92 0.00 0.00 175.35 176.61 3d7r s LYS 43 N -3.08 4.12 0.12 1.68 -0.14 -1.26 -4.95 119.74 116.23 3d7r s LYS 43 Ca 0.64 2.58 -0.30 0.00 -1.36 0.00 0.00 55.97 57.53 3d7r s LYS 43 Cb -0.15 -3.02 -0.06 0.00 -1.68 0.00 0.00 37.83 32.91 3d7r s LYS 43 CO 0.19 -0.64 1.06 -1.58 -0.76 0.00 0.00 175.35 173.62 3d7r s HIS 44 N 0.06 3.64 0.12 3.18 5.65 -1.26 -5.05 115.29 121.64 3d7r s HIS 44 Ca 0.64 1.62 0.10 0.00 0.25 0.00 0.00 55.06 57.67 3d7r s HIS 44 Cb -0.48 -3.22 -0.04 0.00 -1.18 0.00 0.00 32.58 27.66 3d7r s HIS 44 CO 0.47 -0.42 -0.24 0.15 -0.65 0.00 0.00 174.74 174.05 3d7r s LYS 45 N 0.12 1.29 0.43 2.88 1.02 -1.26 -5.12 119.74 119.09 3d7r s LYS 45 Ca 0.50 -1.28 -0.26 0.00 0.02 0.00 0.00 55.97 54.95 3d7r s LYS 45 Cb -0.27 -1.66 -0.09 0.00 -0.52 0.00 0.00 37.83 35.29 3d7r s LYS 45 CO 0.32 0.39 1.39 0.00 -0.92 0.00 0.00 175.35 176.53 3d7r n GLN 46 N 0.92 2.23 -1.68 1.68 10.64 -1.26 -4.89 117.38 125.02 3d7r n GLN 46 Ca -0.18 0.79 -0.45 0.00 -1.83 0.00 0.00 57.00 55.33 3d7r n GLN 46 Cb 0.54 -2.56 -0.03 0.00 -0.86 0.00 0.00 30.24 27.33 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 -0.01 2.15 0.30 2.61 -0.02 -1.26 -4.84 135.00 133.94 3d7r n PRO 47 Ca 0.05 0.77 0.17 0.00 -2.02 0.00 0.00 63.50 62.47 3d7r n PRO 47 Cb 0.40 -2.47 0.93 0.00 -0.02 0.00 0.00 33.50 32.34 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 4.76 0.00 -0.01 2.55 4.64 -2.04 -2.75 113.55 120.70 3d7r h SER 48 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 3d7r h SER 48 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3d7r h SER 48 CO 0.80 0.04 -0.47 0.35 -0.87 0.00 0.00 176.83 176.68 3d7r n THR 49 N -3.44 0.00 -3.08 2.95 -2.24 -1.26 -4.96 114.28 102.25 3d7r n THR 49 Ca -0.02 -0.27 -0.40 0.00 -2.27 0.00 0.00 64.05 61.09 3d7r n THR 49 Cb 0.15 1.16 -0.05 0.00 -2.10 0.00 0.00 70.33 69.49 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 -2.30 4.19 -0.40 3.22 2.96 -1.04 -5.02 118.68 120.29 3d7r s LEU 50 Ca 0.13 0.94 -0.28 0.00 -0.22 0.00 0.00 54.13 54.71 3d7r s LEU 50 Cb 0.14 -2.96 0.02 0.00 0.50 0.00 0.00 46.19 43.89 3d7r s LEU 50 CO 0.50 -0.25 1.03 0.21 -1.32 0.00 0.00 176.35 176.52 3d7r s ASN 51 N 1.09 6.71 -0.24 3.68 2.47 -1.26 -4.89 114.94 122.50 3d7r s ASN 51 Ca 0.31 0.61 -0.19 0.00 0.42 0.00 0.00 52.86 54.02 3d7r s ASN 51 Cb -0.16 -2.51 -0.03 0.00 -1.45 0.00 0.00 41.25 37.11 3d7r s ASN 51 CO 0.12 -1.00 0.57 -0.69 -3.72 0.00 0.00 177.10 172.37 3d7r s VAL 52 N 3.85 5.04 0.09 -5.21 1.01 -1.26 -4.96 120.40 118.96 3d7r s VAL 52 Ca 0.43 1.01 -0.06 0.00 0.00 0.00 0.00 61.98 63.37 3d7r s VAL 52 Cb -0.10 -3.88 -0.26 0.00 0.00 0.00 0.00 36.38 32.14 3d7r s VAL 52 CO 0.23 0.09 1.18 0.11 0.00 0.00 0.00 175.10 176.71 3d7r h LYS 53 N 7.80 0.35 -7.23 2.72 1.57 -1.95 -3.45 116.57 116.38 3d7r h LYS 53 Ca -0.29 -0.51 -0.51 0.00 -1.87 0.00 0.00 60.65 57.47 3d7r h LYS 53 Cb 1.14 0.18 0.12 0.00 0.08 0.00 0.00 32.23 33.74 3d7r h LYS 53 CO 0.75 1.21 0.35 0.00 -0.57 0.00 0.00 179.45 181.19 3d7r s ALA 54 N -2.86 2.32 0.26 3.86 0.00 -1.26 -5.00 121.76 119.08 3d7r s ALA 54 Ca -0.05 0.52 -0.29 0.00 0.00 0.00 0.00 51.96 52.14 3d7r s ALA 54 Cb 0.07 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.77 3d7r s ALA 54 CO 0.89 -1.55 1.19 -0.80 0.00 0.00 0.00 175.76 175.49 3d7r s ASN 55 N -2.72 7.06 -0.09 0.00 -0.87 0.13 -4.86 114.94 113.60 3d7r s ASN 55 Ca 0.66 2.38 0.03 0.00 -1.57 0.00 0.00 52.86 54.37 3d7r s ASN 55 Cb -0.21 -2.63 -0.01 0.00 -0.02 0.00 0.00 41.25 38.39 3d7r s ASN 55 CO 0.46 -0.33 -0.20 -0.22 -2.57 0.00 0.00 177.10 174.24 3d7r s LEU 56 N -1.13 2.33 -0.15 0.60 2.96 -1.26 -0.83 118.68 121.20 3d7r s LEU 56 Ca 0.49 -0.44 -0.03 0.00 -0.22 0.00 0.00 54.13 53.93 3d7r s LEU 56 Cb -0.35 -1.47 -0.02 0.00 0.50 0.00 0.00 46.19 44.85 3d7r s LEU 56 CO 0.43 0.20 -0.07 -1.61 -1.32 0.00 0.00 176.35 173.99 3d7r s GLU 57 N 0.10 3.57 -0.63 1.98 2.02 0.15 -4.96 118.70 120.93 3d7r s GLU 57 Ca -0.09 -0.58 -0.07 0.00 0.02 0.00 0.00 54.97 54.25 3d7r s GLU 57 Cb -0.15 -2.84 0.16 0.00 0.10 0.00 0.00 34.13 31.40 3d7r s GLU 57 CO 0.06 0.20 0.49 0.15 0.02 0.00 0.00 175.26 176.18 3d7r s LYS 58 N 0.43 2.77 0.57 1.61 1.02 -1.26 -1.16 119.74 123.73 3d7r s LYS 58 Ca -0.06 -2.29 0.06 0.00 0.02 0.00 0.00 55.97 53.70 3d7r s LYS 58 Cb -0.15 -3.95 0.06 0.00 -0.52 0.00 0.00 37.83 33.27 3d7r s LYS 58 CO 0.03 -1.20 0.47 -0.51 -0.92 0.00 0.00 175.35 173.22 3d7r s LEU 59 N 0.41 2.65 0.04 3.17 1.43 0.52 -4.99 118.68 121.92 3d7r s LEU 59 Ca 0.14 -1.26 -0.06 0.00 -1.03 0.00 0.00 54.13 51.92 3d7r s LEU 59 Cb -0.19 -1.13 -0.01 0.00 0.03 0.00 0.00 46.19 44.88 3d7r s LEU 59 CO -0.04 -1.21 0.11 -0.94 0.23 0.00 0.00 176.35 174.50 3d7r s SER 60 N -4.36 0.16 -0.18 2.29 1.04 -1.26 -1.69 113.70 109.70 3d7r s SER 60 Ca 0.36 -0.53 -0.03 0.00 0.48 0.00 0.00 55.95 56.22 3d7r s SER 60 Cb -0.03 0.24 0.06 0.00 0.10 0.00 0.00 66.02 66.39 3d7r s SER 60 CO 0.23 -0.54 0.05 -0.22 0.98 0.00 0.00 173.24 173.74 3d7r s LEU 61 N -2.20 0.90 -1.30 2.42 2.96 -1.26 -4.87 118.68 115.32 3d7r s LEU 61 Ca -0.04 -0.70 -0.07 0.00 -0.22 0.00 0.00 54.13 53.11 3d7r s LEU 61 Cb -0.00 -0.49 -0.00 0.00 0.50 0.00 0.00 46.19 46.20 3d7r s LEU 61 CO -0.05 -0.31 0.58 0.47 -1.32 0.00 0.00 176.35 175.73 3d7r n ASP 62 N 5.12 -1.99 -2.26 3.68 8.00 -1.26 -4.77 116.55 123.08 3d7r n ASP 62 Ca -0.08 -0.98 -0.01 0.00 0.71 0.00 0.00 54.79 54.43 3d7r n ASP 62 Cb 0.48 -3.34 0.00 0.00 -0.02 0.00 0.00 41.12 38.24 3d7r n ASP 62 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 3d7r n ASP 63 N -2.90 -4.93 -4.22 -2.24 5.75 -1.26 -5.21 116.55 101.54 3d7r n ASP 63 Ca -0.24 0.04 -0.31 0.00 -0.01 0.00 0.00 54.79 54.27 3d7r n ASP 63 Cb 0.66 -3.17 -0.17 0.00 -1.03 0.00 0.00 41.12 37.40 3d7r n ASP 63 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 3d7r s GLN 65 N -2.72 2.64 -0.10 0.11 -0.21 -1.26 -5.11 119.66 113.00 3d7r s GLN 65 Ca 0.03 -0.84 -0.01 0.00 0.02 0.00 0.00 55.36 54.57 3d7r s GLN 65 Cb -0.01 -2.12 0.03 0.00 1.00 0.00 0.00 33.01 31.91 3d7r s GLN 65 CO 0.38 0.26 -0.06 0.08 -2.12 0.00 0.00 175.29 173.84 3d7r s VAL 66 N 0.11 0.85 -0.10 1.09 1.01 -0.68 -0.88 120.40 121.81 3d7r s VAL 66 Ca -0.11 -0.18 -0.10 0.00 0.00 0.00 0.00 61.98 61.60 3d7r s VAL 66 Cb -0.15 -0.90 -0.05 0.00 0.00 0.00 0.00 36.38 35.28 3d7r s VAL 66 CO 0.06 0.34 0.22 -0.36 0.00 0.00 0.00 175.10 175.36 3d7r s PHE 67 N 1.75 3.61 -0.02 5.22 0.08 -0.74 -0.35 117.98 127.52 3d7r s PHE 67 Ca 0.04 0.64 0.07 0.00 0.12 0.00 0.00 56.93 57.81 3d7r s PHE 67 Cb -0.13 -2.09 -0.02 0.00 -0.57 0.00 0.00 43.02 40.22 3d7r s PHE 67 CO -0.07 0.63 -0.25 1.03 -0.10 0.00 0.00 175.22 176.46 3d7r s ARG 68 N -0.78 2.02 -0.11 0.44 0.52 -0.31 -0.02 118.95 120.71 3d7r s ARG 68 Ca 0.17 -0.88 0.03 0.00 -0.52 0.00 0.00 55.73 54.53 3d7r s ARG 68 Cb -0.13 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.40 3d7r s ARG 68 CO 0.06 0.52 -0.22 -0.06 0.02 0.00 0.00 175.30 175.62 3d7r s PHE 69 N -0.55 2.63 0.09 -0.53 0.08 0.25 0.31 117.98 120.25 3d7r s PHE 69 Ca 0.09 -1.06 -0.02 0.00 0.12 0.00 0.00 56.93 56.06 3d7r s PHE 69 Cb -0.10 -1.76 -0.04 0.00 -0.57 0.00 0.00 43.02 40.56 3d7r s PHE 69 CO -0.01 -0.44 0.03 0.54 -0.10 0.00 0.00 175.22 175.25 3d7r s ASN 70 N 0.47 0.37 -0.02 1.36 2.20 -0.01 -1.01 114.94 118.30 3d7r s ASN 70 Ca -0.15 -1.06 0.02 0.00 -0.94 0.00 0.00 52.86 50.73 3d7r s ASN 70 Cb -0.17 0.26 0.00 0.00 -2.00 0.00 0.00 41.25 39.34 3d7r s ASN 70 CO 0.06 -0.68 -0.06 0.12 -2.94 0.00 0.00 177.10 173.60 3d7r s PHE 71 N -3.97 0.64 -1.37 1.54 5.36 -1.26 0.22 117.98 119.13 3d7r s PHE 71 Ca 0.15 -0.13 -0.08 0.00 -0.96 0.00 0.00 56.93 55.90 3d7r s PHE 71 Cb 0.07 -0.46 0.05 0.00 -0.34 0.00 0.00 43.02 42.35 3d7r s PHE 71 CO -0.05 -0.06 0.54 0.54 -1.46 0.00 0.00 175.22 174.74 3d7r n ARG 72 N 3.22 -3.90 -1.64 10.12 1.74 -1.26 -1.34 116.66 123.60 3d7r n ARG 72 Ca -0.17 0.60 -0.17 0.00 -0.77 0.00 0.00 57.85 57.35 3d7r n ARG 72 Cb 0.56 -5.36 -0.06 0.00 -1.02 0.00 0.00 32.46 26.58 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 -4.12 -0.15 -2.97 -1.55 8.25 -1.26 -4.96 115.22 108.46 3d7r n HIS 73 Ca -0.04 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 56.99 3d7r n HIS 73 Cb 0.56 -2.98 -0.05 0.00 1.12 0.00 0.00 29.99 28.64 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 -3.69 3.24 0.00 -0.41 -1.52 -0.45 -4.79 119.66 112.04 3d7r s GLN 74 Ca 0.00 -0.54 0.00 0.00 -1.95 0.00 0.00 55.36 52.87 3d7r s GLN 74 Cb 0.00 -4.08 0.00 0.00 -0.22 0.00 0.00 33.01 28.71 3d7r s GLN 74 CO 0.00 -1.39 0.20 0.44 -0.25 0.00 0.00 175.29 174.28 3d7r n ILE 75 N 5.95 0.03 0.37 1.08 -5.35 -1.26 -3.61 119.36 116.57 3d7r n ILE 75 Ca -0.02 -0.15 0.13 0.00 -0.27 0.00 0.00 62.75 62.44 3d7r n ILE 75 Cb 0.47 1.63 0.54 0.00 -1.74 0.00 0.00 39.64 40.53 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 -4.34 7.28 2.03 -1.90 -3.43 116.42 116.06 3d7r h ASP 76 Ca 0.00 0.00 -0.38 0.00 -0.73 0.00 0.00 57.03 55.92 3d7r h ASP 76 Cb 0.43 0.00 -0.25 0.00 -0.83 0.00 0.00 39.33 38.68 3d7r h ASP 76 CO 0.00 0.00 -0.77 -0.54 -1.03 0.00 0.00 179.24 176.90 3d7r s LYS 77 N -3.40 0.75 0.05 4.15 1.02 -1.26 -4.91 119.74 116.14 3d7r s LYS 77 Ca 0.03 -0.64 0.07 0.00 0.02 0.00 0.00 55.97 55.46 3d7r s LYS 77 Cb 0.09 -0.69 -0.03 0.00 -0.52 0.00 0.00 37.83 36.68 3d7r s LYS 77 CO 0.41 0.17 -0.20 0.15 -0.92 0.00 0.00 175.35 174.96 3d7r s LYS 78 N -1.02 1.30 -0.24 1.68 -0.14 -0.00 -0.84 119.74 120.48 3d7r s LYS 78 Ca -0.01 -0.96 -0.03 0.00 -1.36 0.00 0.00 55.97 53.62 3d7r s LYS 78 Cb -0.07 -1.43 0.01 0.00 -1.68 0.00 0.00 37.83 34.67 3d7r s LYS 78 CO 0.01 0.36 -0.05 0.42 -0.76 0.00 0.00 175.35 175.33 3d7r s ILE 79 N -0.86 3.08 -0.44 2.17 1.01 0.13 -0.67 121.20 125.63 3d7r s ILE 79 Ca 0.07 -0.83 -0.26 0.00 0.00 0.00 0.00 60.65 59.62 3d7r s ILE 79 Cb -0.09 -2.51 0.02 0.00 0.01 0.00 0.00 42.46 39.90 3d7r s ILE 79 CO 0.02 0.27 0.97 -0.22 0.00 0.00 0.00 174.94 175.98 3d7r s LEU 80 N 1.39 3.93 -0.25 2.97 2.96 0.28 -0.21 118.68 129.74 3d7r s LEU 80 Ca 0.02 0.33 -0.08 0.00 -0.22 0.00 0.00 54.13 54.18 3d7r s LEU 80 Cb -0.16 -3.29 -0.04 0.00 0.50 0.00 0.00 46.19 43.20 3d7r s LEU 80 CO -0.04 -1.04 0.10 -0.47 -1.32 0.00 0.00 176.35 173.58 3d7r s TYR 81 N 3.83 3.14 -0.37 5.38 5.04 0.03 -4.42 117.35 129.97 3d7r s TYR 81 Ca 0.40 -0.23 -0.09 0.00 -2.44 0.00 0.00 57.07 54.71 3d7r s TYR 81 Cb -0.10 -2.25 0.04 0.00 0.35 0.00 0.00 41.96 40.00 3d7r s TYR 81 CO 0.25 -0.24 0.18 0.42 -1.34 0.00 0.00 175.55 174.83 3d7r s ILE 82 N 1.47 4.26 0.49 3.14 -1.09 -1.26 -4.21 121.20 124.01 3d7r s ILE 82 Ca 0.06 -1.05 -0.18 0.00 -2.23 0.00 0.00 60.65 57.25 3d7r s ILE 82 Cb -0.15 -3.44 -0.09 0.00 -1.58 0.00 0.00 42.46 37.21 3d7r s ILE 82 CO 0.05 -0.27 0.98 -1.38 -1.23 0.00 0.00 174.94 173.09 3d7r s HIS 83 N 1.48 3.40 0.92 3.97 -3.43 -1.26 -2.80 115.29 117.58 3d7r s HIS 83 Ca 0.01 1.51 -0.13 0.00 -0.80 0.00 0.00 55.06 55.65 3d7r s HIS 83 Cb -0.20 -2.81 0.15 0.00 -1.43 0.00 0.00 32.58 28.28 3d7r s HIS 83 CO 0.05 -0.32 1.15 0.20 -2.00 0.00 0.00 174.74 173.82 3d7r s GLY 84 N -2.82 1.59 0.00 -1.38 0.00 -1.08 -3.87 107.32 99.77 3d7r s GLY 84 Ca 0.60 -0.62 0.00 0.00 0.00 0.00 0.00 44.72 44.70 3d7r s GLY 84 CO 0.26 -0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.95 3d7r n GLY 85 N -2.36 -0.48 2.39 0.20 0.00 -1.26 -4.70 105.19 98.98 3d7r n GLY 85 Ca 0.08 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.11 -1.36 1.61 3.72 -1.26 -0.60 117.46 119.45 3d7r n PHE 86 Ca 0.00 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.28 3d7r n PHE 86 Cb 0.00 -2.62 -0.05 0.00 -0.94 0.00 0.00 39.48 35.87 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 -0.37 -4.86 0.00 4.37 3.02 -1.26 -4.78 115.26 111.39 3d7r n ASN 87 Ca -0.15 0.31 0.00 0.00 -0.03 0.00 0.00 54.58 54.71 3d7r n ASN 87 Cb 0.49 -3.45 0.00 0.00 -0.61 0.00 0.00 39.78 36.22 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 1.23 1.75 -2.77 5.41 0.00 -0.73 -0.48 120.51 124.92 3d7r n ALA 88 Ca -0.12 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.00 3d7r n ALA 88 Cb 0.47 0.21 -0.04 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 -3.32 4.30 0.80 0.00 1.43 0.23 -4.82 118.68 117.29 3d7r s LEU 89 Ca 0.00 0.47 -0.08 0.00 -1.03 0.00 0.00 54.13 53.48 3d7r s LEU 89 Cb 0.00 -3.18 0.13 0.00 0.03 0.00 0.00 46.19 43.17 3d7r s LEU 89 CO 0.00 0.09 1.12 -1.10 0.23 0.00 0.00 176.35 176.69 3d7r s GLN 90 N -2.62 1.53 0.35 1.70 -1.52 -1.26 -4.65 119.66 113.19 3d7r s GLN 90 Ca 0.39 -0.54 -0.28 0.00 -1.95 0.00 0.00 55.36 52.98 3d7r s GLN 90 Cb -0.12 -2.10 -0.11 0.00 -0.22 0.00 0.00 33.01 30.45 3d7r s GLN 90 CO 0.26 -1.70 1.46 -2.30 -0.25 0.00 0.00 175.29 172.76 3d7r n PRO 91 N -3.19 2.54 -1.75 2.91 -0.02 -1.26 -4.90 135.00 129.33 3d7r n PRO 91 Ca 0.12 0.89 -0.34 0.00 -2.02 0.00 0.00 63.50 62.15 3d7r n PRO 91 Cb 0.60 -2.59 0.05 0.00 -0.02 0.00 0.00 33.50 31.54 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 -0.07 4.90 0.58 2.55 0.15 -1.26 -4.92 113.70 115.63 3d7r s SER 92 Ca 0.56 2.20 0.28 0.00 0.70 0.00 0.00 55.95 59.69 3d7r s SER 92 Cb -0.50 -2.57 1.64 0.00 -1.71 0.00 0.00 66.02 62.87 3d7r s SER 92 CO 0.61 -1.78 2.09 1.55 1.20 0.00 0.00 173.24 176.91 3d7r h PRO 93 N 0.20 0.00 0.00 5.44 0.13 -1.98 -0.86 132.00 134.94 3d7r h PRO 93 Ca -0.48 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.56 3d7r h PRO 93 Cb 1.27 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 3d7r h PRO 93 CO 0.53 0.00 -0.44 0.74 -0.23 0.00 0.00 178.00 178.60 3d7r h PHE 94 N 0.00 0.00 -0.43 1.56 -1.00 -1.92 -2.74 116.94 112.42 3d7r h PHE 94 Ca 0.09 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 60.82 3d7r h PHE 94 Cb 0.51 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 40.05 3d7r h PHE 94 CO 0.00 0.44 0.04 0.45 -1.61 0.00 0.00 178.31 177.63 3d7r h HIS 95 N 0.00 0.78 -0.46 -0.55 3.86 -1.47 -0.77 115.15 116.53 3d7r h HIS 95 Ca -0.00 -0.12 0.06 0.00 -1.16 0.00 0.00 60.37 59.14 3d7r h HIS 95 Cb 1.07 -0.21 -0.05 0.00 1.06 0.00 0.00 27.41 29.29 3d7r h HIS 95 CO 0.00 0.76 0.18 -1.49 0.86 0.00 0.00 177.93 178.24 3d7r h TRP 96 N 0.57 0.32 -0.24 2.45 4.06 -1.33 0.04 115.95 121.83 3d7r h TRP 96 Ca 0.13 0.02 -0.01 0.00 2.06 0.00 0.00 58.89 61.08 3d7r h TRP 96 Cb 0.42 -0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 28.49 3d7r h TRP 96 CO 0.03 0.12 0.10 -0.09 -3.56 0.00 0.00 178.44 175.04 3d7r h ARG 97 N 0.36 0.36 -0.38 0.49 2.43 -1.40 -1.30 114.38 114.94 3d7r h ARG 97 Ca 0.21 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.37 3d7r h ARG 97 Cb 0.20 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.65 3d7r h ARG 97 CO -0.21 0.40 0.14 1.25 -1.51 0.00 0.00 179.97 180.04 3d7r h LEU 98 N 0.24 0.15 -0.94 3.80 5.85 -0.73 -0.93 115.31 122.74 3d7r h LEU 98 Ca 0.08 0.04 -0.07 0.00 0.84 0.00 0.00 57.88 58.77 3d7r h LEU 98 Cb 0.17 0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3d7r h LEU 98 CO -0.01 0.12 0.02 -0.07 -0.34 0.00 0.00 178.44 178.16 3d7r h LEU 99 N 0.29 0.75 -0.20 2.25 4.07 -0.88 0.00 115.31 121.60 3d7r h LEU 99 Ca 0.17 -0.17 0.00 0.00 0.08 0.00 0.00 57.88 57.96 3d7r h LEU 99 Cb 0.15 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.68 3d7r h LEU 99 CO -0.18 0.81 0.13 -0.78 -1.08 0.00 0.00 178.44 177.34 3d7r h ASP 100 N 0.74 0.23 -0.67 -0.43 3.58 -0.93 -0.66 116.42 118.29 3d7r h ASP 100 Ca 0.15 -0.02 -0.07 0.00 0.42 0.00 0.00 57.03 57.51 3d7r h ASP 100 Cb 0.42 -0.06 -0.03 0.00 1.72 0.00 0.00 39.33 41.39 3d7r h ASP 100 CO 0.02 0.18 0.16 0.11 -2.88 0.00 0.00 179.24 176.82 3d7r h LYS 101 N 0.27 1.09 -0.80 0.28 1.57 -0.67 -1.86 116.57 116.44 3d7r h LYS 101 Ca 0.07 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.55 3d7r h LYS 101 Cb -0.02 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.11 3d7r h LYS 101 CO -0.02 0.97 0.32 0.82 -0.57 0.00 0.00 179.45 180.97 3d7r h ILE 102 N 1.03 1.26 -0.09 1.86 2.04 -0.83 -1.34 117.51 121.44 3d7r h ILE 102 Ca 0.21 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 65.25 3d7r h ILE 102 Cb 0.37 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.76 3d7r h ILE 102 CO 0.00 0.34 0.03 0.74 0.00 0.00 0.00 178.15 179.27 3d7r h THR 103 N 1.16 0.98 0.00 -0.27 2.02 -0.73 -0.09 112.91 115.98 3d7r h THR 103 Ca 0.27 -0.03 -0.08 0.00 0.77 0.00 0.00 66.41 67.33 3d7r h THR 103 Cb 0.22 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.51 3d7r h THR 103 CO -0.02 0.01 -0.40 -0.07 0.37 0.00 0.00 175.52 175.42 3d7r h LEU 104 N 0.08 0.00 0.14 2.58 4.07 -1.19 -0.77 115.31 120.22 3d7r h LEU 104 Ca 0.04 0.00 -0.31 0.00 0.08 0.00 0.00 57.88 57.68 3d7r h LEU 104 Cb 0.02 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.76 3d7r h LEU 104 CO -0.04 0.40 -1.56 0.28 -1.08 0.00 0.00 178.44 176.44 3d7r h SER 105 N 0.00 0.46 0.25 -0.43 0.02 -0.95 -3.38 113.55 109.52 3d7r h SER 105 Ca -0.00 -0.63 -0.20 0.00 -0.84 0.00 0.00 61.79 60.12 3d7r h SER 105 Cb 0.74 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.09 3d7r h SER 105 CO 0.05 1.52 -1.94 0.35 -1.14 0.00 0.00 176.83 175.67 3d7r n THR 106 N -3.49 0.95 -2.71 -2.27 -2.24 -0.07 -4.85 114.28 99.59 3d7r n THR 106 Ca -0.18 -0.70 -0.20 0.00 -2.27 0.00 0.00 64.05 60.71 3d7r n THR 106 Cb 1.05 -0.44 0.01 0.00 -2.10 0.00 0.00 70.33 68.85 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 -2.67 -1.93 -4.92 3.22 4.77 -0.30 -5.02 117.00 110.15 3d7r n LEU 107 Ca -0.17 -0.09 -0.27 0.00 -0.03 0.00 0.00 56.01 55.45 3d7r n LEU 107 Cb 0.89 -2.67 -0.03 0.00 -2.33 0.00 0.00 43.42 39.28 3d7r n LEU 107 CO 0.44 -0.02 0.17 -0.31 -1.33 0.00 0.00 177.39 176.33 3d7r s TYR 108 N -2.97 3.49 -0.14 -1.77 1.51 -1.26 -4.67 117.35 111.54 3d7r s TYR 108 Ca 0.14 0.51 -0.27 0.00 -1.01 0.00 0.00 57.07 56.44 3d7r s TYR 108 Cb -0.06 -2.01 -0.01 0.00 -0.11 0.00 0.00 41.96 39.76 3d7r s TYR 108 CO 0.17 0.19 0.90 -2.00 -1.11 0.00 0.00 175.55 173.70 3d7r s GLU 109 N -3.73 4.36 -0.17 -0.62 2.12 -0.02 -4.69 118.70 115.95 3d7r s GLU 109 Ca 0.42 1.17 -0.14 0.00 0.36 0.00 0.00 54.97 56.78 3d7r s GLU 109 Cb -0.10 -3.55 -0.05 0.00 0.26 0.00 0.00 34.13 30.69 3d7r s GLU 109 CO 0.32 -0.30 0.29 0.08 -0.54 0.00 0.00 175.26 175.11 3d7r s VAL 110 N 2.01 5.30 -0.19 3.70 1.01 -0.18 -0.69 120.40 131.36 3d7r s VAL 110 Ca 0.43 0.53 -0.01 0.00 0.00 0.00 0.00 61.98 62.94 3d7r s VAL 110 Cb -0.17 -3.63 0.01 0.00 0.00 0.00 0.00 36.38 32.59 3d7r s VAL 110 CO 0.15 0.38 -0.15 -0.69 0.00 0.00 0.00 175.10 174.79 3d7r s VAL 111 N 0.57 2.49 -0.61 2.92 1.01 0.70 -0.59 120.40 126.89 3d7r s VAL 111 Ca 0.16 -0.80 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 3d7r s VAL 111 Cb -0.13 -2.08 0.16 0.00 0.00 0.00 0.00 36.38 34.33 3d7r s VAL 111 CO 0.04 0.50 0.41 -0.22 0.00 0.00 0.00 175.10 175.83 3d7r s LEU 112 N 1.32 4.99 0.13 3.92 2.96 0.98 -0.79 118.68 132.19 3d7r s LEU 112 Ca 0.05 -2.98 -0.30 0.00 -0.22 0.00 0.00 54.13 50.67 3d7r s LEU 112 Cb -0.14 -1.79 -0.07 0.00 0.50 0.00 0.00 46.19 44.69 3d7r s LEU 112 CO -0.09 -0.31 1.26 -2.16 -1.32 0.00 0.00 176.35 173.72 3d7r s PRO 113 N -0.24 4.42 -1.26 0.98 0.04 -1.26 -1.79 135.00 135.88 3d7r s PRO 113 Ca 0.18 1.92 -0.12 0.00 0.04 0.00 0.00 61.00 63.01 3d7r s PRO 113 Cb -0.21 -3.27 0.15 0.00 0.04 0.00 0.00 34.50 31.22 3d7r s PRO 113 CO -0.03 -0.25 1.68 -0.89 0.04 0.00 0.00 177.00 177.55 3d7r n ILE 114 N 3.30 4.22 -1.47 0.56 2.08 -0.05 -4.82 119.36 123.18 3d7r n ILE 114 Ca 0.08 -4.45 -0.33 0.00 0.56 0.00 0.00 62.75 58.61 3d7r n ILE 114 Cb 0.44 -2.42 0.08 0.00 -0.75 0.00 0.00 39.64 36.99 3d7r n ILE 114 CO 0.00 0.00 0.00 -0.72 0.56 0.00 0.00 176.55 176.39 3d7r s TYR 115 N 1.41 2.37 0.21 1.39 -0.85 -1.26 -4.54 117.35 116.08 3d7r s TYR 115 Ca 0.43 1.59 -0.32 0.00 -0.52 0.00 0.00 57.07 58.25 3d7r s TYR 115 Cb 0.04 -3.24 -0.14 0.00 0.38 0.00 0.00 41.96 39.00 3d7r s TYR 115 CO 0.00 -2.05 1.29 -2.30 -1.52 0.00 0.00 175.55 170.98 3d7r n PRO 116 N -2.90 1.64 -4.38 -3.49 -0.02 -1.26 -5.01 135.00 119.59 3d7r n PRO 116 Ca 0.11 0.58 -0.28 0.00 -2.02 0.00 0.00 63.50 61.90 3d7r n PRO 116 Cb 0.52 -2.16 -0.12 0.00 -0.02 0.00 0.00 33.50 31.72 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 -0.43 1.62 0.68 -0.52 -0.14 -1.26 -4.50 119.74 115.20 3d7r s LYS 117 Ca 0.70 -1.40 -0.11 0.00 -1.36 0.00 0.00 55.97 53.80 3d7r s LYS 117 Cb -0.74 -1.95 -0.01 0.00 -1.68 0.00 0.00 37.83 33.46 3d7r s LYS 117 CO 0.51 0.43 1.05 -0.08 -0.76 0.00 0.00 175.35 176.50 3d7r s THR 118 N -1.48 4.16 -0.94 2.17 -1.32 0.37 -0.65 115.64 117.96 3d7r s THR 118 Ca 0.20 0.70 0.26 0.00 -1.21 0.00 0.00 61.69 61.64 3d7r s THR 118 Cb -0.09 -3.57 0.23 0.00 -1.51 0.00 0.00 72.50 67.56 3d7r s THR 118 CO 0.10 -0.92 1.81 -0.81 -2.21 0.00 0.00 174.62 172.60 3d7r n PRO 119 N -2.99 0.05 0.02 7.08 -0.04 -1.26 -4.35 135.00 133.50 3d7r n PRO 119 Ca 0.07 0.10 -0.19 0.00 -0.04 0.00 0.00 63.50 63.43 3d7r n PRO 119 Cb 0.54 -1.56 -0.09 0.00 -0.04 0.00 0.00 33.50 32.35 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 0.74 -5.80 0.54 4.81 -1.94 -3.47 114.58 109.47 3d7r h GLU 120 Ca 0.00 -0.72 -0.59 0.00 -0.13 0.00 0.00 59.36 57.92 3d7r h GLU 120 Cb 0.49 0.19 -0.10 0.00 0.63 0.00 0.00 28.75 29.95 3d7r h GLU 120 CO 0.00 1.30 -0.52 -0.06 -0.73 0.00 0.00 179.01 179.01 3d7r s PHE 121 N -3.47 2.50 0.36 0.92 0.08 0.17 -5.06 117.98 113.48 3d7r s PHE 121 Ca -0.10 -0.64 0.06 0.00 0.12 0.00 0.00 56.93 56.37 3d7r s PHE 121 Cb 0.08 -1.89 -0.03 0.00 -0.57 0.00 0.00 43.02 40.61 3d7r s PHE 121 CO 0.92 0.23 0.22 -1.01 -0.10 0.00 0.00 175.22 175.48 3d7r s HIS 122 N -2.65 1.76 0.22 0.36 3.76 -1.26 -3.05 115.29 114.42 3d7r s HIS 122 Ca 0.37 -1.54 -0.11 0.00 -0.15 0.00 0.00 55.06 53.63 3d7r s HIS 122 Cb 0.05 -0.87 0.29 0.00 1.11 0.00 0.00 32.58 33.16 3d7r s HIS 122 CO 0.20 -0.67 1.64 0.97 -0.85 0.00 0.00 174.74 176.03 3d7r h ILE 123 N 2.01 0.41 -0.47 0.60 2.10 -1.54 -0.96 117.51 119.66 3d7r h ILE 123 Ca -0.29 -0.02 -0.06 0.00 1.08 0.00 0.00 64.86 65.58 3d7r h ILE 123 Cb 1.25 0.34 -0.02 0.00 -1.09 0.00 0.00 36.82 37.30 3d7r h ILE 123 CO 0.43 0.01 0.06 0.44 -1.08 0.00 0.00 178.15 178.02 3d7r h ASP 124 N 0.06 0.69 -0.27 2.19 3.32 -1.95 -1.55 116.42 118.92 3d7r h ASP 124 Ca 0.33 -0.14 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 3d7r h ASP 124 Cb 0.53 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 3d7r h ASP 124 CO -0.61 0.72 0.15 0.44 -1.72 0.00 0.00 179.24 178.22 3d7r h ASP 125 N 0.71 0.33 0.22 6.45 3.32 -1.61 -1.77 116.42 124.07 3d7r h ASP 125 Ca 0.15 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3d7r h ASP 125 Cb 0.34 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3d7r h ASP 125 CO 0.01 0.32 -0.11 0.74 -1.72 0.00 0.00 179.24 178.48 3d7r h THR 126 N 0.32 0.77 -0.42 0.35 2.02 -1.02 -2.58 112.91 112.34 3d7r h THR 126 Ca 0.09 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.20 3d7r h THR 126 Cb 0.06 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 3d7r h THR 126 CO -0.02 0.00 -0.06 -0.26 0.37 0.00 0.00 175.52 175.56 3d7r h PHE 127 N -0.31 0.77 -0.42 3.16 0.04 -1.26 -2.35 116.94 116.58 3d7r h PHE 127 Ca -0.03 -0.12 -0.11 0.00 2.80 0.00 0.00 57.97 60.51 3d7r h PHE 127 Cb 0.24 -0.21 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 3d7r h PHE 127 CO -0.07 0.75 -0.20 1.96 -0.60 0.00 0.00 178.31 180.16 3d7r h GLN 128 N 0.66 0.81 -0.37 1.51 4.20 -1.29 -1.50 115.11 119.13 3d7r h GLN 128 Ca 0.12 -0.32 -0.03 0.00 0.06 0.00 0.00 58.65 58.48 3d7r h GLN 128 Cb 0.49 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 3d7r h GLN 128 CO 0.03 0.94 0.10 0.00 -0.67 0.00 0.00 178.83 179.23 3d7r h ALA 129 N 1.06 0.49 -0.85 3.87 0.00 -1.33 -1.75 119.26 120.76 3d7r h ALA 129 Ca 0.10 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d7r h ALA 129 Cb 0.71 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 3d7r h ALA 129 CO 0.05 0.15 0.54 0.82 0.00 0.00 0.00 179.25 180.82 3d7r h ILE 130 N 0.45 1.22 -0.52 0.00 2.04 -1.31 -2.28 117.51 117.12 3d7r h ILE 130 Ca 0.12 -0.44 0.06 0.00 1.00 0.00 0.00 64.86 65.60 3d7r h ILE 130 Cb 0.29 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.32 3d7r h ILE 130 CO -0.00 0.22 0.21 -0.61 0.00 0.00 0.00 178.15 177.98 3d7r h GLN 131 N 1.15 0.40 -0.37 2.37 5.75 -1.04 -1.10 115.11 122.28 3d7r h GLN 131 Ca 0.31 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.78 3d7r h GLN 131 Cb -0.10 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.34 3d7r h GLN 131 CO -0.06 0.26 0.23 0.00 -2.65 0.00 0.00 178.83 176.61 3d7r h ARG 132 N 0.41 0.50 -0.28 1.69 3.08 -0.79 -0.20 114.38 118.79 3d7r h ARG 132 Ca 0.24 -0.04 -0.15 0.00 0.07 0.00 0.00 59.98 60.10 3d7r h ARG 132 Cb 0.23 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3d7r h ARG 132 CO -0.22 0.37 -0.44 -0.24 -1.07 0.00 0.00 179.97 178.37 3d7r h VAL 133 N 0.48 1.29 -0.29 2.04 3.04 -1.23 -1.40 116.25 120.17 3d7r h VAL 133 Ca 0.13 -1.62 0.02 0.00 -1.01 0.00 0.00 66.70 64.22 3d7r h VAL 133 Cb -0.01 1.54 -0.02 0.00 -2.01 0.00 0.00 31.29 30.79 3d7r h VAL 133 CO -0.03 0.52 0.15 0.22 -1.01 0.00 0.00 177.57 177.42 3d7r h TYR 134 N 0.57 0.27 -0.77 3.17 3.20 -0.99 -1.28 116.97 121.15 3d7r h TYR 134 Ca 0.04 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.93 3d7r h TYR 134 Cb 0.98 -0.08 -0.04 0.00 1.54 0.00 0.00 36.73 39.13 3d7r h TYR 134 CO 0.05 0.15 0.51 -0.44 -1.64 0.00 0.00 178.16 176.79 3d7r h ASP 135 N 0.31 0.88 -0.16 -2.11 3.32 -0.88 -0.19 116.42 117.59 3d7r h ASP 135 Ca 0.12 -0.02 0.04 0.00 0.02 0.00 0.00 57.03 57.19 3d7r h ASP 135 Cb 0.03 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.32 3d7r h ASP 135 CO -0.08 0.64 -0.13 -0.61 -1.72 0.00 0.00 179.24 177.34 3d7r h GLN 136 N 1.04 -0.14 -0.35 3.56 4.15 -0.97 -1.19 115.11 121.22 3d7r h GLN 136 Ca 0.29 0.01 -0.03 0.00 0.77 0.00 0.00 58.65 59.69 3d7r h GLN 136 Cb -0.11 0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.60 3d7r h GLN 136 CO -0.07 -0.09 0.12 -0.07 -1.93 0.00 0.00 178.83 176.79 3d7r h LEU 137 N -0.14 0.50 -0.97 -2.39 3.38 -0.71 -2.64 115.31 112.33 3d7r h LEU 137 Ca 0.10 -0.19 0.07 0.00 0.09 0.00 0.00 57.88 57.95 3d7r h LEU 137 Cb 0.29 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.85 3d7r h LEU 137 CO -0.25 0.56 0.62 0.58 0.09 0.00 0.00 178.44 180.04 3d7r h VAL 138 N 0.41 1.07 0.00 1.22 2.07 -0.94 -1.01 116.25 119.07 3d7r h VAL 138 Ca 0.11 -0.39 -0.05 0.00 0.82 0.00 0.00 66.70 67.19 3d7r h VAL 138 Cb 0.23 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 3d7r h VAL 138 CO -0.01 0.21 -0.25 0.77 0.02 0.00 0.00 177.57 178.31 3d7r h SER 139 N 1.12 0.00 -0.02 0.57 4.64 -0.99 0.18 113.55 119.05 3d7r h SER 139 Ca 0.42 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.69 3d7r h SER 139 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 3d7r h SER 139 CO -0.18 0.25 -0.18 -0.33 -0.87 0.00 0.00 176.83 175.52 3d7r h GLU 140 N 0.00 0.17 0.00 4.77 5.08 -0.86 -3.42 114.58 120.32 3d7r h GLU 140 Ca -0.00 -0.15 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 3d7r h GLU 140 Cb 0.47 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.75 3d7r h GLU 140 CO 0.03 0.83 0.00 1.33 -1.00 0.00 0.00 179.01 180.20 3d7r n VAL 141 N -4.57 0.00 0.00 3.13 0.24 -0.76 -5.12 118.33 111.24 3d7r n VAL 141 Ca -0.09 -0.20 0.00 0.00 -2.04 0.00 0.00 64.34 62.01 3d7r n VAL 141 Cb 0.44 1.26 0.00 0.00 -1.47 0.00 0.00 33.84 34.07 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 0.22 -0.35 0.34 7.63 0.00 0.61 -4.44 105.19 109.20 3d7r n GLY 142 Ca 0.00 -1.48 0.08 0.00 0.00 0.00 0.00 46.02 44.62 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 0.52 0.00 1.61 2.07 -1.88 -0.25 115.15 117.23 3d7r h HIS 143 Ca 0.00 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.53 3d7r h HIS 143 Cb 0.00 -0.17 0.00 0.00 2.57 0.00 0.00 27.41 29.81 3d7r h HIS 143 CO 0.00 0.28 0.00 -0.56 -3.07 0.00 0.00 177.93 174.58 3d7r h GLN 144 N 0.52 0.00 -0.38 5.12 -0.00 -1.86 -2.34 115.11 116.16 3d7r h GLN 144 Ca 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.89 3d7r h GLN 144 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.75 3d7r h GLN 144 CO -0.07 0.00 0.00 0.09 -0.00 0.00 0.00 178.83 178.85 3d7r n ASN 145 N -2.36 3.32 -4.30 0.06 3.02 -0.11 -4.54 115.26 110.36 3d7r n ASN 145 Ca -0.01 -2.22 -0.32 0.00 -0.03 0.00 0.00 54.58 52.00 3d7r n ASN 145 Cb 0.09 -0.33 -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 -1.39 2.46 -0.01 2.41 1.01 -0.88 -0.82 120.40 123.18 3d7r s VAL 146 Ca 0.31 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.45 3d7r s VAL 146 Cb 0.19 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.57 3d7r s VAL 146 CO 0.17 0.55 -0.17 -0.69 0.00 0.00 0.00 175.10 174.96 3d7r s VAL 147 N 0.19 2.86 0.35 2.92 1.01 0.15 -0.94 120.40 126.95 3d7r s VAL 147 Ca -0.12 -0.95 0.08 0.00 0.00 0.00 0.00 61.98 60.99 3d7r s VAL 147 Cb -0.16 -2.14 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 3d7r s VAL 147 CO 0.06 0.49 0.28 -0.69 0.00 0.00 0.00 175.10 175.24 3d7r s VAL 148 N -0.80 3.22 0.00 2.92 1.01 -0.85 -0.56 120.40 125.34 3d7r s VAL 148 Ca 0.13 -1.44 0.00 0.00 0.00 0.00 0.00 61.98 60.67 3d7r s VAL 148 Cb -0.10 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.17 3d7r s VAL 148 CO 0.02 -0.14 0.00 0.61 0.00 0.00 0.00 175.10 175.60 3d7r n GLY 150 N -1.36 2.55 3.23 4.51 0.00 -0.86 -0.27 105.19 112.99 3d7r n GLY 150 Ca -0.01 -0.80 -0.26 0.00 0.00 0.00 0.00 46.02 44.95 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 2.40 1.49 1.61 -4.77 -1.12 -0.73 116.67 115.54 3d7r s ASP 151 Ca 0.00 -0.47 0.00 0.00 -3.30 0.00 0.00 52.55 48.78 3d7r s ASP 151 Cb 0.00 -0.22 0.00 0.00 -1.09 0.00 0.00 42.92 41.61 3d7r s ASP 151 CO 0.00 0.18 0.00 0.61 0.70 0.00 0.00 175.17 176.66 3d7r n GLY 152 N 2.05 2.79 0.31 2.12 0.00 0.61 -0.53 105.19 112.54 3d7r n GLY 152 Ca -0.17 -0.30 0.15 0.00 0.00 0.00 0.00 46.02 45.70 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 3.01 0.00 0.24 1.61 4.64 -1.89 -1.01 113.55 120.15 3d7r h SER 153 Ca 0.00 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.22 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 -0.39 1.23 -0.87 0.00 0.00 176.83 176.80 3d7r h GLY 154 N 0.00 0.23 1.31 -0.77 0.00 -0.92 0.20 103.07 103.12 3d7r h GLY 154 Ca 0.04 -0.21 -0.13 0.00 0.00 0.00 0.00 47.33 47.03 3d7r h GLY 154 CO -0.00 0.19 -0.30 -1.33 0.00 0.00 0.00 176.54 175.10 3d7r h GLY 155 N 1.19 0.84 0.98 4.60 0.00 -0.96 0.11 103.07 109.83 3d7r h GLY 155 Ca 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 47.33 46.57 3d7r h GLY 155 CO 0.06 0.71 0.03 0.00 0.00 0.00 0.00 176.54 177.34 3d7r h ALA 156 N 1.00 0.06 -0.70 3.60 0.00 -1.16 -1.56 119.26 120.51 3d7r h ALA 156 Ca 0.07 0.00 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3d7r h ALA 156 Cb 0.84 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 3d7r h ALA 156 CO 0.07 -0.45 0.44 -0.07 0.00 0.00 0.00 179.25 179.24 3d7r h LEU 157 N 0.06 0.72 -0.26 0.00 3.38 -0.78 0.37 115.31 118.80 3d7r h LEU 157 Ca 0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 3d7r h LEU 157 Cb -0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 3d7r h LEU 157 CO -0.01 0.50 0.16 0.00 0.09 0.00 0.00 178.44 179.18 3d7r h ALA 158 N 1.30 0.33 -0.08 1.53 0.00 -0.68 0.18 119.26 121.83 3d7r h ALA 158 Ca 0.28 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 3d7r h ALA 158 Cb 0.02 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3d7r h ALA 158 CO -0.11 -0.18 -0.01 1.25 0.00 0.00 0.00 179.25 180.21 3d7r h LEU 159 N 0.33 0.15 -0.92 0.00 5.85 -1.01 -1.95 115.31 117.76 3d7r h LEU 159 Ca 0.09 -0.34 0.10 0.00 0.84 0.00 0.00 57.88 58.57 3d7r h LEU 159 Cb 0.00 -0.04 -0.08 0.00 0.37 0.00 0.00 40.66 40.92 3d7r h LEU 159 CO -0.02 0.45 0.56 -1.28 -0.34 0.00 0.00 178.44 177.81 3d7r h SER 160 N -0.16 0.83 -0.21 1.25 0.87 -0.80 -0.46 113.55 114.87 3d7r h SER 160 Ca 0.02 0.04 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 3d7r h SER 160 Cb 0.38 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 3d7r h SER 160 CO 0.01 0.47 0.07 0.15 -0.53 0.00 0.00 176.83 177.00 3d7r h PHE 161 N 0.93 0.33 -0.38 2.24 3.57 -0.54 -0.61 116.94 122.48 3d7r h PHE 161 Ca 0.44 -0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.86 3d7r h PHE 161 Cb 0.37 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 3d7r h PHE 161 CO -0.03 0.39 0.03 0.28 -2.23 0.00 0.00 178.31 176.75 3d7r h VAL 162 N 0.17 1.20 -0.77 1.41 2.07 -0.96 -0.70 116.25 118.68 3d7r h VAL 162 Ca 0.07 -0.79 -0.02 0.00 0.82 0.00 0.00 66.70 66.77 3d7r h VAL 162 Cb 0.22 0.89 -0.04 0.00 -1.52 0.00 0.00 31.29 30.84 3d7r h VAL 162 CO -0.00 0.28 0.39 1.56 0.02 0.00 0.00 177.57 179.81 3d7r h GLN 163 N 0.57 1.08 -0.42 1.57 4.20 -0.93 -0.83 115.11 120.35 3d7r h GLN 163 Ca 0.12 -0.14 -0.04 0.00 0.06 0.00 0.00 58.65 58.66 3d7r h GLN 163 Cb 0.32 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 27.88 3d7r h GLN 163 CO 0.01 0.81 0.12 1.03 -0.67 0.00 0.00 178.83 180.13 3d7r h SER 164 N 1.08 0.62 -0.31 1.46 0.87 -0.18 0.13 113.55 117.21 3d7r h SER 164 Ca 0.27 -0.21 0.05 0.00 -1.23 0.00 0.00 61.79 60.66 3d7r h SER 164 Cb 0.07 -0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 61.82 3d7r h SER 164 CO -0.04 0.67 0.03 -0.07 -0.53 0.00 0.00 176.83 176.90 3d7r h LEU 165 N 0.54 -0.05 -0.06 2.23 3.38 -0.83 -0.67 115.31 119.84 3d7r h LEU 165 Ca 0.13 0.06 0.00 0.00 0.09 0.00 0.00 57.88 58.16 3d7r h LEU 165 Cb 0.28 0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 3d7r h LEU 165 CO -0.00 0.01 0.04 0.25 0.09 0.00 0.00 178.44 178.83 3d7r h LEU 166 N 0.13 0.07 -1.98 1.67 5.85 -0.90 0.30 115.31 120.45 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 0.18 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 3d7r h LEU 166 CO -0.22 0.05 -0.10 0.44 -0.34 0.00 0.00 178.44 178.27 3d7r h ASP 167 N 0.08 0.00 -0.56 1.25 3.32 -0.49 -2.39 116.42 117.62 3d7r h ASP 167 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 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 0.10 0.00 0.59 -1.72 0.00 0.00 179.24 178.20 3d7r n ASN 168 N -4.00 3.96 -1.99 6.45 3.02 -0.28 -4.97 115.26 117.45 3d7r n ASN 168 Ca -0.02 -2.24 -0.19 0.00 -0.03 0.00 0.00 54.58 52.09 3d7r n ASN 168 Cb 0.18 -0.46 -0.05 0.00 -0.61 0.00 0.00 39.78 38.85 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 0.98 -1.61 -2.69 3.52 6.02 -0.25 -4.97 117.38 118.39 3d7r n GLN 169 Ca 0.21 1.03 -0.35 0.00 -0.01 0.00 0.00 57.00 57.89 3d7r n GLN 169 Cb 0.69 -5.54 -0.05 0.00 1.02 0.00 0.00 30.24 26.35 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 -4.35 4.17 0.13 -1.09 -1.52 0.90 -4.98 119.66 112.90 3d7r s GLN 170 Ca 0.00 1.30 -0.35 0.00 -1.95 0.00 0.00 55.36 54.35 3d7r s GLN 170 Cb 0.00 -2.34 -0.15 0.00 -0.22 0.00 0.00 33.01 30.30 3d7r s GLN 170 CO 0.00 -0.10 1.41 -2.30 -0.25 0.00 0.00 175.29 174.05 3d7r n PRO 171 N -0.40 1.54 -3.62 2.91 -0.02 -1.26 -4.57 135.00 129.57 3d7r n PRO 171 Ca 0.06 0.56 -0.30 0.00 -2.02 0.00 0.00 63.50 61.80 3d7r n PRO 171 Cb 0.52 -2.23 -0.04 0.00 -0.02 0.00 0.00 33.50 31.73 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 0.63 4.23 0.86 2.45 1.43 -1.26 -4.98 118.68 122.03 3d7r s LEU 172 Ca 0.81 0.58 -0.11 0.00 -1.03 0.00 0.00 54.13 54.38 3d7r s LEU 172 Cb -0.84 -3.33 0.11 0.00 0.03 0.00 0.00 46.19 42.17 3d7r s LEU 172 CO 0.44 -0.01 1.10 -2.16 0.23 0.00 0.00 176.35 175.95 3d7r s PRO 173 N -2.93 1.53 0.26 1.29 0.04 -1.26 -4.49 135.00 129.44 3d7r s PRO 173 Ca 0.41 1.10 0.01 0.00 0.04 0.00 0.00 61.00 62.57 3d7r s PRO 173 Cb -0.12 -1.82 0.35 0.00 0.04 0.00 0.00 34.50 32.96 3d7r s PRO 173 CO 0.26 -2.13 1.69 -0.97 0.04 0.00 0.00 177.00 175.88 3d7r h ASN 174 N -1.48 0.51 -5.10 6.66 -0.73 -1.04 -3.45 115.58 110.95 3d7r h ASN 174 Ca -0.46 -0.19 -0.07 0.00 1.87 0.00 0.00 56.30 57.44 3d7r h ASN 174 Cb 1.26 -0.14 -0.14 0.00 0.27 0.00 0.00 38.32 39.57 3d7r h ASN 174 CO 0.51 0.79 -0.22 -0.54 -0.37 0.00 0.00 177.43 177.59 3d7r s LYS 175 N -4.43 0.93 -0.11 6.67 1.02 -1.26 -4.32 119.74 118.24 3d7r s LYS 175 Ca -0.07 -0.76 -0.00 0.00 0.02 0.00 0.00 55.97 55.16 3d7r s LYS 175 Cb 0.13 0.40 0.02 0.00 -0.52 0.00 0.00 37.83 37.86 3d7r s LYS 175 CO 0.80 -0.33 -0.08 -1.17 -0.92 0.00 0.00 175.35 173.66 3d7r s LEU 176 N -2.67 1.19 -0.16 3.17 2.96 -0.57 -2.01 118.68 120.59 3d7r s LEU 176 Ca 0.02 -0.29 -0.03 0.00 -0.22 0.00 0.00 54.13 53.61 3d7r s LEU 176 Cb 0.02 -0.81 -0.02 0.00 0.50 0.00 0.00 46.19 45.88 3d7r s LEU 176 CO -0.10 -0.11 -0.05 -0.31 -1.32 0.00 0.00 176.35 174.46 3d7r s TYR 177 N 1.63 2.99 -0.17 5.38 2.02 0.62 -1.01 117.35 128.81 3d7r s TYR 177 Ca 0.03 -0.39 0.01 0.00 -0.37 0.00 0.00 57.07 56.35 3d7r s TYR 177 Cb -0.13 -1.96 0.03 0.00 -0.40 0.00 0.00 41.96 39.50 3d7r s TYR 177 CO -0.07 -0.10 -0.15 -0.51 -1.57 0.00 0.00 175.55 173.15 3d7r s LEU 178 N 0.46 1.97 -0.29 -1.29 1.43 0.20 -2.02 118.68 119.14 3d7r s LEU 178 Ca -0.04 -0.63 -0.07 0.00 -1.03 0.00 0.00 54.13 52.36 3d7r s LEU 178 Cb -0.14 -1.29 0.00 0.00 0.03 0.00 0.00 46.19 44.79 3d7r s LEU 178 CO 0.03 -0.06 0.08 -0.63 0.23 0.00 0.00 176.35 176.00 3d7r s ILE 179 N 1.40 4.01 -1.36 -0.59 1.01 0.09 -0.37 121.20 125.38 3d7r s ILE 179 Ca 0.04 -0.60 -0.18 0.00 0.00 0.00 0.00 60.65 59.91 3d7r s ILE 179 Cb -0.14 -3.03 0.02 0.00 0.01 0.00 0.00 42.46 39.33 3d7r s ILE 179 CO -0.11 0.13 0.33 -1.20 0.00 0.00 0.00 174.94 174.09 3d7r n SER 180 N 4.88 -1.52 -4.77 3.58 7.64 0.19 -0.28 113.62 123.33 3d7r n SER 180 Ca -0.15 -1.28 -0.40 0.00 1.01 0.00 0.00 58.87 58.05 3d7r n SER 180 Cb 0.49 -1.56 -0.02 0.00 -1.01 0.00 0.00 64.21 62.10 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 -7.40 4.31 -1.14 1.43 0.04 -1.26 -2.64 135.00 128.34 3d7r s PRO 181 Ca 0.24 2.12 -0.15 0.00 0.04 0.00 0.00 61.00 63.26 3d7r s PRO 181 Cb -0.14 -3.01 0.16 0.00 0.04 0.00 0.00 34.50 31.55 3d7r s PRO 181 CO 0.97 -0.19 1.37 0.42 0.04 0.00 0.00 177.00 179.61 3d7r s ILE 182 N -1.18 4.93 0.33 0.56 1.01 -0.98 -4.85 121.20 121.01 3d7r s ILE 182 Ca 0.50 -2.35 0.14 0.00 0.00 0.00 0.00 60.65 58.94 3d7r s ILE 182 Cb -0.38 -4.89 0.10 0.00 0.01 0.00 0.00 42.46 37.30 3d7r s ILE 182 CO 0.50 -1.61 1.80 -0.07 0.00 0.00 0.00 174.94 175.56 3d7r h LEU 183 N 9.98 0.00 -7.49 2.97 3.38 -1.91 -3.39 115.31 118.85 3d7r h LEU 183 Ca 0.28 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 57.67 3d7r h LEU 183 Cb 0.91 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 41.27 3d7r h LEU 183 CO 1.22 0.39 -0.78 -0.62 0.09 0.00 0.00 178.44 178.74 3d7r s ASP 184 N -6.79 3.54 0.38 -0.43 -1.08 -1.26 -2.33 116.67 108.70 3d7r s ASP 184 Ca -0.02 -1.09 0.27 0.00 -0.52 0.00 0.00 52.55 51.20 3d7r s ASP 184 Cb 0.14 -0.97 1.26 0.00 -1.46 0.00 0.00 42.92 41.89 3d7r s ASP 184 CO 0.71 -0.27 1.82 0.00 0.52 0.00 0.00 175.17 177.96 3d7r h ALA 185 N 8.06 1.00 0.00 3.66 0.00 -1.80 -2.54 119.26 127.64 3d7r h ALA 185 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.62 3d7r h ALA 185 Cb 1.09 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 3d7r h ALA 185 CO 0.39 0.00 -0.57 1.79 0.00 0.00 0.00 179.25 180.86 3d7r h THR 186 N 0.00 1.15 -6.65 0.00 1.35 -1.95 -3.37 112.91 103.44 3d7r h THR 186 Ca 0.00 -2.14 -0.53 0.00 -0.55 0.00 0.00 66.41 63.19 3d7r h THR 186 Cb 0.26 2.24 -0.14 0.00 -1.73 0.00 0.00 68.15 68.78 3d7r h THR 186 CO 0.00 0.55 -0.85 0.18 -0.25 0.00 0.00 175.52 175.15 3d7r n LEU 187 N -3.49 -1.91 -0.40 3.87 4.77 -0.96 -4.87 117.00 114.01 3d7r n LEU 187 Ca 0.00 -1.01 0.07 0.00 -0.03 0.00 0.00 56.01 55.05 3d7r n LEU 187 Cb 0.66 -2.14 0.01 0.00 -2.33 0.00 0.00 43.42 39.62 3d7r n LEU 187 CO 0.41 0.36 0.31 -1.54 -1.33 0.00 0.00 177.39 175.59 3d7r n SER 188 N -2.79 1.70 -4.69 -1.43 3.41 -1.26 -4.98 113.62 103.58 3d7r n SER 188 Ca -0.08 -1.35 -0.61 0.00 -0.26 0.00 0.00 58.87 56.57 3d7r n SER 188 Cb 0.57 0.36 -0.08 0.00 -0.26 0.00 0.00 64.21 64.79 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 0.09 1.53 0.07 4.04 2.85 -1.26 -4.81 115.26 117.77 3d7r n ASN 189 Ca 0.07 1.14 0.10 0.00 -0.11 0.00 0.00 54.58 55.77 3d7r n ASN 189 Cb 0.33 -1.02 0.42 0.00 1.24 0.00 0.00 39.78 40.75 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 4.02 0.11 0.00 1.20 2.85 -1.26 -1.49 118.16 123.58 3d7r n LYS 190 Ca 0.26 0.31 0.15 0.00 -1.05 0.00 0.00 58.31 57.98 3d7r n LYS 190 Cb 0.06 -1.69 0.88 0.00 -0.65 0.00 0.00 35.03 33.62 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 -1.89 0.00 -4.58 -5.58 8.00 -1.26 -4.63 116.55 106.60 3d7r n ASP 191 Ca 0.03 -0.84 -0.42 0.00 0.71 0.00 0.00 54.79 54.27 3d7r n ASP 191 Cb 0.23 -0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.27 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 -2.08 3.95 0.55 0.53 1.01 -0.56 -4.88 121.20 119.73 3d7r s ILE 192 Ca 0.43 0.83 -0.05 0.00 0.00 0.00 0.00 60.65 61.87 3d7r s ILE 192 Cb 0.21 -4.65 -0.00 0.00 0.01 0.00 0.00 42.46 38.02 3d7r s ILE 192 CO 0.36 -1.30 0.85 -0.94 0.00 0.00 0.00 174.94 173.91 3d7r s SER 193 N 3.36 5.75 0.25 3.58 1.04 -1.26 -4.92 113.70 121.50 3d7r s SER 193 Ca 0.45 0.70 -0.04 0.00 0.48 0.00 0.00 55.95 57.54 3d7r s SER 193 Cb -0.08 -1.79 0.37 0.00 0.10 0.00 0.00 66.02 64.61 3d7r s SER 193 CO 0.25 -0.93 1.85 0.44 0.98 0.00 0.00 173.24 175.83 3d7r h ASP 194 N -0.03 0.85 -0.47 7.02 3.32 -1.97 -0.84 116.42 124.30 3d7r h ASP 194 Ca -0.46 0.02 0.09 0.00 0.02 0.00 0.00 57.03 56.71 3d7r h ASP 194 Cb 1.25 -0.15 -0.09 0.00 0.22 0.00 0.00 39.33 40.56 3d7r h ASP 194 CO 0.60 0.53 -0.09 0.00 -1.72 0.00 0.00 179.24 178.57 3d7r h ALA 195 N 1.43 0.34 -0.42 3.45 0.00 -1.98 0.65 119.26 122.73 3d7r h ALA 195 Ca 0.39 0.17 -0.08 0.00 0.00 0.00 0.00 54.91 55.40 3d7r h ALA 195 Cb 0.22 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 3d7r h ALA 195 CO -0.19 -0.43 -0.05 1.25 0.00 0.00 0.00 179.25 179.83 3d7r h LEU 196 N 0.03 0.77 -0.64 0.00 5.85 -1.80 -2.66 115.31 116.86 3d7r h LEU 196 Ca 0.23 -0.34 0.08 0.00 0.84 0.00 0.00 57.88 58.70 3d7r h LEU 196 Cb 0.35 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.10 3d7r h LEU 196 CO -0.46 0.92 0.29 0.40 -0.34 0.00 0.00 178.44 179.26 3d7r h ILE 197 N 0.60 0.84 0.00 4.05 2.04 -0.72 -0.98 117.51 123.35 3d7r h ILE 197 Ca 0.11 -0.18 0.00 0.00 1.00 0.00 0.00 64.86 65.79 3d7r h ILE 197 Cb 0.56 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.91 3d7r h ILE 197 CO 0.03 0.10 0.00 -0.33 0.00 0.00 0.00 178.15 177.95 3d7r h GLU 198 N 0.52 0.00 0.00 2.37 4.39 -0.69 -2.56 114.58 118.62 3d7r h GLU 198 Ca 0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.01 3d7r h GLU 198 Cb 0.33 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 3d7r h GLU 198 CO -0.26 0.00 -0.68 1.04 -1.16 0.00 0.00 179.01 177.95 3d7r n GLN 199 N -2.49 0.19 -3.38 2.33 1.13 -0.39 -4.81 117.38 109.96 3d7r n GLN 199 Ca 0.01 0.04 -0.45 0.00 -1.94 0.00 0.00 57.00 54.66 3d7r n GLN 199 Cb 0.21 -1.60 -0.07 0.00 0.11 0.00 0.00 30.24 28.89 3d7r n GLN 199 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3d7r s ASP 200 N -3.74 6.11 -0.09 1.08 -1.08 -0.97 -4.82 116.67 113.16 3d7r s ASP 200 Ca 0.07 -1.55 0.14 0.00 -0.52 0.00 0.00 52.55 50.70 3d7r s ASP 200 Cb 0.15 -2.17 0.57 0.00 -1.46 0.00 0.00 42.92 40.01 3d7r s ASP 200 CO 0.73 -0.73 1.44 0.00 0.52 0.00 0.00 175.17 177.14 3d7r n ALA 201 N 5.19 3.00 0.01 3.66 0.00 -1.26 -4.38 120.51 126.72 3d7r n ALA 201 Ca -0.13 -1.24 -0.02 0.00 0.00 0.00 0.00 53.44 52.05 3d7r n ALA 201 Cb 0.42 -1.03 -0.01 0.00 0.00 0.00 0.00 19.45 18.84 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 0.82 0.56 -2.93 0.00 0.31 -1.26 -5.06 118.33 110.78 3d7r n VAL 202 Ca 0.20 0.12 -0.34 0.00 -0.01 0.00 0.00 64.34 64.31 3d7r n VAL 202 Cb 0.73 -1.58 -0.07 0.00 -0.91 0.00 0.00 33.84 32.02 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 -6.49 4.12 -0.04 7.52 1.43 -1.26 -4.58 118.68 119.38 3d7r s LEU 203 Ca -0.03 1.58 0.01 0.00 -1.03 0.00 0.00 54.13 54.66 3d7r s LEU 203 Cb 0.01 -4.17 0.02 0.00 0.03 0.00 0.00 46.19 42.08 3d7r s LEU 203 CO 0.04 -0.20 -0.06 -0.55 0.23 0.00 0.00 176.35 175.82 3d7r s SER 204 N -2.00 1.02 0.10 2.29 0.15 -1.26 -4.97 113.70 109.03 3d7r s SER 204 Ca 0.55 -0.15 -0.22 0.00 0.70 0.00 0.00 55.95 56.82 3d7r s SER 204 Cb -0.13 -0.47 -0.11 0.00 -1.71 0.00 0.00 66.02 63.60 3d7r s SER 204 CO 0.18 -0.03 1.72 -0.61 1.20 0.00 0.00 173.24 175.69 3d7r h GLN 205 N 7.06 -0.04 -0.27 5.44 4.15 -1.94 0.72 115.11 130.23 3d7r h GLN 205 Ca -0.37 0.00 0.06 0.00 0.77 0.00 0.00 58.65 59.11 3d7r h GLN 205 Cb 1.16 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 28.81 3d7r h GLN 205 CO 0.48 -0.03 -0.07 0.35 -1.93 0.00 0.00 178.83 177.63 3d7r h PHE 206 N -0.04 -0.16 0.27 3.99 3.57 -1.94 0.94 116.94 123.56 3d7r h PHE 206 Ca 0.03 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 3d7r h PHE 206 Cb 0.08 0.11 -0.00 0.00 2.79 0.00 0.00 35.95 38.94 3d7r h PHE 206 CO -0.13 -0.13 -0.16 0.78 -2.23 0.00 0.00 178.31 176.45 3d7r h GLY 207 N -0.01 -0.41 0.85 2.40 0.00 -1.65 -0.79 103.07 103.45 3d7r h GLY 207 Ca 0.13 0.17 0.02 0.00 0.00 0.00 0.00 47.33 47.65 3d7r h GLY 207 CO -0.29 -0.16 0.03 -2.08 0.00 0.00 0.00 176.54 174.05 3d7r h VAL 208 N -0.40 0.94 -0.21 4.60 2.07 -0.71 -1.73 116.25 120.81 3d7r h VAL 208 Ca -0.03 -0.03 0.04 0.00 0.82 0.00 0.00 66.70 67.50 3d7r h VAL 208 Cb 0.33 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 30.89 3d7r h VAL 208 CO 0.03 0.02 -0.05 0.78 0.02 0.00 0.00 177.57 178.37 3d7r h ASN 209 N 0.10 -0.20 -0.34 0.57 -0.26 -0.69 -3.13 115.58 111.63 3d7r h ASN 209 Ca 0.07 0.06 -0.13 0.00 -0.56 0.00 0.00 56.30 55.74 3d7r h ASN 209 Cb 0.05 0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.44 3d7r h ASN 209 CO -0.08 -0.07 -0.28 -0.33 -1.06 0.00 0.00 177.43 175.61 3d7r h GLU 210 N -0.00 0.79 -0.39 0.81 4.39 -0.98 -0.61 114.58 118.59 3d7r h GLU 210 Ca 0.10 -0.39 0.00 0.00 0.34 0.00 0.00 59.36 59.41 3d7r h GLU 210 Cb 0.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.81 3d7r h GLU 210 CO -0.22 1.02 0.00 -0.89 -1.16 0.00 0.00 179.01 177.77 3d7r n ILE 211 N -4.22 0.02 0.00 3.13 5.41 -0.66 -2.59 119.36 120.46 3d7r n ILE 211 Ca -0.03 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.72 3d7r n ILE 211 Cb 0.47 -0.16 0.00 0.00 -0.71 0.00 0.00 39.64 39.25 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 0.47 0.00 0.04 0.38 5.02 -0.24 -2.07 118.16 121.77 3d7r n LYS 213 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 3d7r n LYS 213 Cb 0.05 0.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.99 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 -0.03 -0.69 1.97 1.63 -1.76 -2.53 116.57 115.16 3d7r h LYS 214 Ca 0.00 0.00 -0.05 0.00 -0.85 0.00 0.00 60.65 59.75 3d7r h LYS 214 Cb 0.00 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.61 3d7r h LYS 214 CO 0.00 0.05 0.25 2.35 -3.45 0.00 0.00 179.45 178.64 3d7r h TRP 215 N -0.09 1.09 0.00 1.91 7.01 -1.71 -2.94 115.95 121.21 3d7r h TRP 215 Ca -0.00 -0.10 -0.02 0.00 2.11 0.00 0.00 58.89 60.88 3d7r h TRP 215 Cb 0.08 -0.32 -0.00 0.00 -2.10 0.00 0.00 29.16 26.82 3d7r h TRP 215 CO -0.06 0.86 -0.09 0.00 -2.79 0.00 0.00 178.44 176.36 3d7r h ALA 216 N 1.11 1.29 -6.13 2.65 0.00 -1.80 -1.30 119.26 115.07 3d7r h ALA 216 Ca 0.23 -0.08 -0.45 0.00 0.00 0.00 0.00 54.91 54.61 3d7r h ALA 216 Cb 0.26 -0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.06 3d7r h ALA 216 CO -0.01 0.11 -0.74 -1.71 0.00 0.00 0.00 179.25 176.90 3d7r n ASN 217 N -3.61 -5.04 0.00 0.00 5.15 -0.97 -2.20 115.26 108.60 3d7r n ASN 217 Ca -0.02 -0.70 0.00 0.00 -0.60 0.00 0.00 54.58 53.26 3d7r n ASN 217 Cb 0.21 -4.29 0.00 0.00 -0.53 0.00 0.00 39.78 35.16 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 -1.78 1.72 3.75 8.20 0.00 -1.26 -5.08 105.19 110.74 3d7r n GLY 218 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 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 4.56 0.51 0.99 1.43 -0.94 -5.01 118.68 120.22 3d7r s LEU 219 Ca 0.00 2.07 -0.22 0.00 -1.03 0.00 0.00 54.13 54.95 3d7r s LEU 219 Cb 0.00 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.55 3d7r s LEU 219 CO 0.00 -0.06 1.25 -2.16 0.23 0.00 0.00 176.35 175.60 3d7r s PRO 220 N -0.91 3.42 0.62 1.29 0.04 -1.26 -4.85 135.00 133.35 3d7r s PRO 220 Ca 0.45 1.96 0.39 0.00 0.04 0.00 0.00 61.00 63.84 3d7r s PRO 220 Cb -0.28 -2.29 2.09 0.00 0.04 0.00 0.00 34.50 34.06 3d7r s PRO 220 CO 0.35 -0.88 2.27 -0.07 0.04 0.00 0.00 177.00 178.71 3d7r h LEU 221 N 1.67 0.00 -0.10 -3.56 3.38 -1.99 -0.72 115.31 113.99 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 0.58 0.01 0.00 0.35 0.09 0.00 0.00 178.44 179.48 3d7r n THR 222 N -3.29 0.47 -1.65 0.22 -2.24 -1.26 -3.90 114.28 102.64 3d7r n THR 222 Ca -0.02 -0.03 -0.45 0.00 -2.27 0.00 0.00 64.05 61.28 3d7r n THR 222 Cb 0.12 -0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 67.63 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 -1.87 2.38 0.29 3.42 2.03 -0.28 -4.68 116.55 117.84 3d7r n ASP 223 Ca 0.05 1.15 0.17 0.00 0.52 0.00 0.00 54.79 56.69 3d7r n ASP 223 Cb 0.33 -1.39 0.86 0.00 -0.72 0.00 0.00 41.12 40.20 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 3.65 0.00 0.00 -0.67 2.10 -1.87 0.14 116.57 119.92 3d7r h LYS 224 Ca -0.44 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.13 3d7r h LYS 224 Cb 1.29 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.61 3d7r h LYS 224 CO 0.72 0.05 -0.36 0.00 -2.00 0.00 0.00 179.45 177.85 3d7r h ARG 225 N 0.00 0.00 0.07 0.07 3.08 -1.95 -3.08 114.38 112.58 3d7r h ARG 225 Ca -0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.70 3d7r h ARG 225 Cb 0.30 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 3d7r h ARG 225 CO 0.01 0.36 -2.01 -0.89 -1.07 0.00 0.00 179.97 176.38 3d7r n ILE 226 N -3.62 1.66 -3.87 2.04 5.41 0.03 -4.70 119.36 116.30 3d7r n ILE 226 Ca -0.01 -0.51 -0.31 0.00 1.00 0.00 0.00 62.75 62.93 3d7r n ILE 226 Cb 0.48 -1.74 -0.12 0.00 -0.71 0.00 0.00 39.64 37.55 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 -6.94 4.78 0.00 4.38 0.01 0.27 -4.54 113.70 111.67 3d7r s SER 227 Ca -0.27 -3.41 0.06 0.00 1.31 0.00 0.00 55.95 53.64 3d7r s SER 227 Cb 0.08 -1.69 0.27 0.00 0.21 0.00 0.00 66.02 64.88 3d7r s SER 227 CO 0.68 -0.18 1.20 -0.81 0.41 0.00 0.00 173.24 174.54 3d7r n PRO 228 N 2.61 0.00 0.09 12.44 -0.04 -1.08 -1.45 135.00 147.58 3d7r n PRO 228 Ca 0.13 0.40 0.19 0.00 -0.04 0.00 0.00 63.50 64.17 3d7r n PRO 228 Cb 0.34 -1.51 0.74 0.00 -0.04 0.00 0.00 33.50 33.04 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 0.58 -0.12 0.52 2.10 -1.76 -0.64 117.51 118.19 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 0.10 0.76 0.00 0.00 -1.09 0.00 0.00 36.82 36.59 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 -4.06 1.86 -3.79 2.19 3.02 -0.53 -4.97 115.26 108.99 3d7r n ASN 230 Ca 0.06 -1.68 -0.15 0.00 -0.03 0.00 0.00 54.58 52.78 3d7r n ASN 230 Cb 0.50 -0.07 0.07 0.00 -0.61 0.00 0.00 39.78 39.67 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 1.19 0.95 3.73 7.41 0.00 -0.25 -4.78 105.19 113.45 3d7r n GLY 231 Ca 0.17 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 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 -1.90 2.04 -0.14 2.61 2.01 -1.26 -4.93 115.64 114.08 3d7r s THR 232 Ca 0.44 0.03 -0.05 0.00 0.31 0.00 0.00 61.69 62.43 3d7r s THR 232 Cb -0.03 -3.02 -0.07 0.00 0.01 0.00 0.00 72.50 69.39 3d7r s THR 232 CO 0.29 0.00 -0.16 -0.38 -0.69 0.00 0.00 174.62 173.68 3d7r n ILE 233 N 3.12 0.76 -2.07 1.82 2.08 -1.26 -4.86 119.36 118.95 3d7r n ILE 233 Ca 0.12 -0.22 -0.42 0.00 0.56 0.00 0.00 62.75 62.79 3d7r n ILE 233 Cb 0.36 -1.50 -0.03 0.00 -0.75 0.00 0.00 39.64 37.72 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 -2.26 4.21 0.00 0.38 2.02 -1.26 -2.56 118.70 119.23 3d7r s GLU 234 Ca -0.19 2.13 0.00 0.00 0.02 0.00 0.00 54.97 56.93 3d7r s GLU 234 Cb 0.07 -3.83 0.00 0.00 0.10 0.00 0.00 34.13 30.47 3d7r s GLU 234 CO 0.26 -0.77 0.00 0.41 0.02 0.00 0.00 175.26 175.18 3d7r n GLY 235 N 3.98 0.47 3.74 -1.39 0.00 -1.26 -5.08 105.19 105.66 3d7r n GLY 235 Ca 0.16 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.82 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 3.56 0.94 0.99 1.43 -1.06 -5.03 118.68 119.51 3d7r s LEU 236 Ca 0.00 2.40 -0.14 0.00 -1.03 0.00 0.00 54.13 55.36 3d7r s LEU 236 Cb 0.00 -4.60 0.16 0.00 0.03 0.00 0.00 46.19 41.78 3d7r s LEU 236 CO 0.00 -1.80 1.17 -2.16 0.23 0.00 0.00 176.35 173.79 3d7r s PRO 237 N -3.50 0.92 0.30 1.29 0.04 -1.26 -4.91 135.00 127.88 3d7r s PRO 237 Ca 0.77 0.10 -0.29 0.00 0.04 0.00 0.00 61.00 61.62 3d7r s PRO 237 Cb -0.31 -1.83 -0.13 0.00 0.04 0.00 0.00 34.50 32.27 3d7r s PRO 237 CO 0.37 -2.31 1.32 -2.30 0.04 0.00 0.00 177.00 174.12 3d7r n PRO 238 N -3.81 2.04 -4.90 0.56 -0.01 -1.26 -4.75 135.00 122.88 3d7r n PRO 238 Ca 0.09 0.72 -0.33 0.00 -0.01 0.00 0.00 63.50 63.97 3d7r n PRO 238 Cb 0.60 -2.32 -0.13 0.00 -0.01 0.00 0.00 33.50 31.64 3d7r n PRO 238 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 175.50 175.57 3d7r s VAL 239 N -0.66 3.05 0.22 -1.45 1.01 -0.74 -1.52 120.40 120.32 3d7r s VAL 239 Ca 0.61 -0.73 0.06 0.00 0.00 0.00 0.00 61.98 61.92 3d7r s VAL 239 Cb -0.61 -2.19 -0.05 0.00 0.00 0.00 0.00 36.38 33.53 3d7r s VAL 239 CO 0.57 0.59 -0.09 -0.31 0.00 0.00 0.00 175.10 175.86 3d7r s TYR 240 N -0.72 1.69 -0.29 5.22 2.02 -0.18 -1.24 117.35 123.85 3d7r s TYR 240 Ca 0.11 -0.69 -0.24 0.00 -0.37 0.00 0.00 57.07 55.88 3d7r s TYR 240 Cb -0.11 -0.88 0.17 0.00 -0.40 0.00 0.00 41.96 40.75 3d7r s TYR 240 CO 0.00 0.24 1.30 -0.06 -1.57 0.00 0.00 175.55 175.46 3d7r s PHE 242 N -3.10 -0.20 0.21 2.71 0.08 0.50 -0.63 117.98 117.54 3d7r s PHE 242 Ca 0.25 0.47 -0.23 0.00 0.12 0.00 0.00 56.93 57.54 3d7r s PHE 242 Cb 0.02 0.41 0.06 0.00 -0.57 0.00 0.00 43.02 42.94 3d7r s PHE 242 CO 0.08 -0.09 0.92 0.20 -0.10 0.00 0.00 175.22 176.23 3d7r s GLY 243 N 0.20 -0.05 0.27 4.36 0.00 -0.91 0.54 107.32 111.74 3d7r s GLY 243 Ca 0.05 -0.16 0.10 0.00 0.00 0.00 0.00 44.72 44.70 3d7r s GLY 243 CO -0.13 0.52 -0.04 -0.32 0.00 0.00 0.00 173.10 173.13 3d7r s GLY 244 N -3.07 1.71 0.23 0.20 0.00 -1.26 -0.91 107.32 104.21 3d7r s GLY 244 Ca 0.15 -1.70 0.26 0.00 0.00 0.00 0.00 44.72 43.42 3d7r s GLY 244 CO 0.05 -1.77 1.76 -1.33 0.00 0.00 0.00 173.10 171.81 3d7r h GLY 245 N 1.96 0.00 -3.56 0.20 0.00 -0.73 -3.31 103.07 97.64 3d7r h GLY 245 Ca -0.43 0.00 -0.32 0.00 0.00 0.00 0.00 47.33 46.58 3d7r h GLY 245 CO 0.60 0.00 0.37 0.54 0.00 0.00 0.00 176.54 178.06 3d7r n ARG 246 N -2.33 2.95 0.00 4.80 1.74 -1.24 -4.94 116.66 117.63 3d7r n ARG 246 Ca 0.05 -3.07 0.00 0.00 -0.77 0.00 0.00 57.85 54.07 3d7r n ARG 246 Cb 0.44 -2.15 0.00 0.00 -1.02 0.00 0.00 32.46 29.73 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 -0.65 2.18 -0.03 5.56 0.28 -1.25 -3.75 120.64 122.99 3d7r n GLU 247 Ca 0.47 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.47 3d7r n GLU 247 Cb 1.45 0.00 0.00 0.00 1.43 0.00 0.00 31.44 34.32 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 -0.11 3.84 -2.24 -1.26 -4.70 114.28 109.81 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 -0.02 0.00 -2.10 0.00 0.00 70.33 68.18 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 0.53 -0.82 4.78 2.76 -1.92 -2.51 115.15 117.97 3d7r h HIS 250 Ca 0.00 -0.05 0.10 0.00 -2.20 0.00 0.00 60.37 58.23 3d7r h HIS 250 Cb 0.00 -0.16 -0.08 0.00 1.55 0.00 0.00 27.41 28.73 3d7r h HIS 250 CO 0.00 0.51 0.45 -1.35 -1.30 0.00 0.00 177.93 176.24 3d7r h PRO 251 N 0.40 0.72 -1.71 5.26 0.11 -1.90 -1.48 132.00 133.40 3d7r h PRO 251 Ca 0.11 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3d7r h PRO 251 Cb 0.21 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.16 3d7r h PRO 251 CO -0.01 0.48 0.00 -0.25 -0.21 0.00 0.00 178.00 178.01 3d7r n ASP 252 N -4.78 0.54 0.00 -2.05 8.00 -0.95 -0.90 116.55 116.41 3d7r n ASP 252 Ca 0.14 -0.37 0.00 0.00 0.71 0.00 0.00 54.79 55.26 3d7r n ASP 252 Cb 0.30 -0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 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 -0.09 -1.24 4.76 -0.56 -0.22 118.16 121.68 3d7r n LYS 254 Ca 0.00 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.35 3d7r n LYS 254 Cb 0.09 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.26 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 0.38 -0.35 -0.35 5.85 -1.28 -1.50 115.31 118.05 3d7r h LEU 255 Ca 0.00 -0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.68 3d7r h LEU 255 Cb 0.00 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 3d7r h LEU 255 CO 0.00 0.33 0.18 0.15 -0.34 0.00 0.00 178.44 178.76 3d7r h PHE 256 N 0.40 0.34 -0.77 1.25 3.57 -0.86 -2.66 116.94 118.22 3d7r h PHE 256 Ca 0.11 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.67 3d7r h PHE 256 Cb 0.02 -0.10 -0.05 0.00 2.79 0.00 0.00 35.95 38.60 3d7r h PHE 256 CO -0.04 0.19 0.47 1.49 -2.23 0.00 0.00 178.31 178.19 3d7r h GLU 257 N 0.38 0.86 -4.85 1.11 4.81 -1.76 -3.42 114.58 111.71 3d7r h GLU 257 Ca 0.14 -0.05 -0.52 0.00 -0.13 0.00 0.00 59.36 58.80 3d7r h GLU 257 Cb 0.04 -0.19 0.04 0.00 0.63 0.00 0.00 28.75 29.27 3d7r h GLU 257 CO -0.09 0.57 1.70 1.04 -0.73 0.00 0.00 179.01 181.50 3d7r n GLN 258 N -4.67 1.22 0.00 1.92 6.02 -0.58 -4.63 117.38 116.66 3d7r n GLN 258 Ca 0.10 -1.87 0.00 0.00 -0.01 0.00 0.00 57.00 55.22 3d7r n GLN 258 Cb 0.14 -3.13 0.00 0.00 1.02 0.00 0.00 30.24 28.28 3d7r n GLN 258 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 3d7r n LEU 261 N 10.26 0.00 -0.17 1.08 4.77 -1.26 -4.62 117.00 127.07 3d7r n LEU 261 Ca 0.47 0.00 0.16 0.00 -0.03 0.00 0.00 56.01 56.61 3d7r n LEU 261 Cb 0.43 0.00 0.51 0.00 -2.33 0.00 0.00 43.42 42.03 3d7r n LEU 261 CO 0.94 0.00 1.21 1.56 -1.33 0.00 0.00 177.39 179.78 3d7r h GLN 262 N 0.00 0.39 -0.64 3.23 4.20 -1.92 -1.35 115.11 119.03 3d7r h GLN 262 Ca 0.00 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.69 3d7r h GLN 262 Cb 0.00 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 27.69 3d7r h GLN 262 CO 0.00 0.26 0.00 0.72 -0.67 0.00 0.00 178.83 179.14 3d7r n HIS 263 N -4.48 1.77 -2.70 2.96 8.25 -1.26 -4.92 115.22 114.83 3d7r n HIS 263 Ca 0.15 -0.62 -0.21 0.00 -0.26 0.00 0.00 57.72 56.79 3d7r n HIS 263 Cb 0.55 -0.44 0.01 0.00 1.12 0.00 0.00 29.99 31.24 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 0.58 -1.44 -3.84 4.41 8.25 -0.51 -4.89 115.22 117.78 3d7r n HIS 264 Ca 0.24 0.27 -0.35 0.00 -0.26 0.00 0.00 57.72 57.61 3d7r n HIS 264 Cb 1.05 -4.10 -0.10 0.00 1.12 0.00 0.00 29.99 27.96 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 -5.34 4.01 0.06 -0.41 -1.52 -1.26 -5.01 119.66 110.19 3d7r s GLN 265 Ca 0.15 -0.32 -0.31 0.00 -1.95 0.00 0.00 55.36 52.94 3d7r s GLN 265 Cb -0.07 -3.35 -0.08 0.00 -0.22 0.00 0.00 33.01 29.29 3d7r s GLN 265 CO 0.19 0.17 1.73 -0.47 -0.25 0.00 0.00 175.29 176.66 3d7r s TYR 266 N 0.68 2.16 -0.10 0.91 5.04 -1.26 -3.99 117.35 120.79 3d7r s TYR 266 Ca 0.05 0.13 -0.06 0.00 -2.44 0.00 0.00 57.07 54.76 3d7r s TYR 266 Cb -0.13 -4.04 0.04 0.00 0.35 0.00 0.00 41.96 38.18 3d7r s TYR 266 CO 0.01 -4.28 0.23 -1.50 -1.34 0.00 0.00 175.55 168.67 3d7r s ILE 267 N 3.08 -0.03 -0.16 3.14 2.07 -1.26 -1.80 121.20 126.24 3d7r s ILE 267 Ca 0.77 0.11 -0.04 0.00 -1.41 0.00 0.00 60.65 60.08 3d7r s ILE 267 Cb -0.41 -0.35 -0.03 0.00 0.13 0.00 0.00 42.46 41.81 3d7r s ILE 267 CO 0.34 0.04 -0.03 -1.61 -1.91 0.00 0.00 174.94 171.77 3d7r s GLU 268 N 0.91 3.65 -0.26 3.50 2.02 -0.37 -4.99 118.70 123.16 3d7r s GLU 268 Ca -0.06 -0.53 0.00 0.00 0.02 0.00 0.00 54.97 54.40 3d7r s GLU 268 Cb -0.08 -2.93 0.04 0.00 0.10 0.00 0.00 34.13 31.26 3d7r s GLU 268 CO -0.06 0.20 -0.08 0.12 0.02 0.00 0.00 175.26 175.46 3d7r s PHE 269 N 0.48 3.15 -0.58 1.61 5.36 -1.26 -4.26 117.98 122.48 3d7r s PHE 269 Ca -0.03 -1.89 -0.19 0.00 -0.96 0.00 0.00 56.93 53.86 3d7r s PHE 269 Cb -0.14 -2.02 0.09 0.00 -0.34 0.00 0.00 43.02 40.61 3d7r s PHE 269 CO 0.03 -0.80 0.72 0.71 -1.46 0.00 0.00 175.22 174.41 3d7r s TYR 270 N 1.23 2.97 -0.32 10.12 2.02 -1.26 -5.02 117.35 127.10 3d7r s TYR 270 Ca -0.04 -0.78 -0.06 0.00 -0.37 0.00 0.00 57.07 55.82 3d7r s TYR 270 Cb -0.18 -3.92 0.03 0.00 -0.40 0.00 0.00 41.96 37.49 3d7r s TYR 270 CO -0.05 -1.27 0.08 0.34 -1.57 0.00 0.00 175.55 173.09 3d7r s ASP 271 N 3.36 5.18 -0.51 2.29 -1.08 -1.26 -2.13 116.67 122.52 3d7r s ASP 271 Ca 0.14 -0.98 -0.16 0.00 -0.52 0.00 0.00 52.55 51.03 3d7r s ASP 271 Cb -0.22 -1.86 0.10 0.00 -1.46 0.00 0.00 42.92 39.48 3d7r s ASP 271 CO 0.08 -0.27 0.48 -0.31 0.52 0.00 0.00 175.17 175.68 3d7r s TYR 272 N 1.43 3.21 0.48 -5.34 2.02 -0.09 -4.96 117.35 114.09 3d7r s TYR 272 Ca -0.00 -1.05 0.21 0.00 -0.37 0.00 0.00 57.07 55.86 3d7r s TYR 272 Cb -0.19 -3.53 1.23 0.00 -0.40 0.00 0.00 41.96 39.08 3d7r s TYR 272 CO 0.02 -0.95 1.94 -1.35 -1.57 0.00 0.00 175.55 173.64 3d7r h PRO 273 N 8.87 0.21 -2.31 -1.71 0.11 -1.92 0.71 132.00 135.95 3d7r h PRO 273 Ca -0.29 -0.01 -0.78 0.00 0.11 0.00 0.00 66.00 65.03 3d7r h PRO 273 Cb 1.10 -0.05 -0.29 0.00 0.11 0.00 0.00 31.00 31.87 3d7r h PRO 273 CO 0.97 0.14 0.78 1.63 -0.21 0.00 0.00 178.00 181.31 3d7r n LYS 274 N -4.42 5.04 -4.34 1.05 4.01 -1.26 -2.93 118.16 115.31 3d7r n LYS 274 Ca 0.14 -4.69 -0.18 0.00 -0.51 0.00 0.00 58.31 53.07 3d7r n LYS 274 Cb 0.63 -2.44 -0.10 0.00 -0.51 0.00 0.00 35.03 32.61 3d7r n LYS 274 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 3d7r s VAL 276 N -4.19 0.48 0.11 -0.18 -7.23 -1.26 -4.73 120.40 103.39 3d7r s VAL 276 Ca 0.40 -2.00 -0.36 0.00 -1.81 0.00 0.00 61.98 58.21 3d7r s VAL 276 Cb 0.19 -2.57 -0.15 0.00 0.56 0.00 0.00 36.38 34.41 3d7r s VAL 276 CO -0.11 0.00 1.45 1.57 -0.31 0.00 0.00 175.10 177.71 3d7r n HIS 277 N -0.56 1.85 -2.14 2.82 -0.00 -1.26 -2.35 115.22 113.59 3d7r n HIS 277 Ca 0.00 0.47 -0.15 0.00 0.46 0.00 0.00 57.72 58.50 3d7r n HIS 277 Cb 0.66 -2.43 -0.02 0.00 -0.12 0.00 0.00 29.99 28.08 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 3.01 -4.61 -0.06 0.26 2.03 -1.26 -4.88 116.55 111.04 3d7r n ASP 278 Ca 0.18 0.05 0.21 0.00 0.52 0.00 0.00 54.79 55.75 3d7r n ASP 278 Cb 0.23 -3.70 0.67 0.00 -0.72 0.00 0.00 41.12 37.61 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 0.07 0.00 -0.67 -5.15 -1.88 -2.12 116.94 107.19 3d7r h PHE 279 Ca -0.35 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.42 3d7r h PHE 279 Cb 1.22 -0.02 0.00 0.00 0.22 0.00 0.00 35.95 37.37 3d7r h PHE 279 CO 0.41 0.02 0.00 -1.35 -2.00 0.00 0.00 178.31 175.39 3d7r h PRO 280 N 0.06 0.00 0.00 6.09 0.11 -1.89 -1.47 132.00 134.89 3d7r h PRO 280 Ca 0.30 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.41 3d7r h PRO 280 Cb 1.13 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.23 3d7r h PRO 280 CO -0.02 0.00 -0.02 -0.84 -0.21 0.00 0.00 178.00 176.91 3d7r h ILE 281 N 0.00 0.07 -3.54 4.15 3.07 -1.72 -3.45 117.51 116.09 3d7r h ILE 281 Ca 0.00 -0.48 -0.52 0.00 1.55 0.00 0.00 64.86 65.41 3d7r h ILE 281 Cb 0.02 1.44 -0.03 0.00 -0.27 0.00 0.00 36.82 37.99 3d7r h ILE 281 CO 0.00 0.02 0.11 -0.31 -1.05 0.00 0.00 178.15 176.92 3d7r s TYR 282 N -3.77 3.70 -1.32 0.16 2.02 -0.56 -4.81 117.35 112.77 3d7r s TYR 282 Ca -0.00 1.42 -0.12 0.00 -0.37 0.00 0.00 57.07 58.01 3d7r s TYR 282 Cb 0.10 -2.64 0.13 0.00 -0.40 0.00 0.00 41.96 39.15 3d7r s TYR 282 CO 0.53 0.38 1.89 -0.35 -1.57 0.00 0.00 175.55 176.43 3d7r n PRO 283 N 0.92 3.36 -4.30 -1.71 -0.04 -1.26 -4.65 135.00 127.31 3d7r n PRO 283 Ca -0.03 -3.32 -0.17 0.00 -0.04 0.00 0.00 63.50 59.94 3d7r n PRO 283 Cb 0.51 -3.08 -0.10 0.00 -0.04 0.00 0.00 33.50 30.79 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 1.55 1.46 0.32 0.52 -4.36 -1.26 -5.05 121.20 114.37 3d7r s ILE 284 Ca 0.43 -2.14 0.06 0.00 -0.26 0.00 0.00 60.65 58.74 3d7r s ILE 284 Cb 0.08 -1.98 0.31 0.00 1.25 0.00 0.00 42.46 42.12 3d7r s ILE 284 CO -0.01 -0.65 1.82 0.03 0.24 0.00 0.00 174.94 176.37 3d7r h ARG 285 N 2.65 0.78 -0.20 0.37 2.47 -2.00 -1.79 114.38 116.65 3d7r h ARG 285 Ca -0.37 -0.05 -0.05 0.00 -1.26 0.00 0.00 59.98 58.25 3d7r h ARG 285 Cb 1.21 -0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 29.34 3d7r h ARG 285 CO 0.63 0.51 -0.11 1.96 0.56 0.00 0.00 179.97 183.52 3d7r h GLN 286 N 0.80 0.32 -0.49 0.04 7.50 -1.96 -0.64 115.11 120.67 3d7r h GLN 286 Ca 0.52 -0.07 -0.08 0.00 0.50 0.00 0.00 58.65 59.52 3d7r h GLN 286 Cb 0.76 -0.04 -0.02 0.00 0.05 0.00 0.00 27.48 28.23 3d7r h GLN 286 CO -0.29 0.44 -0.00 0.77 -1.50 0.00 0.00 178.83 178.24 3d7r h SER 287 N 0.30 0.85 -0.69 1.46 0.02 -1.59 -0.69 113.55 113.21 3d7r h SER 287 Ca 0.06 -0.31 -0.05 0.00 -0.84 0.00 0.00 61.79 60.65 3d7r h SER 287 Cb 0.39 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.67 3d7r h SER 287 CO 0.02 0.95 0.22 0.45 -1.14 0.00 0.00 176.83 177.33 3d7r h HIS 288 N 0.72 1.11 -0.42 3.45 3.86 -1.23 -0.55 115.15 122.09 3d7r h HIS 288 Ca 0.14 -0.10 0.01 0.00 -1.16 0.00 0.00 60.37 59.25 3d7r h HIS 288 Cb 0.52 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.64 3d7r h HIS 288 CO 0.04 0.88 0.27 -0.22 0.86 0.00 0.00 177.93 179.76 3d7r h LYS 289 N 1.04 0.53 -0.76 2.45 3.64 -0.88 -0.87 116.57 121.71 3d7r h LYS 289 Ca 0.23 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.54 3d7r h LYS 289 Cb 0.29 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 3d7r h LYS 289 CO -0.01 0.35 0.33 0.00 -2.27 0.00 0.00 179.45 177.84 3d7r h ALA 290 N 1.17 0.99 -0.44 5.00 0.00 -0.75 -1.16 119.26 124.07 3d7r h ALA 290 Ca 0.16 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 3d7r h ALA 290 Cb -0.03 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 3d7r h ALA 290 CO -0.05 0.59 0.24 0.82 0.00 0.00 0.00 179.25 180.85 3d7r h ILE 291 N 1.09 1.16 -0.89 0.00 2.04 -0.88 -0.49 117.51 119.54 3d7r h ILE 291 Ca 0.26 -0.40 0.04 0.00 1.00 0.00 0.00 64.86 65.76 3d7r h ILE 291 Cb 0.18 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 36.83 3d7r h ILE 291 CO -0.02 0.16 0.57 0.50 0.00 0.00 0.00 178.15 179.36 3d7r h LYS 292 N 0.57 1.06 -0.36 2.37 3.64 -0.85 0.31 116.57 123.31 3d7r h LYS 292 Ca 0.15 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.41 3d7r h LYS 292 Cb 0.05 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.61 3d7r h LYS 292 CO -0.03 0.70 -0.03 1.96 -2.27 0.00 0.00 179.45 179.78 3d7r h GLN 293 N 1.09 0.58 -0.19 1.90 4.20 -0.81 0.15 115.11 122.02 3d7r h GLN 293 Ca 0.36 -0.14 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 3d7r h GLN 293 Cb 0.05 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 3d7r h GLN 293 CO -0.13 0.62 0.08 0.82 -0.67 0.00 0.00 178.83 179.55 3d7r h ILE 294 N 0.55 1.16 -0.84 2.54 2.04 -0.37 -2.59 117.51 120.00 3d7r h ILE 294 Ca 0.11 -0.49 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 3d7r h ILE 294 Cb 0.40 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 37.57 3d7r h ILE 294 CO 0.02 0.16 0.42 0.00 0.00 0.00 0.00 178.15 178.75 3d7r h ALA 295 N 0.92 1.07 0.00 1.87 0.00 -0.47 -1.09 119.26 121.56 3d7r h ALA 295 Ca 0.06 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 3d7r h ALA 295 Cb 0.18 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3d7r h ALA 295 CO -0.01 0.62 -0.27 -0.22 0.00 0.00 0.00 179.25 179.38 3d7r h LYS 296 N 1.18 0.00 0.00 0.00 3.64 -0.71 -3.31 116.57 117.37 3d7r h LYS 296 Ca 0.29 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.54 3d7r h LYS 296 Cb 0.09 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 3d7r h LYS 296 CO -0.04 0.27 -2.05 -1.13 -2.27 0.00 0.00 179.45 174.23 3d7r n SER 297 N -3.42 0.08 0.21 4.20 3.41 -0.96 -4.63 113.62 112.51 3d7r n SER 297 Ca 0.00 0.03 0.04 0.00 -0.26 0.00 0.00 58.87 58.69 3d7r n SER 297 Cb 0.46 1.53 0.45 0.00 -0.26 0.00 0.00 64.21 66.39 3d7r n SER 297 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 3d7r h ILE 298 N 0.00 1.14 -0.13 -1.33 2.10 -1.30 -2.27 117.51 115.73 3d7r h ILE 298 Ca -0.18 -0.96 0.00 0.00 1.08 0.00 0.00 64.86 64.80 3d7r h ILE 298 Cb 1.42 1.53 0.00 0.00 -1.09 0.00 0.00 36.82 38.68 3d7r h ILE 298 CO 0.01 0.27 0.00 0.47 -1.08 0.00 0.00 178.15 177.82 3d7r n ASP 299 N -4.13 2.34 -4.68 2.19 8.00 -1.26 -4.95 116.55 114.06 3d7r n ASP 299 Ca -0.02 -1.78 -0.46 0.00 0.71 0.00 0.00 54.79 53.24 3d7r n ASP 299 Cb 0.33 -0.07 -0.04 0.00 -0.02 0.00 0.00 41.12 41.32 3d7r n ASP 299 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3d7r n GLU 300 N 0.79 2.27 -1.71 -1.24 2.13 -0.86 -4.90 120.64 117.12 3d7r n GLU 300 Ca 0.17 0.82 -0.42 0.00 0.66 0.00 0.00 57.16 58.39 3d7r n GLU 300 Cb 0.47 -2.62 -0.03 0.00 0.27 0.00 0.00 31.44 29.53 3d7r n GLU 300 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3d7r s ASP 301 N 1.58 6.42 -0.07 4.31 2.15 -1.26 -4.96 116.67 124.84 3d7r s ASP 301 Ca 0.81 2.77 -0.29 0.00 0.43 0.00 0.00 52.55 56.27 3d7r s ASP 301 Cb -0.65 -2.57 -0.02 0.00 -0.30 0.00 0.00 42.92 39.38 3d7r s ASP 301 CO 0.39 -1.00 0.98 -0.69 -0.17 0.00 0.00 175.17 174.68 3d7r s VAL 302 N 2.56 4.83 -2.07 1.11 1.01 -1.26 -5.22 120.40 121.35 3d7r s VAL 302 Ca 0.80 2.01 0.31 0.00 0.00 0.00 0.00 61.98 65.11 3d7r s VAL 302 Cb -0.46 -4.30 0.86 0.00 0.00 0.00 0.00 36.38 32.48 3d7r s VAL 302 CO 0.36 0.07 2.16 0.41 0.00 0.00 0.00 175.10 178.10