#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a7r s PRO 2 N 0.00 2.80 0.09 0.03 0.04 -1.26 -5.20 135.00 131.50 2a7r s PRO 2 Ca 0.00 -0.38 0.07 0.00 0.04 0.00 0.00 61.00 60.73 2a7r s PRO 2 Cb 0.00 -2.41 -0.03 0.00 0.04 0.00 0.00 34.50 32.10 2a7r s PRO 2 CO 0.00 -0.62 -0.18 -1.01 0.04 0.00 0.00 177.00 175.23 2a7r s HIS 3 N -2.82 1.54 -0.14 0.56 4.02 -1.26 -5.13 115.29 112.06 2a7r s HIS 3 Ca 0.53 -0.44 -0.09 0.00 1.02 0.00 0.00 55.06 56.08 2a7r s HIS 3 Cb -0.10 -0.85 -0.04 0.00 -1.02 0.00 0.00 32.58 30.56 2a7r s HIS 3 CO 0.41 0.14 0.17 0.42 1.02 0.00 0.00 174.74 176.91 2a7r s ILE 4 N -1.25 5.42 -0.13 0.60 1.01 -1.26 -5.05 121.20 120.54 2a7r s ILE 4 Ca 0.03 0.28 -0.29 0.00 0.00 0.00 0.00 60.65 60.67 2a7r s ILE 4 Cb -0.10 -3.47 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 2a7r s ILE 4 CO 0.03 0.54 1.16 -0.62 0.00 0.00 0.00 174.94 176.05 2a7r s ASP 5 N -0.48 7.06 0.09 3.58 -1.08 -1.26 -4.94 116.67 119.64 2a7r s ASP 5 Ca 0.14 1.65 -0.29 0.00 -0.52 0.00 0.00 52.55 53.53 2a7r s ASP 5 Cb -0.12 -2.55 -0.14 0.00 -1.46 0.00 0.00 42.92 38.65 2a7r s ASP 5 CO 0.03 -0.63 1.65 0.78 0.52 0.00 0.00 175.17 177.52 2a7r h ASN 6 N 7.61 -0.65 -2.55 -0.34 -0.26 -2.08 -3.42 115.58 113.89 2a7r h ASN 6 Ca -0.29 0.05 -0.53 0.00 -0.56 0.00 0.00 56.30 54.97 2a7r h ASN 6 Cb 1.12 0.21 0.02 0.00 -1.06 0.00 0.00 38.32 38.62 2a7r h ASN 6 CO 0.92 -0.38 1.10 -0.62 -1.06 0.00 0.00 177.43 177.39 2a7r s ASP 7 N -4.70 6.52 -0.15 5.81 2.15 -1.26 -4.95 116.67 120.08 2a7r s ASP 7 Ca -0.16 2.59 -0.29 0.00 0.43 0.00 0.00 52.55 55.12 2a7r s ASP 7 Cb 0.06 -2.55 -0.00 0.00 -0.30 0.00 0.00 42.92 40.12 2a7r s ASP 7 CO 0.64 -0.97 1.01 -0.69 -0.17 0.00 0.00 175.17 174.99 2a7r s VAL 8 N 3.29 4.75 0.06 1.11 1.01 -1.26 -5.01 120.40 124.35 2a7r s VAL 8 Ca 0.80 2.01 -0.30 0.00 0.00 0.00 0.00 61.98 64.49 2a7r s VAL 8 Cb -0.42 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.62 2a7r s VAL 8 CO 0.35 -0.06 0.98 -0.54 0.00 0.00 0.00 175.10 175.83 2a7r s LYS 9 N 2.44 4.63 0.20 2.72 3.01 -1.26 -5.05 119.74 126.43 2a7r s LYS 9 Ca 0.46 1.45 0.10 0.00 -1.01 0.00 0.00 55.97 56.96 2a7r s LYS 9 Cb -0.17 -3.41 -0.04 0.00 -1.01 0.00 0.00 37.83 33.20 2a7r s LYS 9 CO 0.13 0.09 -0.12 -0.48 0.51 0.00 0.00 175.35 175.49 2a7r s LEU 10 N 0.44 2.88 0.57 3.17 0.05 -1.26 -4.87 118.68 119.66 2a7r s LEU 10 Ca 0.49 -0.66 0.09 0.00 0.05 0.00 0.00 54.13 54.10 2a7r s LEU 10 Cb -0.23 -1.55 0.08 0.00 -2.05 0.00 0.00 46.19 42.45 2a7r s LEU 10 CO 0.29 0.09 0.69 -1.81 -0.55 0.00 0.00 176.35 175.06 2a7r s ASP 11 N -2.93 4.95 0.37 1.48 1.11 -1.26 -1.82 116.67 118.57 2a7r s ASP 11 Ca 0.25 -0.98 0.11 0.00 0.18 0.00 0.00 52.55 52.12 2a7r s ASP 11 Cb -0.08 0.37 0.90 0.00 1.07 0.00 0.00 42.92 45.18 2a7r s ASP 11 CO 0.15 -1.30 1.84 -0.26 1.18 0.00 0.00 175.17 176.78 2a7r h PHE 12 N 0.32 0.78 -0.89 4.23 0.05 -1.94 -1.31 116.94 118.18 2a7r h PHE 12 Ca -0.31 0.02 -0.02 0.00 3.82 0.00 0.00 57.97 61.48 2a7r h PHE 12 Cb 1.29 -0.24 -0.04 0.00 2.00 0.00 0.00 35.95 38.96 2a7r h PHE 12 CO 0.59 0.23 0.49 0.87 -0.18 0.00 0.00 178.31 180.32 2a7r h LYS 13 N 0.61 1.24 0.00 1.51 1.57 -1.98 -2.58 116.57 116.94 2a7r h LYS 13 Ca 0.49 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 59.13 2a7r h LYS 13 Cb 0.93 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 33.00 2a7r h LYS 13 CO -0.24 0.90 0.00 -0.25 -0.57 0.00 0.00 179.45 179.29 2a7r n ASP 14 N -4.33 0.00 -3.83 0.86 8.00 -0.49 -4.84 116.55 111.92 2a7r n ASP 14 Ca 0.10 -1.32 -0.09 0.00 0.71 0.00 0.00 54.79 54.18 2a7r n ASP 14 Cb 0.09 0.00 -0.06 0.00 -0.02 0.00 0.00 41.12 41.13 2a7r n ASP 14 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2a7r s VAL 15 N -2.00 0.10 0.16 2.53 0.11 -0.97 -1.61 120.40 118.71 2a7r s VAL 15 Ca 0.02 -1.08 -0.02 0.00 -2.93 0.00 0.00 61.98 57.98 2a7r s VAL 15 Cb 0.01 -1.47 -0.04 0.00 -1.53 0.00 0.00 36.38 33.36 2a7r s VAL 15 CO 0.02 -0.43 0.11 -0.76 -3.33 0.00 0.00 175.10 170.70 2a7r s LEU 16 N -2.88 1.48 -0.23 2.54 1.43 -0.57 -4.91 118.68 115.54 2a7r s LEU 16 Ca 0.08 -1.24 -0.09 0.00 -1.03 0.00 0.00 54.13 51.86 2a7r s LEU 16 Cb 0.03 0.42 -0.04 0.00 0.03 0.00 0.00 46.19 46.63 2a7r s LEU 16 CO -0.07 -0.79 0.11 -0.76 0.23 0.00 0.00 176.35 175.06 2a7r s LEU 17 N -3.08 3.83 -0.07 1.79 1.02 -1.26 -1.03 118.68 119.88 2a7r s LEU 17 Ca 0.29 0.01 -0.30 0.00 0.02 0.00 0.00 54.13 54.15 2a7r s LEU 17 Cb 0.07 -2.01 -0.03 0.00 0.02 0.00 0.00 46.19 44.24 2a7r s LEU 17 CO 0.05 0.07 1.23 -0.60 0.02 0.00 0.00 176.35 177.12 2a7r s ARG 18 N 1.02 4.32 0.79 1.70 3.52 -0.71 -4.95 118.95 124.64 2a7r s ARG 18 Ca 0.05 1.69 -0.14 0.00 -0.13 0.00 0.00 55.73 57.20 2a7r s ARG 18 Cb -0.14 -3.60 0.07 0.00 -1.56 0.00 0.00 34.95 29.72 2a7r s ARG 18 CO 0.04 -0.51 1.22 -2.14 -0.81 0.00 0.00 175.30 173.10 2a7r s PRO 19 N 2.48 1.74 -0.01 5.12 0.02 -1.26 -4.74 135.00 138.34 2a7r s PRO 19 Ca 0.56 1.82 -0.05 0.00 0.02 0.00 0.00 61.00 63.35 2a7r s PRO 19 Cb -0.25 -1.78 0.00 0.00 0.02 0.00 0.00 34.50 32.50 2a7r s PRO 19 CO 0.21 -2.15 0.11 0.15 -0.33 0.00 0.00 177.00 174.99 2a7r s LYS 20 N -4.02 0.34 0.51 5.54 1.02 0.42 -4.96 119.74 118.59 2a7r s LYS 20 Ca 0.75 -0.23 -0.23 0.00 0.02 0.00 0.00 55.97 56.28 2a7r s LYS 20 Cb -0.30 0.14 -0.07 0.00 -0.52 0.00 0.00 37.83 37.08 2a7r s LYS 20 CO 0.49 -0.07 1.32 2.89 -0.92 0.00 0.00 175.35 179.06 2a7r n ARG 21 N 2.03 1.77 -2.78 1.68 -4.01 -1.26 -4.37 116.66 109.71 2a7r n ARG 21 Ca -0.19 0.64 -0.06 0.00 -1.04 0.00 0.00 57.85 57.20 2a7r n ARG 21 Cb 0.57 -2.51 0.01 0.00 -3.04 0.00 0.00 32.46 27.49 2a7r n ARG 21 CO 0.00 0.00 0.00 -1.13 -3.04 0.00 0.00 177.63 173.46 2a7r n SER 22 N -0.58 -1.26 -0.08 2.89 3.41 -1.26 -4.70 113.62 112.03 2a7r n SER 22 Ca 0.09 -2.02 0.03 0.00 -0.26 0.00 0.00 58.87 56.71 2a7r n SER 22 Cb 0.43 2.15 0.04 0.00 -0.26 0.00 0.00 64.21 66.57 2a7r n SER 22 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2a7r n THR 23 N -0.33 0.97 -1.89 6.66 -2.24 -1.26 -5.07 114.28 111.12 2a7r n THR 23 Ca -0.04 -1.09 -0.41 0.00 -2.27 0.00 0.00 64.05 60.24 2a7r n THR 23 Cb 0.36 0.37 -0.02 0.00 -2.10 0.00 0.00 70.33 68.94 2a7r n THR 23 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2a7r s LEU 24 N -1.27 4.36 0.00 3.22 1.43 -1.26 -5.00 118.68 120.17 2a7r s LEU 24 Ca 0.09 2.81 0.00 0.00 -1.03 0.00 0.00 54.13 56.01 2a7r s LEU 24 Cb 0.08 -3.63 0.00 0.00 0.03 0.00 0.00 46.19 42.67 2a7r s LEU 24 CO 0.01 -0.81 0.00 2.29 0.23 0.00 0.00 176.35 178.07 2a7r n LYS 25 N 2.27 0.00 -4.49 1.70 -0.00 -1.26 -4.99 118.16 111.39 2a7r n LYS 25 Ca 0.08 0.00 -0.23 0.00 -0.00 0.00 0.00 58.31 58.15 2a7r n LYS 25 Cb 0.39 -0.36 -0.10 0.00 -0.00 0.00 0.00 35.03 34.96 2a7r n LYS 25 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2a7r s SER 26 N -1.88 2.71 0.38 -5.58 0.15 -1.26 -5.01 113.70 103.20 2a7r s SER 26 Ca 0.00 -1.41 0.20 0.00 0.70 0.00 0.00 55.95 55.45 2a7r s SER 26 Cb 0.00 -0.08 1.10 0.00 -1.71 0.00 0.00 66.02 65.33 2a7r s SER 26 CO 0.00 -0.61 1.57 0.03 1.20 0.00 0.00 173.24 175.43 2a7r h ARG 27 N 2.01 0.00 0.00 5.44 2.47 -1.94 0.22 114.38 122.58 2a7r h ARG 27 Ca -0.41 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.16 2a7r h ARG 27 Cb 1.25 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 29.55 2a7r h ARG 27 CO 0.71 0.00 -0.71 0.66 0.56 0.00 0.00 179.97 181.19 2a7r h SER 28 N 0.00 0.00 0.00 7.04 4.64 -1.94 -3.19 113.55 120.09 2a7r h SER 28 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2a7r h SER 28 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2a7r h SER 28 CO 0.00 0.71 0.00 -0.62 -0.87 0.00 0.00 176.83 176.05 2a7r n GLU 29 N -3.43 0.58 -3.86 4.77 4.71 0.06 -4.72 120.64 118.75 2a7r n GLU 29 Ca 0.00 0.00 -0.35 0.00 -0.01 0.00 0.00 57.16 56.80 2a7r n GLU 29 Cb 0.77 -1.10 -0.10 0.00 -1.01 0.00 0.00 31.44 30.00 2a7r n GLU 29 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 2a7r s VAL 30 N -1.67 4.91 -0.40 2.62 1.01 -1.21 -4.83 120.40 120.83 2a7r s VAL 30 Ca 0.00 0.02 -0.14 0.00 0.00 0.00 0.00 61.98 61.85 2a7r s VAL 30 Cb 0.00 -3.25 0.02 0.00 0.00 0.00 0.00 36.38 33.15 2a7r s VAL 30 CO 0.00 0.41 0.28 -0.62 0.00 0.00 0.00 175.10 175.17 2a7r s ASP 31 N 0.74 6.05 -0.04 3.32 3.68 -0.60 -4.95 116.67 124.87 2a7r s ASP 31 Ca 0.05 -0.90 0.08 0.00 2.13 0.00 0.00 52.55 53.91 2a7r s ASP 31 Cb -0.13 -2.14 0.31 0.00 -1.45 0.00 0.00 42.92 39.51 2a7r s ASP 31 CO 0.02 -0.43 1.15 0.18 0.13 0.00 0.00 175.17 176.22 2a7r n LEU 32 N 5.14 2.28 -4.94 -1.34 4.77 -1.26 -1.38 117.00 120.27 2a7r n LEU 32 Ca -0.11 -1.15 -0.26 0.00 -0.03 0.00 0.00 56.01 54.46 2a7r n LEU 32 Cb 0.47 -0.37 -0.03 0.00 -2.33 0.00 0.00 43.42 41.16 2a7r n LEU 32 CO 0.40 0.42 -0.10 0.42 -1.33 0.00 0.00 177.39 177.20 2a7r s THR 33 N -1.65 5.29 0.01 -5.08 -4.23 -1.26 -4.22 115.64 104.50 2a7r s THR 33 Ca 0.22 -0.69 -0.00 0.00 -1.18 0.00 0.00 61.69 60.04 2a7r s THR 33 Cb 0.14 -3.71 -0.01 0.00 1.34 0.00 0.00 72.50 70.25 2a7r s THR 33 CO 0.11 -0.08 -0.01 -0.13 -0.54 0.00 0.00 174.62 173.97 2a7r s ARG 34 N -3.19 0.24 -0.21 3.99 0.52 -0.63 -4.63 118.95 115.04 2a7r s ARG 34 Ca 0.34 -0.44 -0.06 0.00 -0.52 0.00 0.00 55.73 55.05 2a7r s ARG 34 Cb -0.11 0.09 -0.03 0.00 0.52 0.00 0.00 34.95 35.42 2a7r s ARG 34 CO 0.28 -0.04 0.03 -1.12 0.02 0.00 0.00 175.30 174.47 2a7r s SER 35 N -1.08 5.04 0.06 0.23 0.01 -1.26 -2.96 113.70 113.74 2a7r s SER 35 Ca -0.12 -0.16 0.07 0.00 1.31 0.00 0.00 55.95 57.05 2a7r s SER 35 Cb -0.07 -1.87 -0.03 0.00 0.21 0.00 0.00 66.02 64.25 2a7r s SER 35 CO -0.01 0.05 -0.20 -0.36 0.41 0.00 0.00 173.24 173.14 2a7r s PHE 36 N 1.07 1.70 -0.32 2.43 2.99 -0.81 -4.97 117.98 120.07 2a7r s PHE 36 Ca 0.03 -0.39 0.02 0.00 0.00 0.00 0.00 56.93 56.59 2a7r s PHE 36 Cb -0.14 -0.98 0.10 0.00 0.00 0.00 0.00 43.02 41.99 2a7r s PHE 36 CO 0.02 0.12 0.05 -1.54 -0.00 0.00 0.00 175.22 173.87 2a7r s SER 37 N -1.44 4.45 0.23 1.36 1.04 -1.26 -0.77 113.70 117.30 2a7r s SER 37 Ca 0.06 -1.89 -0.31 0.00 0.48 0.00 0.00 55.95 54.29 2a7r s SER 37 Cb -0.09 -1.35 -0.11 0.00 0.10 0.00 0.00 66.02 64.57 2a7r s SER 37 CO 0.03 -0.37 1.58 -0.36 0.98 0.00 0.00 173.24 175.09 2a7r s PHE 38 N 1.18 2.93 0.19 5.02 2.99 -0.20 -4.94 117.98 125.15 2a7r s PHE 38 Ca 0.09 0.70 -0.12 0.00 0.00 0.00 0.00 56.93 57.60 2a7r s PHE 38 Cb -0.18 -3.99 0.21 0.00 0.00 0.00 0.00 43.02 39.06 2a7r s PHE 38 CO -0.13 -3.49 1.73 -0.09 -0.00 0.00 0.00 175.22 173.24 2a7r h ARG 39 N 5.82 0.31 0.00 0.44 2.43 -1.87 -2.25 114.38 119.26 2a7r h ARG 39 Ca -0.45 -0.02 -0.43 0.00 -0.81 0.00 0.00 59.98 58.28 2a7r h ARG 39 Cb 1.21 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.63 2a7r h ARG 39 CO 0.86 0.21 -2.42 0.09 -1.51 0.00 0.00 179.97 177.19 2a7r n ASN 40 N -5.05 1.96 0.00 -3.80 3.02 -1.26 -4.27 115.26 105.87 2a7r n ASN 40 Ca 0.06 0.23 0.08 0.00 -0.03 0.00 0.00 54.58 54.92 2a7r n ASN 40 Cb 0.24 -0.73 0.38 0.00 -0.61 0.00 0.00 39.78 39.05 2a7r n ASN 40 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 2a7r n SER 41 N -4.00 0.00 -0.59 6.41 3.41 -1.26 -4.83 113.62 112.76 2a7r n SER 41 Ca -0.50 0.45 -0.07 0.00 -0.26 0.00 0.00 58.87 58.49 2a7r n SER 41 Cb 0.90 -0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 64.35 2a7r n SER 41 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2a7r n LYS 42 N -1.48 -1.76 -2.12 4.33 4.76 -0.85 -4.77 118.16 116.27 2a7r n LYS 42 Ca 0.05 0.67 -0.27 0.00 -2.87 0.00 0.00 58.31 55.88 2a7r n LYS 42 Cb 0.20 -4.91 0.10 0.00 -1.84 0.00 0.00 35.03 28.57 2a7r n LYS 42 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2a7r s GLN 43 N -2.40 1.80 0.12 1.97 -1.52 -1.26 -4.76 119.66 113.61 2a7r s GLN 43 Ca 0.00 -0.29 0.11 0.00 -1.95 0.00 0.00 55.36 53.23 2a7r s GLN 43 Cb 0.00 -2.08 -0.04 0.00 -0.22 0.00 0.00 33.01 30.68 2a7r s GLN 43 CO 0.00 -1.56 -0.27 0.99 -0.25 0.00 0.00 175.29 174.20 2a7r s THR 44 N -3.43 2.27 0.12 -0.19 2.01 -1.26 -1.03 115.64 114.12 2a7r s THR 44 Ca 0.64 -1.70 0.06 0.00 0.31 0.00 0.00 61.69 61.00 2a7r s THR 44 Cb -0.09 -1.99 -0.04 0.00 0.01 0.00 0.00 72.50 70.40 2a7r s THR 44 CO 0.47 0.13 -0.15 -0.47 -0.69 0.00 0.00 174.62 173.92 2a7r s TYR 45 N -1.03 1.42 -0.30 4.92 5.04 0.05 -4.97 117.35 122.48 2a7r s TYR 45 Ca 0.14 -0.54 -0.13 0.00 -2.44 0.00 0.00 57.07 54.10 2a7r s TYR 45 Cb -0.10 -0.75 0.13 0.00 0.35 0.00 0.00 41.96 41.60 2a7r s TYR 45 CO 0.06 0.15 0.79 0.45 -1.34 0.00 0.00 175.55 175.65 2a7r s SER 46 N -2.37 -0.89 0.00 4.32 0.15 -1.24 -1.93 113.70 111.75 2a7r s SER 46 Ca 0.08 1.27 0.00 0.00 0.70 0.00 0.00 55.95 58.00 2a7r s SER 46 Cb -0.06 1.84 0.00 0.00 -1.71 0.00 0.00 66.02 66.10 2a7r s SER 46 CO 0.03 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.90 2a7r n GLY 47 N 4.92 -1.35 3.67 9.45 0.00 -1.16 -4.95 105.19 115.77 2a7r n GLY 47 Ca -0.13 -1.55 -0.43 0.00 0.00 0.00 0.00 46.02 43.91 2a7r n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a7r s VAL 48 N -1.75 4.57 0.00 1.61 1.01 -0.94 -1.60 120.40 123.30 2a7r s VAL 48 Ca 0.00 1.88 -0.04 0.00 0.00 0.00 0.00 61.98 63.82 2a7r s VAL 48 Cb 0.00 -4.21 -0.17 0.00 0.00 0.00 0.00 36.38 32.00 2a7r s VAL 48 CO 0.00 -0.10 2.67 -0.81 0.00 0.00 0.00 175.10 176.86 2a7r n PRO 49 N 5.87 1.41 -4.38 2.72 -0.04 -1.26 -4.12 135.00 135.20 2a7r n PRO 49 Ca 0.11 -0.63 -0.34 0.00 -0.04 0.00 0.00 63.50 62.61 2a7r n PRO 49 Cb 0.47 -1.74 -0.14 0.00 -0.04 0.00 0.00 33.50 32.04 2a7r n PRO 49 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2a7r s ILE 50 N 1.26 3.04 -0.09 0.52 1.01 -1.26 -1.86 121.20 123.82 2a7r s ILE 50 Ca 0.42 -0.64 0.01 0.00 0.00 0.00 0.00 60.65 60.44 2a7r s ILE 50 Cb 0.20 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 40.33 2a7r s ILE 50 CO 0.00 0.49 -0.09 -0.63 0.00 0.00 0.00 174.94 174.71 2a7r s ILE 51 N 0.87 3.52 -0.07 2.92 1.01 0.22 -1.64 121.20 128.03 2a7r s ILE 51 Ca -0.03 -0.53 -0.30 0.00 0.00 0.00 0.00 60.65 59.79 2a7r s ILE 51 Cb -0.15 -2.45 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 2a7r s ILE 51 CO 0.00 0.57 1.01 0.00 0.00 0.00 0.00 174.94 176.52 2a7r s ALA 52 N -0.46 3.34 0.53 9.38 0.00 -0.43 0.54 121.76 134.66 2a7r s ALA 52 Ca 0.06 0.43 -0.21 0.00 0.00 0.00 0.00 51.96 52.25 2a7r s ALA 52 Cb -0.12 -3.41 -0.06 0.00 0.00 0.00 0.00 23.12 19.52 2a7r s ALA 52 CO 0.02 -0.51 1.14 0.00 0.00 0.00 0.00 175.76 176.41 2a7r n ALA 53 N 4.70 0.77 -1.01 0.00 0.00 0.12 -2.11 120.51 122.99 2a7r n ALA 53 Ca 0.08 0.12 -0.12 0.00 0.00 0.00 0.00 53.44 53.51 2a7r n ALA 53 Cb 0.49 -2.20 -0.16 0.00 0.00 0.00 0.00 19.45 17.58 2a7r n ALA 53 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2a7r n ASN 54 N -0.51 5.30 -4.89 0.00 6.94 -1.17 -1.74 115.26 119.19 2a7r n ASN 54 Ca 0.11 -2.51 -0.32 0.00 -0.02 0.00 0.00 54.58 51.84 2a7r n ASN 54 Cb 0.44 -1.40 -0.05 0.00 -2.36 0.00 0.00 39.78 36.41 2a7r n ASN 54 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 2a7r s MET 55 N 0.84 3.36 0.31 -3.83 -1.94 -1.26 -4.43 119.30 112.35 2a7r s MET 55 Ca 0.65 -0.44 0.08 0.00 -1.71 0.00 0.00 55.69 54.27 2a7r s MET 55 Cb 0.31 -3.01 0.84 0.00 2.01 0.00 0.00 34.83 34.98 2a7r s MET 55 CO -0.01 0.63 1.71 -0.44 -0.01 0.00 0.00 175.02 176.90 2a7r h ASP 56 N 3.38 0.53 0.85 3.03 5.19 -1.85 0.26 116.42 127.80 2a7r h ASP 56 Ca -0.47 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 56.09 2a7r h ASP 56 Cb 1.17 0.08 0.00 0.00 0.18 0.00 0.00 39.33 40.76 2a7r h ASP 56 CO 0.72 0.04 -0.31 0.35 -3.12 0.00 0.00 179.24 176.92 2a7r n THR 57 N -4.96 0.14 -0.04 0.35 -2.24 -1.26 -4.53 114.28 101.74 2a7r n THR 57 Ca 0.25 -0.09 -0.08 0.00 -2.27 0.00 0.00 64.05 61.87 2a7r n THR 57 Cb 0.73 -0.16 -0.03 0.00 -2.10 0.00 0.00 70.33 68.77 2a7r n THR 57 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2a7r n VAL 58 N -1.71 0.41 -1.11 2.28 0.31 0.20 0.18 118.33 118.88 2a7r n VAL 58 Ca 0.06 -0.11 -0.31 0.00 -0.01 0.00 0.00 64.34 63.97 2a7r n VAL 58 Cb 0.37 -1.50 -0.04 0.00 -0.91 0.00 0.00 33.84 31.76 2a7r n VAL 58 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2a7r n GLY 59 N 2.61 3.76 3.94 2.92 0.00 0.67 -4.74 105.19 114.35 2a7r n GLY 59 Ca -0.14 -1.28 -0.26 0.00 0.00 0.00 0.00 46.02 44.34 2a7r n GLY 59 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2a7r s THR 60 N 2.33 5.27 0.25 2.61 -4.23 -1.26 -1.27 115.64 119.34 2a7r s THR 60 Ca 0.61 -0.61 -0.04 0.00 -1.18 0.00 0.00 61.69 60.47 2a7r s THR 60 Cb 0.18 -3.76 0.12 0.00 1.34 0.00 0.00 72.50 70.38 2a7r s THR 60 CO -0.04 -0.16 1.76 -0.26 -0.54 0.00 0.00 174.62 175.37 2a7r h PHE 61 N 1.93 0.94 -1.01 3.99 0.05 -1.91 0.11 116.94 121.06 2a7r h PHE 61 Ca -0.49 -0.12 0.09 0.00 3.82 0.00 0.00 57.97 61.27 2a7r h PHE 61 Cb 1.20 -0.26 -0.07 0.00 2.00 0.00 0.00 35.95 38.81 2a7r h PHE 61 CO 0.53 0.82 0.64 0.93 -0.18 0.00 0.00 178.31 181.05 2a7r h GLU 62 N 0.84 1.07 0.02 1.51 3.07 -1.95 -0.05 114.58 119.09 2a7r h GLU 62 Ca 0.17 -0.06 -0.00 0.00 -0.50 0.00 0.00 59.36 58.96 2a7r h GLU 62 Cb 0.41 -0.24 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 2a7r h GLU 62 CO 0.01 0.71 -0.01 1.98 -1.40 0.00 0.00 179.01 180.30 2a7r h MET 63 N 1.10 -0.02 -1.01 2.33 -1.53 -1.33 -3.22 114.93 111.25 2a7r h MET 63 Ca 0.46 0.00 0.19 0.00 -3.44 0.00 0.00 59.70 56.91 2a7r h MET 63 Cb 0.31 0.00 -0.11 0.00 -0.55 0.00 0.00 31.60 31.26 2a7r h MET 63 CO -0.21 0.45 0.61 0.00 0.14 0.00 0.00 176.91 177.90 2a7r h ALA 64 N 0.48 1.67 -0.67 0.39 0.00 0.09 -1.47 119.26 119.75 2a7r h ALA 64 Ca -0.00 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.05 2a7r h ALA 64 Cb 0.47 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 2a7r h ALA 64 CO 0.00 -0.03 0.36 1.57 0.00 0.00 0.00 179.25 181.15 2a7r h LYS 65 N 0.78 0.64 0.04 0.00 2.10 -1.05 -0.26 116.57 118.82 2a7r h LYS 65 Ca 0.57 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 59.18 2a7r h LYS 65 Cb 0.87 -0.14 0.00 0.00 -0.90 0.00 0.00 32.23 32.06 2a7r h LYS 65 CO -0.37 0.42 -0.02 0.28 -2.00 0.00 0.00 179.45 177.76 2a7r h VAL 66 N 0.66 1.37 -0.52 0.07 2.07 -1.38 -3.16 116.25 115.37 2a7r h VAL 66 Ca 0.30 -1.46 0.14 0.00 0.82 0.00 0.00 66.70 66.50 2a7r h VAL 66 Cb 0.21 2.32 -0.02 0.00 -1.52 0.00 0.00 31.29 32.28 2a7r h VAL 66 CO -0.20 0.36 0.37 -0.07 0.02 0.00 0.00 177.57 178.06 2a7r h LEU 67 N -0.71 0.05 -1.02 2.57 3.38 -1.28 0.23 115.31 118.52 2a7r h LEU 67 Ca -0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 2a7r h LEU 67 Cb 0.63 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.34 2a7r h LEU 67 CO 0.01 0.03 0.25 0.00 0.09 0.00 0.00 178.44 178.81 2a7r h LYS 69 N 0.93 0.00 -0.02 0.00 5.09 -0.51 -2.06 116.57 120.00 2a7r h LYS 69 Ca 0.22 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.96 2a7r h LYS 69 Cb 0.20 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.53 2a7r h LYS 69 CO -0.02 0.00 0.00 1.19 -2.09 0.00 0.00 179.45 178.53 2a7r n PHE 70 N -2.68 0.01 -0.87 0.07 3.01 -0.52 -4.99 117.46 111.49 2a7r n PHE 70 Ca -0.02 -0.01 0.00 0.00 1.01 0.00 0.00 57.45 58.43 2a7r n PHE 70 Cb 0.09 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 2a7r n PHE 70 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2a7r n SER 71 N 0.47 -2.62 -4.85 4.37 7.64 -0.65 -4.69 113.62 113.29 2a7r n SER 71 Ca 0.05 0.00 -0.35 0.00 1.01 0.00 0.00 58.87 59.58 2a7r n SER 71 Cb 0.22 -0.44 -0.06 0.00 -1.01 0.00 0.00 64.21 62.92 2a7r n SER 71 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2a7r s LEU 72 N 0.00 4.32 0.51 -3.43 1.43 0.09 -2.21 118.68 119.39 2a7r s LEU 72 Ca 0.00 1.08 -0.16 0.00 -1.03 0.00 0.00 54.13 54.02 2a7r s LEU 72 Cb 0.00 -3.34 -0.08 0.00 0.03 0.00 0.00 46.19 42.81 2a7r s LEU 72 CO 0.00 0.08 0.97 0.12 0.23 0.00 0.00 176.35 177.74 2a7r s PHE 73 N -1.51 3.46 -0.03 0.29 5.36 -0.65 -4.15 117.98 120.75 2a7r s PHE 73 Ca 0.39 1.42 -0.00 0.00 -0.96 0.00 0.00 56.93 57.78 2a7r s PHE 73 Cb -0.15 -2.76 0.03 0.00 -0.34 0.00 0.00 43.02 39.81 2a7r s PHE 73 CO 0.19 -0.35 0.02 0.99 -1.46 0.00 0.00 175.22 174.61 2a7r s THR 74 N -2.62 0.01 -0.50 0.12 2.01 -1.00 -1.31 115.64 112.35 2a7r s THR 74 Ca 0.58 0.20 -0.14 0.00 0.31 0.00 0.00 61.69 62.64 2a7r s THR 74 Cb -0.10 -0.15 0.11 0.00 0.01 0.00 0.00 72.50 72.37 2a7r s THR 74 CO 0.32 0.12 0.42 0.00 -0.69 0.00 0.00 174.62 174.79 2a7r s ALA 75 N 1.21 3.55 0.24 7.40 0.00 -0.90 -0.93 121.76 132.33 2a7r s ALA 75 Ca -0.07 -2.38 -0.30 0.00 0.00 0.00 0.00 51.96 49.20 2a7r s ALA 75 Cb -0.13 -3.09 -0.10 0.00 0.00 0.00 0.00 23.12 19.80 2a7r s ALA 75 CO -0.03 -1.89 1.49 0.08 0.00 0.00 0.00 175.76 175.42 2a7r s VAL 76 N 1.56 2.54 0.59 0.00 1.01 -0.67 -3.03 120.40 122.39 2a7r s VAL 76 Ca 0.04 0.44 -0.20 0.00 0.00 0.00 0.00 61.98 62.26 2a7r s VAL 76 Cb -0.27 -3.28 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2a7r s VAL 76 CO 0.03 0.06 1.30 -1.38 0.00 0.00 0.00 175.10 175.12 2a7r s HIS 77 N 0.21 2.23 0.00 5.22 -3.43 -0.39 -3.53 115.29 115.60 2a7r s HIS 77 Ca 0.62 1.45 -0.02 0.00 -0.80 0.00 0.00 55.06 56.31 2a7r s HIS 77 Cb -0.43 -3.69 -0.08 0.00 -1.43 0.00 0.00 32.58 26.94 2a7r s HIS 77 CO 0.42 -2.76 2.15 0.36 -2.00 0.00 0.00 174.74 172.91 2a7r n LYS 78 N -1.46 1.11 0.00 -0.38 2.85 -1.26 -3.92 118.16 115.10 2a7r n LYS 78 Ca 0.13 -0.30 0.00 0.00 -1.05 0.00 0.00 58.31 57.09 2a7r n LYS 78 Cb 0.47 -1.39 0.00 0.00 -0.65 0.00 0.00 35.03 33.46 2a7r n LYS 78 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2a7r n HIS 79 N 1.96 0.00 -1.58 5.58 8.25 -1.26 -5.04 115.22 123.13 2a7r n HIS 79 Ca 0.13 0.00 -0.50 0.00 -0.26 0.00 0.00 57.72 57.08 2a7r n HIS 79 Cb 0.53 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.59 2a7r n HIS 79 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2a7r n TYR 80 N -2.06 1.40 -2.21 4.41 0.53 -1.25 -4.93 117.16 113.04 2a7r n TYR 80 Ca 0.00 0.66 -0.33 0.00 -1.02 0.00 0.00 57.90 57.21 2a7r n TYR 80 Cb 0.43 -2.30 -0.01 0.00 -1.03 0.00 0.00 39.34 36.43 2a7r n TYR 80 CO 0.00 0.00 0.00 -1.12 -1.02 0.00 0.00 176.86 174.72 2a7r s SER 81 N 0.24 6.01 0.58 7.72 0.01 -1.26 -4.87 113.70 122.13 2a7r s SER 81 Ca 0.79 1.83 0.32 0.00 1.31 0.00 0.00 55.95 60.19 2a7r s SER 81 Cb -0.90 -2.54 1.36 0.00 0.21 0.00 0.00 66.02 64.15 2a7r s SER 81 CO 0.49 -1.01 1.69 0.25 0.41 0.00 0.00 173.24 175.08 2a7r h LEU 82 N 0.79 0.00 0.21 2.44 6.46 -1.96 0.63 115.31 123.90 2a7r h LEU 82 Ca -0.48 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.27 2a7r h LEU 82 Cb 1.22 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.15 2a7r h LEU 82 CO 0.58 0.00 -0.10 0.58 -0.62 0.00 0.00 178.44 178.88 2a7r h VAL 83 N 0.00 0.87 -0.97 1.05 2.07 -2.00 -2.22 116.25 115.05 2a7r h VAL 83 Ca 0.42 -0.65 0.07 0.00 0.82 0.00 0.00 66.70 67.36 2a7r h VAL 83 Cb 2.09 1.24 -0.07 0.00 -1.52 0.00 0.00 31.29 33.04 2a7r h VAL 83 CO -0.00 0.14 0.63 1.56 0.02 0.00 0.00 177.57 179.92 2a7r h GLN 84 N -0.63 1.09 0.28 1.57 7.50 -1.23 -0.46 115.11 123.23 2a7r h GLN 84 Ca -0.03 -0.07 -0.01 0.00 0.50 0.00 0.00 58.65 59.05 2a7r h GLN 84 Cb 0.45 -0.25 -0.01 0.00 0.05 0.00 0.00 27.48 27.73 2a7r h GLN 84 CO 0.05 0.72 -0.20 -1.49 -1.50 0.00 0.00 178.83 176.41 2a7r h TRP 85 N 1.12 -0.52 -0.46 2.96 4.06 -1.46 0.32 115.95 121.99 2a7r h TRP 85 Ca 0.42 -0.00 0.09 0.00 2.06 0.00 0.00 58.89 61.45 2a7r h TRP 85 Cb 0.19 0.19 -0.10 0.00 -1.00 0.00 0.00 29.16 28.44 2a7r h TRP 85 CO -0.00 -0.30 -0.34 1.96 -3.56 0.00 0.00 178.44 176.20 2a7r h GLN 86 N -0.47 -0.22 0.38 0.49 1.08 -0.69 0.54 115.11 116.22 2a7r h GLN 86 Ca -0.02 0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2a7r h GLN 86 Cb 0.41 0.05 -0.03 0.00 -0.05 0.00 0.00 27.48 27.86 2a7r h GLN 86 CO 0.01 -0.15 -0.43 1.49 -0.95 0.00 0.00 178.83 178.79 2a7r h GLU 87 N -0.23 -0.81 0.02 1.46 4.81 -0.82 0.32 114.58 119.33 2a7r h GLU 87 Ca 0.19 0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.50 2a7r h GLU 87 Cb 0.54 0.18 -0.05 0.00 0.63 0.00 0.00 28.75 30.06 2a7r h GLU 87 CO -0.58 -0.54 -0.31 0.35 -0.73 0.00 0.00 179.01 177.20 2a7r h PHE 88 N -0.84 -0.84 -0.99 0.92 3.57 0.30 0.11 116.94 119.18 2a7r h PHE 88 Ca -0.03 0.03 0.20 0.00 3.53 0.00 0.00 57.97 61.69 2a7r h PHE 88 Cb 0.76 0.37 -0.10 0.00 2.79 0.00 0.00 35.95 39.77 2a7r h PHE 88 CO -0.26 -0.40 0.62 0.00 -2.23 0.00 0.00 178.31 176.04 2a7r h ALA 89 N 0.27 1.84 0.45 2.41 0.00 0.24 0.69 119.26 125.17 2a7r h ALA 89 Ca 0.06 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2a7r h ALA 89 Cb 0.54 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2a7r h ALA 89 CO -0.25 -0.20 -0.22 0.78 0.00 0.00 0.00 179.25 179.37 2a7r h GLY 90 N 0.66 -0.63 2.00 0.00 0.00 0.20 -2.90 103.07 102.39 2a7r h GLY 90 Ca 0.56 0.23 0.00 0.00 0.00 0.00 0.00 47.33 48.12 2a7r h GLY 90 CO -0.33 -0.23 0.00 0.61 0.00 0.00 0.00 176.54 176.59 2a7r n GLN 91 N -3.86 0.15 -3.11 4.80 10.64 0.13 -3.65 117.38 122.48 2a7r n GLN 91 Ca -0.08 0.51 -0.20 0.00 -1.83 0.00 0.00 57.00 55.40 2a7r n GLN 91 Cb 0.24 -1.87 -0.03 0.00 -0.86 0.00 0.00 30.24 27.72 2a7r n GLN 91 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2a7r n ASN 92 N -2.17 1.83 -0.33 2.61 3.02 0.20 -4.99 115.26 115.43 2a7r n ASN 92 Ca 0.01 -3.18 -0.11 0.00 -0.03 0.00 0.00 54.58 51.26 2a7r n ASN 92 Cb 0.13 -0.60 -0.10 0.00 -0.61 0.00 0.00 39.78 38.60 2a7r n ASN 92 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2a7r h PRO 93 N 2.99 -0.10 -0.95 3.52 0.15 -1.58 -2.60 132.00 133.43 2a7r h PRO 93 Ca 0.10 0.01 0.12 0.00 0.15 0.00 0.00 66.00 66.38 2a7r h PRO 93 Cb 0.85 0.02 -0.08 0.00 0.15 0.00 0.00 31.00 31.94 2a7r h PRO 93 CO 0.59 -0.07 0.58 0.38 0.15 0.00 0.00 178.00 179.62 2a7r h ASP 94 N -0.11 0.83 0.00 1.44 3.04 -1.94 -3.15 116.42 116.53 2a7r h ASP 94 Ca 0.13 0.05 0.00 0.00 -3.24 0.00 0.00 57.03 53.98 2a7r h ASP 94 Cb 0.45 -0.11 0.00 0.00 -1.04 0.00 0.00 39.33 38.63 2a7r h ASP 94 CO -0.82 0.43 0.00 0.00 -2.04 0.00 0.00 179.24 176.82 2a7r n LEU 96 N 0.60 0.48 -4.88 0.00 4.77 -1.19 -4.70 117.00 112.09 2a7r n LEU 96 Ca 0.00 0.21 -0.30 0.00 -0.03 0.00 0.00 56.01 55.88 2a7r n LEU 96 Cb 0.36 0.11 0.03 0.00 -2.33 0.00 0.00 43.42 41.59 2a7r n LEU 96 CO 0.00 0.12 0.72 -1.83 -1.33 0.00 0.00 177.39 175.07 2a7r s GLU 97 N -3.06 3.19 -1.09 3.23 -1.05 -1.25 -3.56 118.70 115.11 2a7r s GLU 97 Ca -0.05 0.56 -0.04 0.00 -0.15 0.00 0.00 54.97 55.29 2a7r s GLU 97 Cb 0.10 -2.07 0.00 0.00 -0.44 0.00 0.00 34.13 31.72 2a7r s GLU 97 CO 0.84 -0.80 0.50 0.72 0.95 0.00 0.00 175.26 177.46 2a7r n HIS 98 N -2.86 -1.50 -3.78 4.83 8.25 -1.26 -4.99 115.22 113.91 2a7r n HIS 98 Ca 0.06 0.42 -0.13 0.00 -0.26 0.00 0.00 57.72 57.82 2a7r n HIS 98 Cb 0.56 -3.56 -0.12 0.00 1.12 0.00 0.00 29.99 27.99 2a7r n HIS 98 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2a7r s LEU 99 N -4.98 0.94 0.04 2.41 2.96 -1.23 -2.37 118.68 116.44 2a7r s LEU 99 Ca 0.25 0.48 0.06 0.00 -0.22 0.00 0.00 54.13 54.69 2a7r s LEU 99 Cb -0.11 0.77 -0.02 0.00 0.50 0.00 0.00 46.19 47.33 2a7r s LEU 99 CO 0.30 -0.10 -0.18 0.00 -1.32 0.00 0.00 176.35 175.06 2a7r s ALA 100 N 0.42 1.48 -0.19 5.97 0.00 -0.11 -4.04 121.76 125.30 2a7r s ALA 100 Ca -0.02 -0.93 -0.15 0.00 0.00 0.00 0.00 51.96 50.86 2a7r s ALA 100 Cb -0.04 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.76 2a7r s ALA 100 CO -0.02 0.32 0.33 0.00 0.00 0.00 0.00 175.76 176.39 2a7r s ALA 101 N -0.78 3.57 0.50 0.00 0.00 -0.66 -1.67 121.76 122.72 2a7r s ALA 101 Ca 0.05 -0.52 -0.01 0.00 0.00 0.00 0.00 51.96 51.48 2a7r s ALA 101 Cb -0.08 -2.50 0.01 0.00 0.00 0.00 0.00 23.12 20.54 2a7r s ALA 101 CO 0.01 -0.12 0.75 -1.12 0.00 0.00 0.00 175.76 175.28 2a7r s SER 102 N 0.81 5.66 -0.23 0.00 0.01 -1.23 -0.47 113.70 118.25 2a7r s SER 102 Ca 0.17 0.33 -0.30 0.00 1.31 0.00 0.00 55.95 57.46 2a7r s SER 102 Cb -0.14 -1.45 0.16 0.00 0.21 0.00 0.00 66.02 64.80 2a7r s SER 102 CO 0.06 -0.87 1.21 -0.55 0.41 0.00 0.00 173.24 173.50 2a7r s SER 103 N -4.28 -0.17 0.23 2.44 0.15 -0.02 -4.72 113.70 107.34 2a7r s SER 103 Ca 0.51 0.18 0.03 0.00 0.70 0.00 0.00 55.95 57.37 2a7r s SER 103 Cb -0.10 0.14 0.04 0.00 -1.71 0.00 0.00 66.02 64.39 2a7r s SER 103 CO 0.40 -0.17 0.30 0.61 1.20 0.00 0.00 173.24 175.58 2a7r n GLY 104 N 0.56 1.85 0.20 9.45 0.00 -1.26 -2.20 105.19 113.79 2a7r n GLY 104 Ca -0.04 -2.15 0.13 0.00 0.00 0.00 0.00 46.02 43.96 2a7r n GLY 104 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2a7r h THR 105 N -0.00 0.00 -3.46 2.61 1.35 -1.95 -3.39 112.91 108.06 2a7r h THR 105 Ca -0.10 -0.80 -0.56 0.00 -0.55 0.00 0.00 66.41 64.40 2a7r h THR 105 Cb 0.45 1.79 0.12 0.00 -1.73 0.00 0.00 68.15 68.78 2a7r h THR 105 CO 0.14 0.00 0.52 0.61 -0.25 0.00 0.00 175.52 176.54 2a7r n GLY 106 N 0.99 0.62 0.18 5.82 0.00 -1.26 -4.80 105.19 106.74 2a7r n GLY 106 Ca 0.04 0.27 -0.04 0.00 0.00 0.00 0.00 46.02 46.29 2a7r n GLY 106 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2a7r h SER 107 N 2.39 -0.08 -0.11 1.61 4.64 -1.99 -0.32 113.55 119.69 2a7r h SER 107 Ca -0.47 0.09 0.04 0.00 -0.47 0.00 0.00 61.79 60.98 2a7r h SER 107 Cb 1.28 0.14 -0.06 0.00 -0.31 0.00 0.00 62.40 63.46 2a7r h SER 107 CO 0.62 -0.01 -0.25 0.77 -0.87 0.00 0.00 176.83 177.09 2a7r h SER 108 N 0.17 -0.77 -0.20 4.97 4.64 -1.97 0.12 113.55 120.51 2a7r h SER 108 Ca 0.22 0.12 0.06 0.00 -0.47 0.00 0.00 61.79 61.71 2a7r h SER 108 Cb 0.30 0.33 -0.07 0.00 -0.31 0.00 0.00 62.40 62.66 2a7r h SER 108 CO -0.32 -0.30 -0.25 0.44 -0.87 0.00 0.00 176.83 175.53 2a7r h ASP 109 N -0.33 -0.79 -0.81 4.97 5.19 -1.66 0.38 116.42 123.37 2a7r h ASP 109 Ca 0.09 0.13 -0.01 0.00 -0.62 0.00 0.00 57.03 56.63 2a7r h ASP 109 Cb 0.47 0.36 -0.04 0.00 0.18 0.00 0.00 39.33 40.30 2a7r h ASP 109 CO -0.30 -0.29 0.48 0.15 -3.12 0.00 0.00 179.24 176.17 2a7r h PHE 110 N -0.28 1.08 -0.36 4.55 3.57 -0.70 0.14 116.94 124.95 2a7r h PHE 110 Ca 0.12 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.61 2a7r h PHE 110 Cb 0.47 -0.35 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 2a7r h PHE 110 CO -0.38 0.72 0.21 1.49 -2.23 0.00 0.00 178.31 178.12 2a7r h GLU 111 N 1.13 0.50 -0.44 1.11 4.81 -0.07 -1.17 114.58 120.46 2a7r h GLU 111 Ca 0.29 -0.06 -0.10 0.00 -0.13 0.00 0.00 59.36 59.36 2a7r h GLU 111 Cb -0.03 -0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.23 2a7r h GLU 111 CO -0.05 0.41 -0.14 1.96 -0.73 0.00 0.00 179.01 180.45 2a7r h GLN 112 N 0.47 0.81 0.08 1.92 4.20 -0.29 -2.67 115.11 119.63 2a7r h GLN 112 Ca 0.13 -0.29 0.00 0.00 0.06 0.00 0.00 58.65 58.55 2a7r h GLN 112 Cb 0.04 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 2a7r h GLN 112 CO -0.02 0.91 -0.07 1.25 -0.67 0.00 0.00 178.83 180.23 2a7r h LEU 113 N 0.73 -0.19 0.21 1.46 5.85 -0.29 -2.33 115.31 120.74 2a7r h LEU 113 Ca 0.12 0.02 0.01 0.00 0.84 0.00 0.00 57.88 58.86 2a7r h LEU 113 Cb 0.65 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.70 2a7r h LEU 113 CO 0.05 -0.12 -0.53 -0.33 -0.34 0.00 0.00 178.44 177.17 2a7r h GLU 114 N -0.17 -0.79 -1.25 1.25 5.08 -1.17 -0.57 114.58 116.97 2a7r h GLU 114 Ca 0.00 0.05 0.41 0.00 -1.00 0.00 0.00 59.36 58.82 2a7r h GLU 114 Cb 0.16 0.18 -0.13 0.00 0.50 0.00 0.00 28.75 29.46 2a7r h GLU 114 CO -0.02 -0.52 0.79 1.96 -1.00 0.00 0.00 179.01 180.22 2a7r h GLN 115 N -0.81 0.13 0.19 2.33 4.20 -1.29 0.26 115.11 120.11 2a7r h GLN 115 Ca -0.02 -0.01 -0.27 0.00 0.06 0.00 0.00 58.65 58.42 2a7r h GLN 115 Cb 0.79 -0.03 0.02 0.00 0.30 0.00 0.00 27.48 28.56 2a7r h GLN 115 CO -0.24 0.09 -1.21 0.82 -0.67 0.00 0.00 178.83 177.62 2a7r h ILE 116 N 0.13 1.33 -0.27 2.54 2.04 -0.80 -2.82 117.51 119.66 2a7r h ILE 116 Ca 0.79 -2.58 -0.08 0.00 1.00 0.00 0.00 64.86 63.98 2a7r h ILE 116 Cb 2.36 3.06 -0.01 0.00 -0.74 0.00 0.00 36.82 41.49 2a7r h ILE 116 CO -0.44 0.76 -0.19 -0.07 0.00 0.00 0.00 178.15 178.22 2a7r h LEU 117 N -0.13 0.48 -0.01 1.44 3.38 0.75 0.14 115.31 121.35 2a7r h LEU 117 Ca -0.22 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.61 2a7r h LEU 117 Cb 1.89 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 42.51 2a7r h LEU 117 CO 0.19 0.68 -0.01 -0.33 0.09 0.00 0.00 178.44 179.06 2a7r h GLU 118 N 0.44 0.02 -0.12 1.13 4.39 -0.73 -3.18 114.58 116.54 2a7r h GLU 118 Ca 0.07 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.76 2a7r h GLU 118 Cb 0.58 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.22 2a7r h GLU 118 CO 0.04 0.50 0.06 0.00 -1.16 0.00 0.00 179.01 178.44 2a7r h ALA 119 N 0.52 0.15 -3.11 3.43 0.00 -1.38 -3.35 119.26 115.53 2a7r h ALA 119 Ca 0.00 -0.07 -0.71 0.00 0.00 0.00 0.00 54.91 54.13 2a7r h ALA 119 Cb 0.49 -0.05 -0.34 0.00 0.00 0.00 0.00 17.79 17.89 2a7r h ALA 119 CO 0.00 -0.29 -0.28 0.42 0.00 0.00 0.00 179.25 179.10 2a7r s ILE 120 N -5.71 4.00 -1.32 0.00 1.09 0.47 -4.90 121.20 114.82 2a7r s ILE 120 Ca -0.14 -3.03 0.25 0.00 -1.10 0.00 0.00 60.65 56.63 2a7r s ILE 120 Cb 0.06 -3.57 0.37 0.00 -1.06 0.00 0.00 42.46 38.27 2a7r s ILE 120 CO 0.69 -0.92 1.82 -0.81 -0.10 0.00 0.00 174.94 175.61 2a7r n PRO 121 N 3.38 0.26 0.08 2.79 -0.04 -1.20 -2.46 135.00 137.81 2a7r n PRO 121 Ca 0.10 0.06 0.12 0.00 -0.04 0.00 0.00 63.50 63.74 2a7r n PRO 121 Cb 0.39 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.80 2a7r n PRO 121 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2a7r n GLN 122 N -1.34 0.14 -2.96 0.54 3.00 -1.26 -4.35 117.38 111.15 2a7r n GLN 122 Ca 0.10 0.27 -0.43 0.00 -0.01 0.00 0.00 57.00 56.92 2a7r n GLN 122 Cb 0.22 -1.72 -0.04 0.00 0.00 0.00 0.00 30.24 28.70 2a7r n GLN 122 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 2a7r s VAL 123 N -3.14 4.53 -0.22 5.09 1.01 -1.03 -4.16 120.40 122.47 2a7r s VAL 123 Ca 0.08 -0.37 0.15 0.00 0.00 0.00 0.00 61.98 61.84 2a7r s VAL 123 Cb 0.12 -4.55 0.71 0.00 0.00 0.00 0.00 36.38 32.66 2a7r s VAL 123 CO 0.44 -1.20 1.63 2.29 0.00 0.00 0.00 175.10 178.26 2a7r n LYS 124 N 7.12 4.07 -4.32 2.72 2.85 -1.26 -4.93 118.16 124.40 2a7r n LYS 124 Ca -0.04 -3.05 -0.18 0.00 -1.05 0.00 0.00 58.31 53.99 2a7r n LYS 124 Cb 0.45 -2.11 -0.14 0.00 -0.65 0.00 0.00 35.03 32.59 2a7r n LYS 124 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 177.40 178.06 2a7r s TYR 125 N -2.82 0.86 -0.03 5.58 1.51 -1.26 -1.61 117.35 119.58 2a7r s TYR 125 Ca 0.50 -0.22 0.07 0.00 -1.01 0.00 0.00 57.07 56.41 2a7r s TYR 125 Cb 0.39 -0.54 -0.02 0.00 -0.11 0.00 0.00 41.96 41.69 2a7r s TYR 125 CO 0.13 -0.01 -0.24 0.42 -1.11 0.00 0.00 175.55 174.74 2a7r s ILE 126 N -0.45 1.93 -0.30 2.71 1.01 -0.05 -1.66 121.20 124.39 2a7r s ILE 126 Ca 0.02 -1.03 0.02 0.00 0.00 0.00 0.00 60.65 59.66 2a7r s ILE 126 Cb -0.05 -1.61 0.07 0.00 0.01 0.00 0.00 42.46 40.88 2a7r s ILE 126 CO 0.00 0.54 -0.02 0.00 0.00 0.00 0.00 174.94 175.46 2a7r s LEU 128 N 1.06 4.05 -0.22 0.00 1.43 0.35 -0.84 118.68 124.51 2a7r s LEU 128 Ca -0.01 0.20 -0.00 0.00 -1.03 0.00 0.00 54.13 53.29 2a7r s LEU 128 Cb -0.20 -2.31 0.06 0.00 0.03 0.00 0.00 46.19 43.77 2a7r s LEU 128 CO -0.05 -0.10 -0.04 -1.81 0.23 0.00 0.00 176.35 174.57 2a7r s ASP 129 N 1.54 3.58 0.39 2.29 1.01 -0.93 -1.24 116.67 123.31 2a7r s ASP 129 Ca 0.12 -1.06 0.08 0.00 0.71 0.00 0.00 52.55 52.40 2a7r s ASP 129 Cb -0.15 -1.05 -0.03 0.00 1.01 0.00 0.00 42.92 42.70 2a7r s ASP 129 CO 0.09 -0.24 0.28 0.68 0.21 0.00 0.00 175.17 176.19 2a7r s VAL 130 N 1.50 2.72 0.00 -1.27 -7.23 -0.93 -4.48 120.40 110.72 2a7r s VAL 130 Ca -0.04 -1.50 0.00 0.00 -1.81 0.00 0.00 61.98 58.63 2a7r s VAL 130 Cb -0.18 -3.02 0.00 0.00 0.56 0.00 0.00 36.38 33.74 2a7r s VAL 130 CO -0.07 -0.05 0.79 0.00 -0.31 0.00 0.00 175.10 175.47 2a7r n ALA 131 N -1.38 -0.37 -2.87 1.32 0.00 -0.36 -4.24 120.51 112.61 2a7r n ALA 131 Ca 0.01 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.01 2a7r n ALA 131 Cb 0.62 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.99 2a7r n ALA 131 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2a7r s ASN 132 N -2.12 6.08 0.00 0.00 2.47 -1.26 -3.09 114.94 117.02 2a7r s ASN 132 Ca 0.00 -1.30 0.09 0.00 0.42 0.00 0.00 52.86 52.07 2a7r s ASN 132 Cb 0.00 -2.16 0.53 0.00 -1.45 0.00 0.00 41.25 38.17 2a7r s ASN 132 CO 0.00 -0.61 1.11 0.61 -3.72 0.00 0.00 177.10 174.49 2a7r n GLY 133 N 5.17 -0.72 0.75 1.21 0.00 -1.16 -2.57 105.19 107.86 2a7r n GLY 133 Ca -0.12 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 45.95 2a7r n GLY 133 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2a7r n TYR 134 N -0.69 0.00 -2.46 1.61 4.02 -1.26 -4.85 117.16 113.53 2a7r n TYR 134 Ca 0.07 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.54 2a7r n TYR 134 Cb 0.03 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.31 2a7r n TYR 134 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 176.86 174.73 2a7r s SER 135 N -1.99 7.18 0.58 7.72 0.01 -1.06 -4.88 113.70 121.25 2a7r s SER 135 Ca 0.23 2.12 0.27 0.00 1.31 0.00 0.00 55.95 59.88 2a7r s SER 135 Cb 0.18 -2.60 1.69 0.00 0.21 0.00 0.00 66.02 65.50 2a7r s SER 135 CO 0.36 -0.30 2.22 -0.08 0.41 0.00 0.00 173.24 175.84 2a7r h GLU 136 N 5.39 0.00 0.44 12.44 4.57 -1.92 -1.60 114.58 133.89 2a7r h GLU 136 Ca -0.44 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 57.73 2a7r h GLU 136 Cb 1.21 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.80 2a7r h GLU 136 CO 0.74 0.00 -0.27 0.45 -1.18 0.00 0.00 179.01 178.75 2a7r h HIS 137 N 0.00 -0.72 -0.55 0.92 3.86 -1.96 -2.05 115.15 114.65 2a7r h HIS 137 Ca 0.01 -0.01 0.11 0.00 -1.16 0.00 0.00 60.37 59.32 2a7r h HIS 137 Cb 0.04 0.26 -0.09 0.00 1.06 0.00 0.00 27.41 28.67 2a7r h HIS 137 CO 0.00 -0.42 -0.01 0.35 0.86 0.00 0.00 177.93 178.71 2a7r h PHE 138 N -0.68 -0.05 -0.75 2.45 3.57 -1.61 0.17 116.94 120.04 2a7r h PHE 138 Ca -0.05 0.04 0.17 0.00 3.53 0.00 0.00 57.97 61.66 2a7r h PHE 138 Cb 0.56 0.11 -0.12 0.00 2.79 0.00 0.00 35.95 39.29 2a7r h PHE 138 CO -0.10 -0.14 0.15 0.28 -2.23 0.00 0.00 178.31 176.27 2a7r h VAL 139 N 0.11 0.46 0.27 1.41 2.07 -1.23 0.28 116.25 119.63 2a7r h VAL 139 Ca 0.28 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.71 2a7r h VAL 139 Cb 0.44 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.43 2a7r h VAL 139 CO -0.47 0.04 -0.13 -0.33 0.02 0.00 0.00 177.57 176.70 2a7r h GLU 140 N 0.23 -0.35 -0.93 1.57 3.07 -0.04 -1.09 114.58 117.04 2a7r h GLU 140 Ca 0.43 0.02 0.22 0.00 -0.50 0.00 0.00 59.36 59.53 2a7r h GLU 140 Cb 0.75 0.08 -0.12 0.00 -0.84 0.00 0.00 28.75 28.62 2a7r h GLU 140 CO -0.55 -0.08 0.46 0.35 -1.40 0.00 0.00 179.01 177.78 2a7r h PHE 141 N -0.59 0.78 0.30 4.33 3.57 0.14 0.24 116.94 125.71 2a7r h PHE 141 Ca -0.04 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 2a7r h PHE 141 Cb 0.43 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.97 2a7r h PHE 141 CO 0.00 0.01 -0.14 0.28 -2.23 0.00 0.00 178.31 176.23 2a7r h VAL 142 N 0.48 0.71 -0.98 1.41 2.07 -0.19 -1.40 116.25 118.36 2a7r h VAL 142 Ca 0.58 -0.05 0.14 0.00 0.82 0.00 0.00 66.70 68.18 2a7r h VAL 142 Cb 1.07 0.74 -0.09 0.00 -1.52 0.00 0.00 31.29 31.50 2a7r h VAL 142 CO -0.50 0.01 0.62 0.11 0.02 0.00 0.00 177.57 177.83 2a7r h LYS 143 N -0.43 0.86 0.33 1.57 6.56 0.67 -0.74 116.57 125.40 2a7r h LYS 143 Ca -0.04 -0.05 -0.02 0.00 -1.06 0.00 0.00 60.65 59.48 2a7r h LYS 143 Cb 0.33 -0.19 0.00 0.00 -0.57 0.00 0.00 32.23 31.80 2a7r h LYS 143 CO 0.07 0.57 -0.16 -0.44 -2.06 0.00 0.00 179.45 177.43 2a7r h ASP 144 N 0.89 -0.38 -0.64 0.86 3.32 -0.44 -2.29 116.42 117.74 2a7r h ASP 144 Ca 0.50 -0.07 0.10 0.00 0.02 0.00 0.00 57.03 57.59 2a7r h ASP 144 Cb 0.62 0.10 -0.04 0.00 0.22 0.00 0.00 39.33 40.23 2a7r h ASP 144 CO -0.27 -0.17 0.43 0.58 -1.72 0.00 0.00 179.24 178.09 2a7r h VAL 145 N -0.58 0.89 0.26 -1.35 2.07 -0.72 -0.39 116.25 116.43 2a7r h VAL 145 Ca -0.05 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.31 2a7r h VAL 145 Cb 0.43 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2a7r h VAL 145 CO 0.08 0.08 -0.12 -0.09 0.02 0.00 0.00 177.57 177.53 2a7r h ARG 146 N 0.45 -0.33 0.17 1.57 9.65 -0.85 -1.84 114.38 123.20 2a7r h ARG 146 Ca 0.30 0.02 -0.00 0.00 -1.10 0.00 0.00 59.98 59.20 2a7r h ARG 146 Cb 0.56 0.08 -0.00 0.00 -1.39 0.00 0.00 29.97 29.21 2a7r h ARG 146 CO -0.09 -0.20 -0.10 0.87 2.80 0.00 0.00 179.97 183.25 2a7r h LYS 147 N -0.38 -0.25 0.00 0.20 1.79 -0.67 -0.67 116.57 116.59 2a7r h LYS 147 Ca -0.04 0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.45 2a7r h LYS 147 Cb 0.29 0.06 -0.00 0.00 -1.58 0.00 0.00 32.23 30.99 2a7r h LYS 147 CO 0.06 -0.17 -0.00 -0.09 -1.08 0.00 0.00 179.45 178.17 2a7r h ARG 148 N -0.26 0.00 -1.66 3.15 1.12 -1.04 -3.19 114.38 112.50 2a7r h ARG 148 Ca -0.01 0.00 -0.46 0.00 -1.11 0.00 0.00 59.98 58.39 2a7r h ARG 148 Cb 0.22 0.00 -0.35 0.00 -0.01 0.00 0.00 29.97 29.83 2a7r h ARG 148 CO 0.01 0.00 -1.04 1.19 -3.11 0.00 0.00 179.97 177.02 2a7r n PHE 149 N -3.44 -0.55 0.13 2.20 3.01 -0.70 -4.98 117.46 113.13 2a7r n PHE 149 Ca -0.03 -3.42 0.05 0.00 1.01 0.00 0.00 57.45 55.06 2a7r n PHE 149 Cb 0.08 -0.05 0.29 0.00 -0.01 0.00 0.00 39.48 39.79 2a7r n PHE 149 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 2a7r n PRO 150 N 0.73 0.07 -0.05 -1.08 -0.04 -0.28 -1.92 135.00 132.43 2a7r n PRO 150 Ca 0.21 0.51 0.04 0.00 -0.04 0.00 0.00 63.50 64.22 2a7r n PRO 150 Cb 0.62 -2.00 0.07 0.00 -0.04 0.00 0.00 33.50 32.15 2a7r n PRO 150 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2a7r n GLN 151 N -1.90 2.43 -3.94 0.54 6.02 -1.26 -4.58 117.38 114.69 2a7r n GLN 151 Ca -0.01 -1.94 -0.34 0.00 -0.01 0.00 0.00 57.00 54.70 2a7r n GLN 151 Cb 0.28 -1.22 -0.06 0.00 1.02 0.00 0.00 30.24 30.27 2a7r n GLN 151 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 2a7r s HIS 152 N -1.68 3.51 -0.07 1.08 3.76 -0.81 -4.88 115.29 116.19 2a7r s HIS 152 Ca 0.14 0.37 -0.30 0.00 -0.15 0.00 0.00 55.06 55.12 2a7r s HIS 152 Cb 0.11 -1.84 -0.02 0.00 1.11 0.00 0.00 32.58 31.95 2a7r s HIS 152 CO 0.02 0.65 1.00 0.99 -0.85 0.00 0.00 174.74 176.55 2a7r s THR 153 N -1.23 4.81 -0.18 1.30 2.01 -0.63 -4.53 115.64 117.20 2a7r s THR 153 Ca 0.23 2.05 -0.05 0.00 0.31 0.00 0.00 61.69 64.23 2a7r s THR 153 Cb -0.12 -4.32 -0.03 0.00 0.01 0.00 0.00 72.50 68.04 2a7r s THR 153 CO 0.14 0.05 0.01 -0.63 -0.69 0.00 0.00 174.62 173.50 2a7r s ILE 154 N 1.69 4.19 -0.22 1.82 1.01 -1.26 -0.87 121.20 127.57 2a7r s ILE 154 Ca 0.50 -0.24 -0.07 0.00 0.00 0.00 0.00 60.65 60.83 2a7r s ILE 154 Cb -0.19 -2.87 -0.03 0.00 0.01 0.00 0.00 42.46 39.37 2a7r s ILE 154 CO 0.21 0.46 0.06 -0.04 0.00 0.00 0.00 174.94 175.63 2a7r s MET 155 N 0.59 3.76 -0.02 2.79 -1.94 0.10 -0.27 119.30 124.33 2a7r s MET 155 Ca -0.00 -0.44 0.00 0.00 -1.71 0.00 0.00 55.69 53.54 2a7r s MET 155 Cb -0.14 -3.25 0.02 0.00 2.01 0.00 0.00 34.83 33.47 2a7r s MET 155 CO 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 175.02 175.04 2a7r s ALA 156 N 1.09 0.17 0.27 3.03 0.00 -0.00 0.13 121.76 126.45 2a7r s ALA 156 Ca 0.04 0.13 -0.09 0.00 0.00 0.00 0.00 51.96 52.03 2a7r s ALA 156 Cb -0.14 -0.19 0.04 0.00 0.00 0.00 0.00 23.12 22.83 2a7r s ALA 156 CO 0.03 -0.04 0.52 0.41 0.00 0.00 0.00 175.76 176.68 2a7r n GLY 157 N 3.73 1.43 3.56 0.00 0.00 -0.37 -1.31 105.19 112.23 2a7r n GLY 157 Ca -0.22 -1.22 -0.25 0.00 0.00 0.00 0.00 46.02 44.33 2a7r n GLY 157 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2a7r s ASN 158 N -2.44 4.14 0.28 1.61 -0.87 -1.26 -2.18 114.94 114.22 2a7r s ASN 158 Ca 0.12 -0.72 -0.01 0.00 -1.57 0.00 0.00 52.86 50.68 2a7r s ASN 158 Cb -0.03 -0.64 -0.02 0.00 -0.02 0.00 0.00 41.25 40.54 2a7r s ASN 158 CO 0.09 0.06 0.30 0.68 -2.57 0.00 0.00 177.10 175.66 2a7r s VAL 159 N -2.08 0.00 0.00 1.60 -7.23 -0.97 -2.97 120.40 108.75 2a7r s VAL 159 Ca 0.28 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.62 2a7r s VAL 159 Cb -0.07 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.38 2a7r s VAL 159 CO 0.16 0.00 0.38 1.33 -0.31 0.00 0.00 175.10 176.67 2a7r n VAL 160 N -0.45 0.00 -4.54 1.32 0.24 -1.26 -0.72 118.33 112.92 2a7r n VAL 160 Ca 0.03 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.11 2a7r n VAL 160 Cb 0.63 1.18 -0.15 0.00 -1.47 0.00 0.00 33.84 34.03 2a7r n VAL 160 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2a7r s THR 161 N 0.00 0.97 0.29 3.34 2.01 -1.26 -4.64 115.64 116.35 2a7r s THR 161 Ca 0.00 -0.49 0.03 0.00 0.31 0.00 0.00 61.69 61.53 2a7r s THR 161 Cb 0.00 -0.83 0.32 0.00 0.01 0.00 0.00 72.50 72.00 2a7r s THR 161 CO 0.00 0.28 1.64 1.23 -0.69 0.00 0.00 174.62 177.08 2a7r h GLY 162 N 6.09 1.38 0.09 4.40 0.00 -1.90 -2.15 103.07 110.99 2a7r h GLY 162 Ca -0.33 -0.02 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2a7r h GLY 162 CO 0.49 -0.40 -0.26 1.05 0.00 0.00 0.00 176.54 177.41 2a7r h GLU 163 N 0.18 -0.38 -0.01 4.80 -0.00 -1.96 -0.48 114.58 116.72 2a7r h GLU 163 Ca 0.57 0.03 0.00 0.00 -0.00 0.00 0.00 59.36 59.96 2a7r h GLU 163 Cb 1.17 0.09 -0.00 0.00 -0.00 0.00 0.00 28.75 30.01 2a7r h GLU 163 CO -0.69 -0.26 0.05 1.98 -0.00 0.00 0.00 179.01 180.09 2a7r h MET 164 N -0.40 0.00 -0.18 1.06 4.05 -1.89 -0.22 114.93 117.36 2a7r h MET 164 Ca -0.01 0.00 -0.07 0.00 -0.28 0.00 0.00 59.70 59.34 2a7r h MET 164 Cb 0.39 0.00 -0.00 0.00 -0.80 0.00 0.00 31.60 31.19 2a7r h MET 164 CO -0.13 0.00 -0.18 0.28 0.23 0.00 0.00 176.91 177.12 2a7r h VAL 165 N 0.00 1.33 -0.16 -5.77 2.07 -0.51 -2.32 116.25 110.89 2a7r h VAL 165 Ca 0.00 -1.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.16 2a7r h VAL 165 Cb 0.10 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.66 2a7r h VAL 165 CO -0.00 0.40 0.00 -0.33 0.02 0.00 0.00 177.57 177.66 2a7r h GLU 166 N 0.10 0.28 -0.43 1.57 5.08 0.36 -1.55 114.58 119.98 2a7r h GLU 166 Ca 0.03 -0.09 0.09 0.00 -1.00 0.00 0.00 59.36 58.39 2a7r h GLU 166 Cb 0.71 -0.03 -0.09 0.00 0.50 0.00 0.00 28.75 29.85 2a7r h GLU 166 CO 0.04 0.50 -0.23 1.49 -1.00 0.00 0.00 179.01 179.81 2a7r h GLU 167 N 0.03 -0.14 -0.73 2.33 4.57 -1.21 0.11 114.58 119.53 2a7r h GLU 167 Ca 0.05 0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 58.18 2a7r h GLU 167 Cb 0.38 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.97 2a7r h GLU 167 CO 0.01 -0.10 0.24 -0.07 -1.18 0.00 0.00 179.01 177.92 2a7r h LEU 168 N -0.15 1.06 -0.62 1.64 3.38 -1.30 0.93 115.31 120.24 2a7r h LEU 168 Ca 0.20 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 2a7r h LEU 168 Cb 0.47 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 2a7r h LEU 168 CO -0.52 0.98 0.16 0.40 0.09 0.00 0.00 178.44 179.54 2a7r h ILE 169 N 1.08 1.25 -0.09 1.22 2.04 -0.47 -1.12 117.51 121.42 2a7r h ILE 169 Ca 0.24 -0.90 -0.15 0.00 1.00 0.00 0.00 64.86 65.05 2a7r h ILE 169 Cb 0.29 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.01 2a7r h ILE 169 CO -0.01 0.34 -0.60 -0.07 0.00 0.00 0.00 178.15 177.81 2a7r h LEU 170 N 0.90 0.36 0.00 1.44 3.38 -0.56 -2.49 115.31 118.34 2a7r h LEU 170 Ca 0.20 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2a7r h LEU 170 Cb 0.34 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2a7r h LEU 170 CO -0.00 0.87 0.00 -1.54 0.09 0.00 0.00 178.44 177.86 2a7r n SER 171 N -3.89 0.00 0.00 -0.43 3.41 0.30 -4.85 113.62 108.16 2a7r n SER 171 Ca -0.03 0.45 0.00 0.00 -0.26 0.00 0.00 58.87 59.04 2a7r n SER 171 Cb 0.62 -0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 2a7r n SER 171 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2a7r n GLY 172 N 0.02 1.54 3.77 5.00 0.00 -0.94 -3.62 105.19 110.96 2a7r n GLY 172 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 2a7r n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a7r s ALA 173 N -0.88 2.71 -0.24 4.61 0.00 -0.46 -4.83 121.76 122.68 2a7r s ALA 173 Ca 0.00 0.90 -0.15 0.00 0.00 0.00 0.00 51.96 52.70 2a7r s ALA 173 Cb 0.00 -3.39 -0.16 0.00 0.00 0.00 0.00 23.12 19.57 2a7r s ALA 173 CO 0.00 -0.85 -0.06 -0.25 0.00 0.00 0.00 175.76 174.60 2a7r n ASP 174 N -1.22 1.94 -4.27 0.00 8.00 0.63 -4.34 116.55 117.29 2a7r n ASP 174 Ca 0.11 0.32 -0.32 0.00 0.71 0.00 0.00 54.79 55.61 2a7r n ASP 174 Cb 0.50 -0.85 -0.16 0.00 -0.02 0.00 0.00 41.12 40.59 2a7r n ASP 174 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2a7r s ILE 175 N -2.46 2.30 -0.22 0.53 -1.09 0.26 -2.73 121.20 117.80 2a7r s ILE 175 Ca -0.33 -0.95 -0.09 0.00 -2.23 0.00 0.00 60.65 57.05 2a7r s ILE 175 Cb 0.10 -1.89 -0.04 0.00 -1.58 0.00 0.00 42.46 39.05 2a7r s ILE 175 CO 0.56 0.56 0.10 -0.63 -1.23 0.00 0.00 174.94 174.30 2a7r s ILE 176 N 0.19 4.92 -0.43 2.92 -1.09 -0.17 -0.82 121.20 126.71 2a7r s ILE 176 Ca -0.13 0.02 -0.28 0.00 -2.23 0.00 0.00 60.65 58.03 2a7r s ILE 176 Cb -0.16 -3.26 0.03 0.00 -1.58 0.00 0.00 42.46 37.48 2a7r s ILE 176 CO 0.07 0.40 1.09 -0.54 -1.23 0.00 0.00 174.94 174.72 2a7r s LYS 177 N 0.84 3.79 -0.20 2.79 -0.14 -0.43 -0.00 119.74 126.40 2a7r s LYS 177 Ca 0.05 0.65 -0.14 0.00 -1.36 0.00 0.00 55.97 55.16 2a7r s LYS 177 Cb -0.13 -3.86 -0.04 0.00 -1.68 0.00 0.00 37.83 32.11 2a7r s LYS 177 CO 0.02 -1.22 0.32 0.08 -0.76 0.00 0.00 175.35 173.80 2a7r s VAL 178 N 4.13 5.26 0.00 3.17 1.01 0.18 -2.28 120.40 131.87 2a7r s VAL 178 Ca 0.46 0.57 0.00 0.00 0.00 0.00 0.00 61.98 63.00 2a7r s VAL 178 Cb -0.09 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.63 2a7r s VAL 178 CO 0.26 0.31 0.00 0.61 0.00 0.00 0.00 175.10 176.28 2a7r n GLY 179 N 3.82 3.39 2.82 4.51 0.00 0.10 0.07 105.19 119.92 2a7r n GLY 179 Ca -0.11 -0.33 -0.17 0.00 0.00 0.00 0.00 46.02 45.41 2a7r n GLY 179 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2a7r s ILE 180 N 0.00 -0.32 0.00 -0.61 1.01 -1.26 -4.60 121.20 115.42 2a7r s ILE 180 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 60.65 60.73 2a7r s ILE 180 Cb 0.00 -0.53 0.00 0.00 0.01 0.00 0.00 42.46 41.94 2a7r s ILE 180 CO 0.00 -0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.50 2a7r n GLY 181 N 5.33 3.05 0.00 6.18 0.00 -1.26 -2.70 105.19 115.78 2a7r n GLY 181 Ca -0.05 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.14 2a7r n GLY 181 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2a7r n PRO 182 N 0.00 0.00 -1.45 1.61 -0.02 -1.26 -4.45 135.00 129.43 2a7r n PRO 182 Ca 0.00 0.33 -0.35 0.00 -2.02 0.00 0.00 63.50 61.45 2a7r n PRO 182 Cb 0.00 -1.50 0.10 0.00 -0.02 0.00 0.00 33.50 32.07 2a7r n PRO 182 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2a7r n GLY 183 N -1.33 0.27 0.27 -1.23 0.00 -1.26 -3.57 105.19 98.34 2a7r n GLY 183 Ca 0.00 -0.30 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 2a7r n GLY 183 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2a7r h SER 184 N -0.11 -0.55 0.32 1.61 0.87 -1.95 -3.02 113.55 110.72 2a7r h SER 184 Ca -0.49 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 2a7r h SER 184 Cb 1.32 0.14 0.00 0.00 -0.44 0.00 0.00 62.40 63.42 2a7r h SER 184 CO 0.50 -0.28 0.00 1.33 -0.53 0.00 0.00 176.83 177.85 2a7r n VAL 185 N -4.36 0.04 -2.84 2.23 0.24 -1.26 -4.76 118.33 107.62 2a7r n VAL 185 Ca -0.08 0.01 -0.40 0.00 -2.04 0.00 0.00 64.34 61.83 2a7r n VAL 185 Cb 0.25 -0.54 -0.06 0.00 -1.47 0.00 0.00 33.84 32.03 2a7r n VAL 185 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2a7r n THR 187 N 1.91 0.90 -0.24 0.00 -2.24 -1.26 -4.53 114.28 108.82 2a7r n THR 187 Ca -0.02 -2.44 -0.05 0.00 -2.27 0.00 0.00 64.05 59.27 2a7r n THR 187 Cb 0.48 1.16 0.06 0.00 -2.10 0.00 0.00 70.33 69.93 2a7r n THR 187 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2a7r h THR 188 N 4.82 1.14 -0.72 4.28 2.02 -1.85 -2.47 112.91 120.12 2a7r h THR 188 Ca -0.21 -0.30 -0.05 0.00 0.77 0.00 0.00 66.41 66.62 2a7r h THR 188 Cb 1.27 0.19 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 2a7r h THR 188 CO 0.12 0.16 0.25 0.03 0.37 0.00 0.00 175.52 176.44 2a7r h ARG 189 N 0.87 1.11 -0.21 6.66 3.08 -1.82 0.47 114.38 124.54 2a7r h ARG 189 Ca 0.26 -0.23 -0.07 0.00 0.07 0.00 0.00 59.98 60.01 2a7r h ARG 189 Cb -0.05 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 29.83 2a7r h ARG 189 CO -0.08 0.94 -0.15 0.87 -1.07 0.00 0.00 179.97 180.48 2a7r h LYS 190 N 1.05 0.47 0.00 0.04 1.57 -1.87 -0.35 116.57 117.48 2a7r h LYS 190 Ca 0.23 -0.23 -0.11 0.00 -1.87 0.00 0.00 60.65 58.68 2a7r h LYS 190 Cb 0.28 -0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 2a7r h LYS 190 CO -0.01 0.79 -0.88 1.57 -0.57 0.00 0.00 179.45 180.35 2a7r h LYS 191 N 0.15 0.00 0.00 3.15 -0.00 -1.39 -3.40 116.57 115.08 2a7r h LYS 191 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.69 2a7r h LYS 191 Cb 0.68 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.91 2a7r h LYS 191 CO 0.04 0.32 -0.41 0.25 -0.00 0.00 0.00 179.45 179.65 2a7r n THR 192 N -3.02 0.00 -1.04 0.07 -2.24 0.16 -5.01 114.28 103.20 2a7r n THR 192 Ca -0.03 -0.15 -0.02 0.00 -2.27 0.00 0.00 64.05 61.59 2a7r n THR 192 Cb 0.74 0.63 -0.01 0.00 -2.10 0.00 0.00 70.33 69.59 2a7r n THR 192 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a7r n GLY 193 N 1.33 0.46 3.64 3.38 0.00 -0.14 -4.97 105.19 108.90 2a7r n GLY 193 Ca 0.00 -0.16 -0.35 0.00 0.00 0.00 0.00 46.02 45.51 2a7r n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2a7r s VAL 194 N -1.80 4.54 -0.00 1.61 1.01 -1.25 -4.93 120.40 119.58 2a7r s VAL 194 Ca 0.00 -0.14 -0.02 0.00 0.00 0.00 0.00 61.98 61.83 2a7r s VAL 194 Cb 0.00 -2.99 0.01 0.00 0.00 0.00 0.00 36.38 33.40 2a7r s VAL 194 CO 0.00 0.52 0.07 0.61 0.00 0.00 0.00 175.10 176.30 2a7r n GLY 195 N 2.99 0.57 3.64 4.51 0.00 -1.26 -3.35 105.19 112.29 2a7r n GLY 195 Ca -0.18 -0.84 -0.00 0.00 0.00 0.00 0.00 46.02 45.00 2a7r n GLY 195 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2a7r s TYR 196 N -2.85 -0.39 0.22 1.61 5.04 -1.10 -5.02 117.35 114.86 2a7r s TYR 196 Ca 0.02 0.77 -0.32 0.00 -2.44 0.00 0.00 57.07 55.09 2a7r s TYR 196 Cb -0.00 0.23 -0.13 0.00 0.35 0.00 0.00 41.96 42.41 2a7r s TYR 196 CO -0.00 -0.19 1.58 -2.30 -1.34 0.00 0.00 175.55 173.30 2a7r n PRO 197 N 3.52 2.40 0.02 4.97 -0.02 -1.26 -4.63 135.00 139.99 2a7r n PRO 197 Ca -0.18 0.86 -0.13 0.00 -2.02 0.00 0.00 63.50 62.03 2a7r n PRO 197 Cb 0.57 -2.63 -0.07 0.00 -0.02 0.00 0.00 33.50 31.35 2a7r n PRO 197 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 2a7r h GLN 198 N 5.51 -0.53 -0.30 -0.52 1.08 -1.95 -1.20 115.11 117.20 2a7r h GLN 198 Ca -0.45 0.04 0.07 0.00 -1.45 0.00 0.00 58.65 56.86 2a7r h GLN 198 Cb 1.24 0.12 -0.08 0.00 -0.05 0.00 0.00 27.48 28.71 2a7r h GLN 198 CO 0.86 -0.35 -0.26 1.25 -0.95 0.00 0.00 178.83 179.37 2a7r h LEU 199 N -0.55 -0.85 -0.72 1.46 5.85 -1.86 0.46 115.31 119.10 2a7r h LEU 199 Ca 0.06 0.16 -0.02 0.00 0.84 0.00 0.00 57.88 58.91 2a7r h LEU 199 Cb 0.66 0.40 -0.03 0.00 0.37 0.00 0.00 40.66 42.06 2a7r h LEU 199 CO -0.38 -0.29 0.36 0.28 -0.34 0.00 0.00 178.44 178.07 2a7r h SER 200 N -0.24 0.93 0.56 1.25 0.02 -1.25 -1.10 113.55 113.72 2a7r h SER 200 Ca 0.15 -0.12 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 2a7r h SER 200 Cb 0.48 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.79 2a7r h SER 200 CO -0.44 0.79 -0.30 0.00 -1.14 0.00 0.00 176.83 175.74 2a7r h ALA 201 N 1.18 -0.79 -0.18 3.77 0.00 -0.03 -1.52 119.26 121.68 2a7r h ALA 201 Ca 0.25 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2a7r h ALA 201 Cb 0.09 0.34 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 2a7r h ALA 201 CO -0.03 -0.95 -0.20 0.28 0.00 0.00 0.00 179.25 178.35 2a7r h VAL 202 N -0.79 0.49 -0.17 0.00 2.07 0.05 0.31 116.25 118.21 2a7r h VAL 202 Ca -0.07 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.49 2a7r h VAL 202 Cb 0.62 0.49 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 2a7r h VAL 202 CO 0.11 0.00 -0.12 0.24 0.02 0.00 0.00 177.57 177.81 2a7r h MET 203 N -0.22 -0.12 0.11 1.57 2.86 -1.13 0.58 114.93 118.57 2a7r h MET 203 Ca 0.12 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.76 2a7r h MET 203 Cb 0.40 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.08 2a7r h MET 203 CO -0.31 -0.08 -0.05 0.93 1.06 0.00 0.00 176.91 178.46 2a7r h GLU 204 N -0.12 -0.14 -0.38 1.72 5.08 -0.87 -2.46 114.58 117.40 2a7r h GLU 204 Ca 0.10 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.41 2a7r h GLU 204 Cb 0.28 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2a7r h GLU 204 CO -0.25 -0.02 0.01 0.00 -1.00 0.00 0.00 179.01 177.75 2a7r h ALA 206 N 0.88 1.26 0.33 0.00 0.00 0.15 0.40 119.26 122.28 2a7r h ALA 206 Ca 0.11 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2a7r h ALA 206 Cb 0.46 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2a7r h ALA 206 CO 0.02 0.13 -0.16 0.22 0.00 0.00 0.00 179.25 179.46 2a7r h ASP 207 N 0.85 -0.37 0.18 0.00 3.58 -1.25 -0.76 116.42 118.65 2a7r h ASP 207 Ca 0.42 -0.02 0.01 0.00 0.42 0.00 0.00 57.03 57.86 2a7r h ASP 207 Cb 0.39 0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.50 2a7r h ASP 207 CO -0.25 -0.22 -0.44 0.00 -2.88 0.00 0.00 179.24 175.45 2a7r h ALA 208 N 0.16 -0.82 -0.58 -0.78 0.00 -0.88 -1.90 119.26 114.45 2a7r h ALA 208 Ca -0.05 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.86 2a7r h ALA 208 Cb 0.37 0.71 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 2a7r h ALA 208 CO 0.07 -1.03 0.19 0.00 0.00 0.00 0.00 179.25 178.49 2a7r h ALA 209 N -0.31 0.72 -0.12 0.00 0.00 -0.90 -1.80 119.26 116.86 2a7r h ALA 209 Ca 0.00 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 2a7r h ALA 209 Cb 0.71 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.58 2a7r h ALA 209 CO -0.21 -0.23 0.01 0.45 0.00 0.00 0.00 179.25 179.27 2a7r h HIS 210 N 0.35 0.16 -0.49 0.00 -0.00 -0.75 0.17 115.15 114.59 2a7r h HIS 210 Ca 0.29 -0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.61 2a7r h HIS 210 Cb 0.37 -0.05 -0.02 0.00 -0.00 0.00 0.00 27.41 27.71 2a7r h HIS 210 CO -0.19 0.16 0.10 0.78 -0.00 0.00 0.00 177.93 178.79 2a7r h GLY 211 N 0.33 0.81 -1.54 2.45 0.00 -0.53 -1.34 103.07 103.26 2a7r h GLY 211 Ca 0.04 -0.46 0.00 0.00 0.00 0.00 0.00 47.33 46.91 2a7r h GLY 211 CO 0.00 0.43 0.00 1.04 0.00 0.00 0.00 176.54 178.01 2a7r n LEU 212 N -4.28 2.23 -2.06 3.11 4.77 -0.80 -4.87 117.00 115.10 2a7r n LEU 212 Ca 0.03 -1.12 -0.19 0.00 -0.03 0.00 0.00 56.01 54.70 2a7r n LEU 212 Cb 0.23 -0.36 -0.02 0.00 -2.33 0.00 0.00 43.42 40.94 2a7r n LEU 212 CO 0.40 0.42 -0.23 2.29 -1.33 0.00 0.00 177.39 178.93 2a7r n LYS 213 N 0.36 -1.48 -1.62 3.23 -0.00 -0.50 -4.98 118.16 113.16 2a7r n LYS 213 Ca 0.11 0.94 -0.04 0.00 -0.00 0.00 0.00 58.31 59.33 2a7r n LYS 213 Cb 0.42 -5.46 0.00 0.00 -0.00 0.00 0.00 35.03 30.00 2a7r n LYS 213 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2a7r n GLY 214 N -0.98 2.56 3.18 2.58 0.00 0.54 -4.09 105.19 108.99 2a7r n GLY 214 Ca -0.22 -2.17 -0.11 0.00 0.00 0.00 0.00 46.02 43.52 2a7r n GLY 214 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2a7r s HIS 215 N -0.05 0.99 0.19 1.61 3.76 -1.10 -3.84 115.29 116.84 2a7r s HIS 215 Ca 0.07 -1.11 0.03 0.00 -0.15 0.00 0.00 55.06 53.89 2a7r s HIS 215 Cb -0.01 -0.57 -0.05 0.00 1.11 0.00 0.00 32.58 33.07 2a7r s HIS 215 CO 0.04 -0.36 -0.01 0.96 -0.85 0.00 0.00 174.74 174.52 2a7r s ILE 216 N -3.85 0.87 -0.08 0.60 -4.36 -1.26 -1.00 121.20 112.11 2a7r s ILE 216 Ca 0.22 -2.01 0.02 0.00 -0.26 0.00 0.00 60.65 58.62 2a7r s ILE 216 Cb 0.07 -2.18 0.01 0.00 1.25 0.00 0.00 42.46 41.61 2a7r s ILE 216 CO 0.01 -0.44 -0.13 -0.63 0.24 0.00 0.00 174.94 173.99 2a7r s ILE 217 N -3.53 1.26 -0.57 8.37 1.01 1.00 -2.29 121.20 126.45 2a7r s ILE 217 Ca 0.25 -0.53 -0.27 0.00 0.00 0.00 0.00 60.65 60.09 2a7r s ILE 217 Cb 0.05 -1.16 0.03 0.00 0.01 0.00 0.00 42.46 41.40 2a7r s ILE 217 CO 0.05 0.39 1.13 -0.55 0.00 0.00 0.00 174.94 175.96 2a7r s SER 218 N 0.81 6.43 -0.36 3.58 0.15 0.08 0.51 113.70 124.91 2a7r s SER 218 Ca -0.11 0.02 -0.13 0.00 0.70 0.00 0.00 55.95 56.43 2a7r s SER 218 Cb -0.15 -2.53 -0.00 0.00 -1.71 0.00 0.00 66.02 61.63 2a7r s SER 218 CO 0.02 -1.41 0.24 -0.62 1.20 0.00 0.00 173.24 172.67 2a7r s ASP 219 N 2.90 5.98 0.10 5.45 2.15 0.11 -0.65 116.67 132.71 2a7r s ASP 219 Ca 0.40 -0.60 0.00 0.00 0.43 0.00 0.00 52.55 52.78 2a7r s ASP 219 Cb -0.09 -2.12 0.00 0.00 -0.30 0.00 0.00 42.92 40.42 2a7r s ASP 219 CO 0.24 -0.30 0.00 0.61 -0.17 0.00 0.00 175.17 175.56 2a7r n GLY 220 N 5.09 -2.30 0.00 2.66 0.00 -1.19 -4.39 105.19 105.06 2a7r n GLY 220 Ca -0.12 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.49 2a7r n GLY 220 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a7r n GLY 221 N -2.71 3.27 3.76 -0.02 0.00 -1.23 -4.88 105.19 103.39 2a7r n GLY 221 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2a7r n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a7r n SER 223 N 2.76 3.56 -3.98 0.00 3.41 -1.26 -4.42 113.62 113.70 2a7r n SER 223 Ca -0.08 -0.05 -0.09 0.00 -0.26 0.00 0.00 58.87 58.39 2a7r n SER 223 Cb 0.51 0.82 -0.08 0.00 -0.26 0.00 0.00 64.21 65.20 2a7r n SER 223 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2a7r h PRO 225 N 2.73 0.72 -0.88 0.00 0.11 -1.92 -1.43 132.00 131.33 2a7r h PRO 225 Ca -0.33 -0.04 0.12 0.00 0.11 0.00 0.00 66.00 65.86 2a7r h PRO 225 Cb 1.20 -0.16 -0.07 0.00 0.11 0.00 0.00 31.00 32.08 2a7r h PRO 225 CO 0.55 0.48 0.57 0.78 -0.21 0.00 0.00 178.00 180.17 2a7r h GLY 226 N 0.75 1.23 1.00 -0.55 0.00 -1.95 0.76 103.07 104.32 2a7r h GLY 226 Ca 0.45 -0.33 -0.07 0.00 0.00 0.00 0.00 47.33 47.39 2a7r h GLY 226 CO -0.21 0.13 0.04 -0.55 0.00 0.00 0.00 176.54 175.95 2a7r h ASP 227 N 0.77 0.85 -0.65 0.19 3.32 -1.67 0.43 116.42 119.66 2a7r h ASP 227 Ca 0.43 -0.29 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 2a7r h ASP 227 Cb 0.59 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.88 2a7r h ASP 227 CO -0.19 0.92 0.35 0.58 -1.72 0.00 0.00 179.24 179.18 2a7r h VAL 228 N 0.75 1.21 -0.04 -1.35 2.07 -1.05 0.42 116.25 118.24 2a7r h VAL 228 Ca 0.15 -0.52 -0.00 0.00 0.82 0.00 0.00 66.70 67.15 2a7r h VAL 228 Cb 0.46 0.37 -0.00 0.00 -1.52 0.00 0.00 31.29 30.60 2a7r h VAL 228 CO 0.02 0.23 0.02 0.00 0.02 0.00 0.00 177.57 177.85 2a7r h ALA 229 N 1.17 0.05 -0.85 1.67 0.00 -0.47 -1.14 119.26 119.70 2a7r h ALA 229 Ca 0.23 -0.07 0.11 0.00 0.00 0.00 0.00 54.91 55.18 2a7r h ALA 229 Cb 0.05 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 2a7r h ALA 229 CO -0.04 -0.38 0.48 0.87 0.00 0.00 0.00 179.25 180.18 2a7r h LYS 230 N -0.05 0.76 -0.07 0.00 1.57 0.48 -0.01 116.57 119.26 2a7r h LYS 230 Ca 0.01 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2a7r h LYS 230 Cb 0.12 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 2a7r h LYS 230 CO -0.00 0.50 0.04 0.00 -0.57 0.00 0.00 179.45 179.42 2a7r h ALA 231 N 1.48 0.08 -0.07 3.86 0.00 0.34 0.13 119.26 125.08 2a7r h ALA 231 Ca 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2a7r h ALA 231 Cb 0.43 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2a7r h ALA 231 CO -0.27 -0.41 0.05 0.74 0.00 0.00 0.00 179.25 179.36 2a7r h PHE 232 N 0.06 0.09 -0.11 0.00 0.05 -0.54 -1.71 116.94 114.78 2a7r h PHE 232 Ca 0.02 0.00 0.02 0.00 3.82 0.00 0.00 57.97 61.83 2a7r h PHE 232 Cb 0.02 -0.03 -0.01 0.00 2.00 0.00 0.00 35.95 37.94 2a7r h PHE 232 CO -0.06 0.06 0.08 0.78 -0.18 0.00 0.00 178.31 178.98 2a7r h GLY 233 N 0.09 0.09 2.00 -1.45 0.00 -0.84 0.67 103.07 103.64 2a7r h GLY 233 Ca 0.03 -0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.32 2a7r h GLY 233 CO -0.01 0.03 0.00 0.00 0.00 0.00 0.00 176.54 176.57 2a7r n ALA 234 N -2.54 1.76 0.00 3.60 0.00 0.44 -4.32 120.51 119.44 2a7r n ALA 234 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2a7r n ALA 234 Cb 0.13 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.30 2a7r n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2a7r n GLY 235 N 0.20 1.14 3.76 0.00 0.00 0.23 -4.01 105.19 106.51 2a7r n GLY 235 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2a7r n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a7r s ALA 236 N -2.00 3.64 -0.04 4.61 0.00 -0.91 -4.85 121.76 122.21 2a7r s ALA 236 Ca 0.00 1.51 -0.16 0.00 0.00 0.00 0.00 51.96 53.31 2a7r s ALA 236 Cb 0.00 -3.60 -0.31 0.00 0.00 0.00 0.00 23.12 19.20 2a7r s ALA 236 CO 0.00 -0.94 0.76 -0.44 0.00 0.00 0.00 175.76 175.14 2a7r h ASP 237 N 4.04 0.59 -4.06 0.00 3.32 -1.86 -3.41 116.42 115.03 2a7r h ASP 237 Ca -0.48 -0.92 -0.53 0.00 0.02 0.00 0.00 57.03 55.12 2a7r h ASP 237 Cb 1.23 -0.19 -0.21 0.00 0.22 0.00 0.00 39.33 40.38 2a7r h ASP 237 CO 0.72 1.66 -0.81 -0.36 -1.72 0.00 0.00 179.24 178.73 2a7r s PHE 238 N -2.53 1.73 -0.13 4.55 0.40 -0.97 -4.77 117.98 116.26 2a7r s PHE 238 Ca -0.15 -0.44 0.02 0.00 -0.60 0.00 0.00 56.93 55.76 2a7r s PHE 238 Cb 0.04 -0.93 0.01 0.00 0.51 0.00 0.00 43.02 42.65 2a7r s PHE 238 CO 0.85 0.22 -0.19 0.08 0.70 0.00 0.00 175.22 176.88 2a7r s VAL 239 N -1.40 1.81 -0.22 -0.44 1.01 -0.78 -0.74 120.40 119.64 2a7r s VAL 239 Ca 0.08 -0.82 -0.09 0.00 0.00 0.00 0.00 61.98 61.15 2a7r s VAL 239 Cb -0.09 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 2a7r s VAL 239 CO 0.05 0.50 0.10 -0.32 0.00 0.00 0.00 175.10 175.43 2a7r s MET 240 N 0.96 3.92 -0.17 2.72 1.75 0.17 -0.61 119.30 128.05 2a7r s MET 240 Ca -0.05 -0.35 -0.08 0.00 -1.25 0.00 0.00 55.69 53.96 2a7r s MET 240 Cb -0.15 -3.37 -0.04 0.00 2.84 0.00 0.00 34.83 34.11 2a7r s MET 240 CO -0.03 0.07 0.09 -0.51 -0.65 0.00 0.00 175.02 173.99 2a7r s LEU 241 N 0.97 4.01 0.00 4.11 1.43 0.19 -3.19 118.68 126.19 2a7r s LEU 241 Ca 0.05 0.20 0.00 0.00 -1.03 0.00 0.00 54.13 53.35 2a7r s LEU 241 Cb -0.14 -2.00 0.00 0.00 0.03 0.00 0.00 46.19 44.08 2a7r s LEU 241 CO 0.03 0.24 0.00 0.61 0.23 0.00 0.00 176.35 177.46 2a7r n GLY 242 N 3.11 0.17 0.24 -3.19 0.00 -1.26 0.16 105.19 104.42 2a7r n GLY 242 Ca -0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.84 2a7r n GLY 242 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2a7r h GLY 243 N 0.00 0.91 1.38 -0.02 0.00 -1.95 -0.42 103.07 102.97 2a7r h GLY 243 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2a7r h GLY 243 CO 0.00 0.08 0.30 -0.33 0.00 0.00 0.00 176.54 176.60 2a7r h MET 244 N 0.56 0.00 0.00 4.80 2.07 -1.89 -0.29 114.93 120.17 2a7r h MET 244 Ca 0.30 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.93 2a7r h MET 244 Cb 0.26 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 29.99 2a7r h MET 244 CO -0.22 0.00 -1.07 1.28 1.07 0.00 0.00 176.91 177.96 2a7r n LEU 245 N -2.83 0.46 -4.58 1.22 4.77 -0.23 -5.00 117.00 110.82 2a7r n LEU 245 Ca -0.02 -0.32 -0.28 0.00 -0.03 0.00 0.00 56.01 55.35 2a7r n LEU 245 Cb 0.35 0.00 0.22 0.00 -2.33 0.00 0.00 43.42 41.66 2a7r n LEU 245 CO 0.13 0.12 0.57 0.00 -1.33 0.00 0.00 177.39 176.88 2a7r s ALA 246 N -2.67 0.16 -0.76 -1.18 0.00 -0.12 -4.05 121.76 113.15 2a7r s ALA 246 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 51.96 51.73 2a7r s ALA 246 Cb 0.11 -3.18 0.00 0.00 0.00 0.00 0.00 23.12 20.05 2a7r s ALA 246 CO 0.63 -3.40 0.00 0.41 0.00 0.00 0.00 175.76 173.40 2a7r n GLY 247 N -0.09 0.87 3.99 0.00 0.00 -1.26 -4.80 105.19 103.89 2a7r n GLY 247 Ca 0.04 -0.29 -0.22 0.00 0.00 0.00 0.00 46.02 45.54 2a7r n GLY 247 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2a7r s HIS 248 N -2.05 1.38 0.03 1.61 4.02 -1.26 0.87 115.29 119.90 2a7r s HIS 248 Ca 0.00 -0.80 -0.25 0.00 1.02 0.00 0.00 55.06 55.03 2a7r s HIS 248 Cb 0.00 -2.08 -0.14 0.00 -1.02 0.00 0.00 32.58 29.34 2a7r s HIS 248 CO 0.00 -0.95 1.24 0.77 1.02 0.00 0.00 174.74 176.83 2a7r h SER 249 N 0.36 -0.76 0.00 1.40 0.02 0.28 -2.38 113.55 112.47 2a7r h SER 249 Ca -0.32 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 2a7r h SER 249 Cb 1.30 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.03 2a7r h SER 249 CO 0.47 -0.49 0.08 -0.62 -1.14 0.00 0.00 176.83 175.12 2a7r n GLU 250 N -4.67 0.04 -1.52 3.45 4.71 -1.26 -4.66 120.64 116.72 2a7r n GLU 250 Ca -0.11 0.49 -0.29 0.00 -0.01 0.00 0.00 57.16 57.23 2a7r n GLU 250 Cb 0.35 -1.70 0.16 0.00 -1.01 0.00 0.00 31.44 29.25 2a7r n GLU 250 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2a7r s SER 251 N -3.15 2.97 0.00 1.62 0.15 -0.90 -3.56 113.70 110.83 2a7r s SER 251 Ca -0.01 0.78 0.00 0.00 0.70 0.00 0.00 55.95 57.43 2a7r s SER 251 Cb 0.02 -1.21 0.00 0.00 -1.71 0.00 0.00 66.02 63.12 2a7r s SER 251 CO 0.05 -2.87 0.00 0.61 1.20 0.00 0.00 173.24 172.23 2a7r n GLY 252 N -2.25 1.44 1.31 9.45 0.00 0.47 -4.86 105.19 110.75 2a7r n GLY 252 Ca 0.09 -1.48 0.16 0.00 0.00 0.00 0.00 46.02 44.80 2a7r n GLY 252 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a7r n GLY 253 N 5.00 -3.26 3.69 -0.02 0.00 -1.24 -4.77 105.19 104.59 2a7r n GLY 253 Ca 0.00 -1.09 -0.41 0.00 0.00 0.00 0.00 46.02 44.52 2a7r n GLY 253 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2a7r s GLU 254 N -4.09 4.37 -0.61 1.61 2.12 -1.26 -4.59 118.70 116.25 2a7r s GLU 254 Ca 0.00 1.10 -0.05 0.00 0.36 0.00 0.00 54.97 56.38 2a7r s GLU 254 Cb 0.00 -3.54 -0.09 0.00 0.26 0.00 0.00 34.13 30.77 2a7r s GLU 254 CO 0.00 -0.23 2.19 1.47 -0.54 0.00 0.00 175.26 178.15 2a7r n LEU 255 N 4.81 4.35 -4.56 2.70 -0.00 -1.26 -1.70 117.00 121.33 2a7r n LEU 255 Ca 0.04 -2.63 -0.31 0.00 -0.00 0.00 0.00 56.01 53.12 2a7r n LEU 255 Cb 0.49 -1.01 0.19 0.00 -0.00 0.00 0.00 43.42 43.10 2a7r n LEU 255 CO 0.49 0.70 0.47 -0.38 -0.00 0.00 0.00 177.39 178.67 2a7r n ILE 256 N 3.68 0.00 -3.50 1.47 5.41 -0.58 -4.69 119.36 121.14 2a7r n ILE 256 Ca 0.38 -0.17 -0.06 0.00 1.00 0.00 0.00 62.75 63.90 2a7r n ILE 256 Cb 0.27 -0.93 -0.07 0.00 -0.71 0.00 0.00 39.64 38.19 2a7r n ILE 256 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 176.55 174.72 2a7r s GLU 257 N -4.38 0.39 0.03 0.38 -1.05 -1.26 0.16 118.70 112.96 2a7r s GLU 257 Ca 0.66 0.93 0.01 0.00 -0.15 0.00 0.00 54.97 56.42 2a7r s GLU 257 Cb -0.23 0.17 -0.02 0.00 -0.44 0.00 0.00 34.13 33.61 2a7r s GLU 257 CO 0.62 -0.41 -0.06 0.50 0.95 0.00 0.00 175.26 176.86 2a7r s ARG 258 N 2.65 0.43 -1.51 -4.83 3.00 0.26 -4.81 118.95 114.15 2a7r s ARG 258 Ca 0.05 -0.66 0.00 0.00 -1.00 0.00 0.00 55.73 54.11 2a7r s ARG 258 Cb -0.13 -0.15 0.00 0.00 0.00 0.00 0.00 34.95 34.67 2a7r s ARG 258 CO -0.15 0.02 0.00 -0.25 0.00 0.00 0.00 175.30 174.91 2a7r n ASP 259 N 1.61 -5.12 0.00 -2.12 8.00 -1.26 -0.70 116.55 116.96 2a7r n ASP 259 Ca -0.23 0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.35 2a7r n ASP 259 Cb 0.55 -4.29 0.00 0.00 -0.02 0.00 0.00 41.12 37.36 2a7r n ASP 259 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2a7r n GLY 260 N -0.92 0.83 3.47 0.44 0.00 -1.26 -5.03 105.19 102.72 2a7r n GLY 260 Ca -0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 2a7r n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a7r s LYS 261 N -0.08 2.37 -0.19 1.61 1.02 0.12 -5.12 119.74 119.47 2a7r s LYS 261 Ca 0.00 -0.79 -0.11 0.00 0.02 0.00 0.00 55.97 55.09 2a7r s LYS 261 Cb 0.00 -2.31 -0.05 0.00 -0.52 0.00 0.00 37.83 34.95 2a7r s LYS 261 CO 0.00 0.60 0.17 0.15 -0.92 0.00 0.00 175.35 175.35 2a7r s LYS 262 N -0.96 4.20 0.31 1.68 1.02 -1.26 0.93 119.74 125.66 2a7r s LYS 262 Ca 0.13 -0.14 0.01 0.00 0.02 0.00 0.00 55.97 55.98 2a7r s LYS 262 Cb -0.11 -3.42 -0.00 0.00 -0.52 0.00 0.00 37.83 33.78 2a7r s LYS 262 CO 0.02 0.29 0.03 0.66 -0.92 0.00 0.00 175.35 175.43 2a7r n TYR 263 N 3.52 0.56 -3.78 3.18 4.02 0.42 -1.05 117.16 124.03 2a7r n TYR 263 Ca -0.15 -1.68 -0.13 0.00 -0.01 0.00 0.00 57.90 55.94 2a7r n TYR 263 Cb 0.52 -0.15 -0.11 0.00 -0.02 0.00 0.00 39.34 39.58 2a7r n TYR 263 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 2a7r s LYS 264 N -3.15 0.37 0.27 -0.72 1.02 -0.38 -1.52 119.74 115.62 2a7r s LYS 264 Ca 0.04 0.32 -0.29 0.00 0.02 0.00 0.00 55.97 56.06 2a7r s LYS 264 Cb 0.00 0.17 -0.09 0.00 -0.52 0.00 0.00 37.83 37.39 2a7r s LYS 264 CO 0.03 -0.05 1.17 -0.51 -0.92 0.00 0.00 175.35 175.06 2a7r s LEU 265 N -0.03 4.50 -0.45 3.17 1.43 -0.69 -0.59 118.68 126.03 2a7r s LEU 265 Ca -0.02 2.34 0.02 0.00 -1.03 0.00 0.00 54.13 55.45 2a7r s LEU 265 Cb -0.02 -3.63 0.14 0.00 0.03 0.00 0.00 46.19 42.71 2a7r s LEU 265 CO 0.01 -0.28 0.27 0.12 0.23 0.00 0.00 176.35 176.70 2a7r s PHE 266 N -0.88 1.84 0.22 0.29 5.36 0.19 -3.66 117.98 121.34 2a7r s PHE 266 Ca 0.47 -2.39 -0.05 0.00 -0.96 0.00 0.00 56.93 54.01 2a7r s PHE 266 Cb -0.34 -1.70 -0.05 0.00 -0.34 0.00 0.00 43.02 40.59 2a7r s PHE 266 CO 0.42 -0.77 0.47 1.52 -1.46 0.00 0.00 175.22 175.40 2a7r s TYR 267 N 0.24 3.47 0.00 10.12 -0.85 -1.26 -2.52 117.35 126.55 2a7r s TYR 267 Ca 0.20 0.58 0.00 0.00 -0.52 0.00 0.00 57.07 57.34 2a7r s TYR 267 Cb -0.18 -2.04 0.00 0.00 0.38 0.00 0.00 41.96 40.12 2a7r s TYR 267 CO -0.04 0.30 0.00 0.41 -1.52 0.00 0.00 175.55 174.70 2a7r n GLY 268 N -0.51 -1.69 0.08 5.49 0.00 -1.25 -4.63 105.19 102.68 2a7r n GLY 268 Ca -0.02 -1.57 -0.05 0.00 0.00 0.00 0.00 46.02 44.37 2a7r n GLY 268 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2a7r h MET 269 N 0.00 0.00 0.00 1.61 0.00 -1.93 -3.34 114.93 111.27 2a7r h MET 269 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 59.70 59.68 2a7r h MET 269 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 31.60 31.56 2a7r h MET 269 CO 0.00 0.79 -0.32 0.43 0.00 0.00 0.00 176.91 177.81 2a7r n SER 270 N -3.26 1.71 -3.49 1.22 7.64 -1.26 -4.82 113.62 111.36 2a7r n SER 270 Ca -0.03 -3.10 -0.31 0.00 1.01 0.00 0.00 58.87 56.44 2a7r n SER 270 Cb 0.91 -0.42 0.27 0.00 -1.01 0.00 0.00 64.21 63.97 2a7r n SER 270 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2a7r s SER 271 N -2.66 -0.32 0.13 6.43 1.04 -1.25 -3.17 113.70 113.89 2a7r s SER 271 Ca 0.30 0.66 -0.01 0.00 0.48 0.00 0.00 55.95 57.38 2a7r s SER 271 Cb 0.28 -0.90 -0.10 0.00 0.10 0.00 0.00 66.02 65.40 2a7r s SER 271 CO -0.02 -4.89 1.30 1.05 0.98 0.00 0.00 173.24 171.66 2a7r h GLU 272 N -3.10 0.27 0.00 4.02 -0.00 -1.88 -2.54 114.58 111.35 2a7r h GLU 272 Ca -0.42 -0.33 0.00 0.00 -0.00 0.00 0.00 59.36 58.61 2a7r h GLU 272 Cb 1.31 0.10 0.00 0.00 -0.00 0.00 0.00 28.75 30.17 2a7r h GLU 272 CO 0.28 1.06 0.00 -0.12 -0.00 0.00 0.00 179.01 180.23 2a7r n MET 273 N -3.65 0.14 -0.09 1.06 0.00 -1.26 -1.87 117.12 111.45 2a7r n MET 273 Ca -0.05 0.21 -0.17 0.00 -0.00 0.00 0.00 57.70 57.69 2a7r n MET 273 Cb 0.87 -1.69 -0.12 0.00 0.00 0.00 0.00 33.22 32.28 2a7r n MET 273 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2a7r h ALA 274 N 2.58 0.13 -0.30 -5.12 0.00 -1.81 -2.74 119.26 112.01 2a7r h ALA 274 Ca 0.00 -0.84 -0.04 0.00 0.00 0.00 0.00 54.91 54.03 2a7r h ALA 274 Cb 0.51 0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2a7r h ALA 274 CO 0.00 0.36 0.00 0.52 0.00 0.00 0.00 179.25 180.13 2a7r h MET 275 N -1.00 0.45 0.05 0.00 2.86 -1.42 0.62 114.93 116.49 2a7r h MET 275 Ca -0.17 -0.09 -0.23 0.00 -2.06 0.00 0.00 59.70 57.15 2a7r h MET 275 Cb 1.11 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.68 2a7r h MET 275 CO -0.10 0.48 -1.07 0.87 1.06 0.00 0.00 176.91 178.14 2a7r h LYS 276 N 0.44 0.11 0.12 1.72 6.56 -1.53 -3.34 116.57 120.64 2a7r h LYS 276 Ca 0.10 -0.18 -0.32 0.00 -1.06 0.00 0.00 60.65 59.18 2a7r h LYS 276 Cb 0.29 0.07 -0.01 0.00 -0.57 0.00 0.00 32.23 32.00 2a7r h LYS 276 CO 0.01 1.07 -1.66 1.57 -2.06 0.00 0.00 179.45 178.38 2a7r h LYS 277 N 0.03 0.25 -7.31 3.15 2.10 -1.17 -3.47 116.57 110.16 2a7r h LYS 277 Ca -0.06 -0.43 -0.51 0.00 -2.00 0.00 0.00 60.65 57.65 2a7r h LYS 277 Cb 1.82 0.16 0.10 0.00 -0.90 0.00 0.00 32.23 33.41 2a7r h LYS 277 CO 0.16 1.10 0.36 1.52 -2.00 0.00 0.00 179.45 180.59 2a7r s TYR 278 N -2.60 2.93 0.44 0.07 1.13 0.21 -4.95 117.35 114.58 2a7r s TYR 278 Ca -0.12 1.47 0.20 0.00 -1.41 0.00 0.00 57.07 57.22 2a7r s TYR 278 Cb 0.07 -2.96 1.21 0.00 -1.10 0.00 0.00 41.96 39.18 2a7r s TYR 278 CO 0.84 -1.39 2.03 0.00 -2.51 0.00 0.00 175.55 174.52 2a7r h ALA 279 N -0.64 1.51 0.00 9.51 0.00 -1.87 -3.47 119.26 124.30 2a7r h ALA 279 Ca -0.44 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.32 2a7r h ALA 279 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 2a7r h ALA 279 CO 0.55 0.20 0.00 0.41 0.00 0.00 0.00 179.25 180.41 2a7r n GLY 280 N -0.88 4.67 1.22 0.00 0.00 -1.26 -5.12 105.19 103.82 2a7r n GLY 280 Ca -0.02 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.74 2a7r n GLY 280 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a7r n GLY 281 N -2.00 -0.09 0.00 -0.02 0.00 -1.26 -5.00 105.19 96.82 2a7r n GLY 281 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2a7r n GLY 281 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2a7r n VAL 282 N -0.81 0.00 0.22 1.61 0.24 -1.26 -4.92 118.33 113.41 2a7r n VAL 282 Ca 0.00 0.00 0.06 0.00 -2.04 0.00 0.00 64.34 62.36 2a7r n VAL 282 Cb 0.40 0.15 0.50 0.00 -1.47 0.00 0.00 33.84 33.42 2a7r n VAL 282 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2a7r h ALA 283 N 0.00 1.56 -0.05 2.33 0.00 -1.91 -2.75 119.26 118.44 2a7r h ALA 283 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2a7r h ALA 283 Cb 0.54 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2a7r h ALA 283 CO 0.00 0.28 -0.23 -0.85 0.00 0.00 0.00 179.25 178.45 2a7r n GLU 284 N -4.16 1.56 -0.03 0.00 -0.00 -1.26 -4.69 120.64 112.06 2a7r n GLU 284 Ca -0.02 -2.97 -0.16 0.00 -0.00 0.00 0.00 57.16 54.01 2a7r n GLU 284 Cb 0.29 -1.60 -0.08 0.00 -0.00 0.00 0.00 31.44 30.05 2a7r n GLU 284 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.13 176.21 2a7r h TYR 285 N 0.64 0.73 -3.94 -1.84 3.20 -1.81 -0.94 116.97 113.01 2a7r h TYR 285 Ca 0.02 -0.31 -0.48 0.00 3.14 0.00 0.00 58.73 61.10 2a7r h TYR 285 Cb 1.09 -0.12 -0.22 0.00 1.54 0.00 0.00 36.73 39.02 2a7r h TYR 285 CO 0.45 1.08 -0.80 1.03 -1.64 0.00 0.00 178.16 178.29 2a7r s ARG 286 N -3.76 0.97 0.47 1.82 1.81 -1.26 -2.40 118.95 116.60 2a7r s ARG 286 Ca -0.13 -1.05 0.08 0.00 -1.72 0.00 0.00 55.73 52.92 2a7r s ARG 286 Cb 0.06 -1.10 0.45 0.00 -0.45 0.00 0.00 34.95 33.92 2a7r s ARG 286 CO 0.83 0.25 1.15 0.00 -0.68 0.00 0.00 175.30 176.85 2a7r h ALA 287 N 4.20 1.53 -2.51 2.13 0.00 -1.77 -3.42 119.26 119.42 2a7r h ALA 287 Ca -0.43 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.40 2a7r h ALA 287 Cb 1.19 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.81 2a7r h ALA 287 CO 0.40 -0.53 -0.08 -1.54 0.00 0.00 0.00 179.25 177.50 2a7r s SER 288 N -3.18 -0.32 -0.71 0.00 1.04 -1.26 -4.90 113.70 104.38 2a7r s SER 288 Ca -0.01 0.04 -0.26 0.00 0.48 0.00 0.00 55.95 56.20 2a7r s SER 288 Cb 0.02 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.57 2a7r s SER 288 CO 0.08 -0.67 1.69 -1.61 0.98 0.00 0.00 173.24 173.71 2a7r s GLU 289 N -2.42 2.83 0.59 4.02 2.02 -1.26 -4.59 118.70 119.89 2a7r s GLU 289 Ca -0.06 0.15 -0.18 0.00 0.02 0.00 0.00 54.97 54.91 2a7r s GLU 289 Cb -0.01 -4.48 -0.07 0.00 0.10 0.00 0.00 34.13 29.68 2a7r s GLU 289 CO -0.02 -2.62 0.73 0.41 0.02 0.00 0.00 175.26 173.78 2a7r n GLY 290 N 5.84 -0.95 3.82 -1.39 0.00 -1.19 -4.76 105.19 106.56 2a7r n GLY 290 Ca 0.19 -0.17 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 2a7r n GLY 290 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2a7r s LYS 291 N -2.44 4.20 0.02 1.61 -0.14 -0.87 -3.51 119.74 118.61 2a7r s LYS 291 Ca 0.73 0.75 -0.17 0.00 -1.36 0.00 0.00 55.97 55.91 2a7r s LYS 291 Cb -0.43 -3.10 -0.06 0.00 -1.68 0.00 0.00 37.83 32.57 2a7r s LYS 291 CO 0.50 0.55 0.50 0.99 -0.76 0.00 0.00 175.35 177.13 2a7r s THR 292 N -1.28 4.91 0.25 2.17 2.01 -1.26 -3.85 115.64 118.59 2a7r s THR 292 Ca 0.34 1.04 -0.03 0.00 0.31 0.00 0.00 61.69 63.36 2a7r s THR 292 Cb -0.18 -3.82 -0.02 0.00 0.01 0.00 0.00 72.50 68.49 2a7r s THR 292 CO 0.20 0.53 0.28 0.68 -0.69 0.00 0.00 174.62 175.63 2a7r s VAL 293 N -0.87 0.00 -0.38 3.82 -7.23 -1.05 -4.96 120.40 109.73 2a7r s VAL 293 Ca 0.27 -1.81 -0.07 0.00 -1.81 0.00 0.00 61.98 58.56 2a7r s VAL 293 Cb -0.18 -2.46 0.06 0.00 0.56 0.00 0.00 36.38 34.37 2a7r s VAL 293 CO 0.16 0.00 0.19 -1.61 -0.31 0.00 0.00 175.10 173.52 2a7r s GLU 294 N -3.85 2.55 -0.08 4.82 2.02 -1.26 0.53 118.70 123.42 2a7r s GLU 294 Ca 0.34 -1.37 -0.21 0.00 0.02 0.00 0.00 54.97 53.75 2a7r s GLU 294 Cb 0.03 -3.62 -0.04 0.00 0.10 0.00 0.00 34.13 30.60 2a7r s GLU 294 CO 0.15 -0.84 0.59 0.54 0.02 0.00 0.00 175.26 175.72 2a7r s VAL 295 N 1.39 5.10 0.28 2.63 0.11 0.25 -4.88 120.40 125.27 2a7r s VAL 295 Ca 0.02 1.20 -0.30 0.00 -2.93 0.00 0.00 61.98 59.97 2a7r s VAL 295 Cb -0.21 -3.93 -0.10 0.00 -1.53 0.00 0.00 36.38 30.60 2a7r s VAL 295 CO 0.02 0.30 1.47 -2.16 -3.33 0.00 0.00 175.10 171.40 2a7r s PRO 296 N 0.62 4.23 -0.15 1.54 0.04 -1.26 -1.25 135.00 138.77 2a7r s PRO 296 Ca 0.32 2.38 -0.36 0.00 0.04 0.00 0.00 61.00 63.38 2a7r s PRO 296 Cb -0.17 -3.08 -0.13 0.00 0.04 0.00 0.00 34.50 31.17 2a7r s PRO 296 CO 0.14 -0.46 1.87 0.34 0.04 0.00 0.00 177.00 178.94 2a7r n PHE 297 N 2.02 2.23 0.56 0.56 7.35 -0.21 -4.79 117.46 125.18 2a7r n PHE 297 Ca 0.06 0.13 0.12 0.00 -0.76 0.00 0.00 57.45 57.00 2a7r n PHE 297 Cb 0.40 -2.61 0.16 0.00 0.35 0.00 0.00 39.48 37.78 2a7r n PHE 297 CO 0.00 0.00 0.00 0.36 -0.76 0.00 0.00 176.76 176.36 2a7r n LYS 298 N 6.47 2.37 0.00 -4.13 2.85 0.25 -4.96 118.16 121.01 2a7r n LYS 298 Ca 0.25 -2.11 0.00 0.00 -1.05 0.00 0.00 58.31 55.39 2a7r n LYS 298 Cb 0.25 -1.48 0.00 0.00 -0.65 0.00 0.00 35.03 33.15 2a7r n LYS 298 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2a7r n GLY 299 N 1.40 0.30 3.73 2.58 0.00 -1.25 -4.81 105.19 107.12 2a7r n GLY 299 Ca 0.17 -0.76 -0.39 0.00 0.00 0.00 0.00 46.02 45.04 2a7r n GLY 299 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2a7r s ASP 300 N -4.00 6.87 0.41 1.61 -0.00 -1.26 0.99 116.67 121.29 2a7r s ASP 300 Ca 0.00 1.04 0.12 0.00 -0.00 0.00 0.00 52.55 53.71 2a7r s ASP 300 Cb 0.00 -2.35 0.94 0.00 -0.00 0.00 0.00 42.92 41.51 2a7r s ASP 300 CO 0.00 -0.03 1.95 0.58 -0.00 0.00 0.00 175.17 177.67 2a7r h VAL 301 N 4.62 0.89 -0.66 -1.27 2.07 -1.95 -2.67 116.25 117.28 2a7r h VAL 301 Ca -0.42 -0.18 0.09 0.00 0.82 0.00 0.00 66.70 67.01 2a7r h VAL 301 Cb 1.19 0.32 -0.10 0.00 -1.52 0.00 0.00 31.29 31.18 2a7r h VAL 301 CO 0.74 0.10 -0.29 1.21 0.02 0.00 0.00 177.57 179.35 2a7r n GLU 302 N -4.49 -0.19 -0.01 1.57 4.07 -1.26 -0.34 120.64 119.99 2a7r n GLU 302 Ca 0.12 1.02 -0.13 0.00 -0.06 0.00 0.00 57.16 58.11 2a7r n GLU 302 Cb 0.39 -1.50 -0.10 0.00 -0.06 0.00 0.00 31.44 30.17 2a7r n GLU 302 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 2a7r h HIS 303 N 0.00 -0.01 -0.93 4.31 -0.00 -1.88 -3.00 115.15 113.64 2a7r h HIS 303 Ca 0.20 -0.00 0.21 0.00 -0.00 0.00 0.00 60.37 60.78 2a7r h HIS 303 Cb 0.37 0.00 -0.12 0.00 -0.00 0.00 0.00 27.41 27.66 2a7r h HIS 303 CO -0.61 0.47 0.48 1.15 -0.00 0.00 0.00 177.93 179.43 2a7r h THR 304 N -0.49 0.56 -0.03 2.45 2.02 -0.92 0.10 112.91 116.60 2a7r h THR 304 Ca -0.00 -0.18 -0.00 0.00 0.77 0.00 0.00 66.41 67.00 2a7r h THR 304 Cb 0.48 -0.02 -0.00 0.00 -1.74 0.00 0.00 68.15 66.87 2a7r h THR 304 CO 0.00 0.10 0.01 0.40 0.37 0.00 0.00 175.52 176.40 2a7r h ILE 305 N 0.53 1.08 -0.03 3.11 1.08 -0.68 -0.60 117.51 122.00 2a7r h ILE 305 Ca 0.57 -0.24 0.00 0.00 -0.39 0.00 0.00 64.86 64.80 2a7r h ILE 305 Cb 1.03 1.20 -0.00 0.00 -3.07 0.00 0.00 36.82 35.98 2a7r h ILE 305 CO -0.47 0.07 0.02 0.03 -0.69 0.00 0.00 178.15 177.11 2a7r h ARG 306 N -0.06 0.03 -0.10 2.37 3.08 -0.85 -0.23 114.38 118.63 2a7r h ARG 306 Ca 0.01 -0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.86 2a7r h ARG 306 Cb 0.10 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.14 2a7r h ARG 306 CO -0.00 0.02 -0.76 0.22 -1.07 0.00 0.00 179.97 178.38 2a7r h ASP 307 N 0.03 0.64 0.22 7.04 3.58 -0.35 -1.17 116.42 126.40 2a7r h ASP 307 Ca 0.01 -0.42 -0.01 0.00 0.42 0.00 0.00 57.03 57.03 2a7r h ASP 307 Cb 0.01 -0.19 0.00 0.00 1.72 0.00 0.00 39.33 40.87 2a7r h ASP 307 CO -0.00 1.19 -0.11 0.40 -2.88 0.00 0.00 179.24 177.84 2a7r h ILE 308 N 0.36 0.43 -1.00 2.25 2.04 -0.11 -2.16 117.51 119.33 2a7r h ILE 308 Ca -0.04 -0.96 0.14 0.00 1.00 0.00 0.00 64.86 65.00 2a7r h ILE 308 Cb 1.36 0.74 -0.09 0.00 -0.74 0.00 0.00 36.82 38.09 2a7r h ILE 308 CO 0.14 0.12 0.62 -0.07 0.00 0.00 0.00 178.15 178.96 2a7r h LEU 309 N -1.00 0.86 0.03 1.44 3.38 -1.19 -0.61 115.31 118.22 2a7r h LEU 309 Ca -0.03 0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.02 2a7r h LEU 309 Cb 0.42 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 2a7r h LEU 309 CO 0.05 0.41 -0.11 1.23 0.09 0.00 0.00 178.44 180.12 2a7r h GLY 310 N 0.90 -0.15 0.86 0.83 0.00 -1.22 -0.55 103.07 103.74 2a7r h GLY 310 Ca 0.52 0.12 0.03 0.00 0.00 0.00 0.00 47.33 48.00 2a7r h GLY 310 CO -0.29 -0.11 0.34 -1.33 0.00 0.00 0.00 176.54 175.15 2a7r h GLY 311 N -0.20 0.81 1.14 4.60 0.00 -0.51 -2.19 103.07 106.72 2a7r h GLY 311 Ca 0.03 -0.26 -0.00 0.00 0.00 0.00 0.00 47.33 47.10 2a7r h GLY 311 CO -0.08 0.21 0.51 -2.22 0.00 0.00 0.00 176.54 174.95 2a7r h ILE 312 N 0.67 1.23 -0.70 2.60 1.08 -0.91 -1.29 117.51 120.21 2a7r h ILE 312 Ca 0.23 -0.51 -0.01 0.00 -0.39 0.00 0.00 64.86 64.18 2a7r h ILE 312 Cb 0.03 0.04 -0.03 0.00 -3.07 0.00 0.00 36.82 33.79 2a7r h ILE 312 CO -0.10 0.24 0.40 0.03 -0.69 0.00 0.00 178.15 178.03 2a7r h ARG 313 N 1.16 0.97 -0.34 2.37 3.08 -0.53 -2.17 114.38 118.92 2a7r h ARG 313 Ca 0.30 -0.10 -0.03 0.00 0.07 0.00 0.00 59.98 60.22 2a7r h ARG 313 Cb -0.05 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 29.79 2a7r h ARG 313 CO -0.06 0.71 0.08 0.77 -1.07 0.00 0.00 179.97 180.40 2a7r h SER 314 N 0.96 0.51 -0.78 7.04 0.02 -0.82 -1.88 113.55 118.60 2a7r h SER 314 Ca 0.25 -0.23 0.15 0.00 -0.84 0.00 0.00 61.79 61.11 2a7r h SER 314 Cb 0.01 -0.13 -0.10 0.00 0.14 0.00 0.00 62.40 62.32 2a7r h SER 314 CO -0.04 0.61 0.33 0.74 -1.14 0.00 0.00 176.83 177.32 2a7r h THR 315 N 0.39 0.66 -0.32 -2.27 2.02 -0.92 0.55 112.91 113.01 2a7r h THR 315 Ca 0.11 -0.16 -0.06 0.00 0.77 0.00 0.00 66.41 67.07 2a7r h THR 315 Cb 0.30 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 66.85 2a7r h THR 315 CO 0.00 0.09 -0.02 0.00 0.37 0.00 0.00 175.52 175.95 2a7r h THR 317 N 0.37 0.64 -0.54 0.00 2.02 -0.31 0.41 112.91 115.49 2a7r h THR 317 Ca 0.09 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.36 2a7r h THR 317 Cb 0.48 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.50 2a7r h THR 317 CO 0.02 0.00 0.37 1.88 0.37 0.00 0.00 175.52 178.16 2a7r h TYR 318 N -0.11 0.34 0.00 3.16 -1.99 -0.82 -2.58 116.97 114.96 2a7r h TYR 318 Ca 0.11 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.85 2a7r h TYR 318 Cb 0.28 -0.11 0.00 0.00 2.00 0.00 0.00 36.73 38.90 2a7r h TYR 318 CO -0.28 0.16 -1.55 0.28 -0.00 0.00 0.00 178.16 176.77 2a7r n VAL 319 N -4.46 0.16 -0.20 -2.88 0.31 -0.78 -0.44 118.33 110.04 2a7r n VAL 319 Ca 0.09 -0.43 0.00 0.00 -0.01 0.00 0.00 64.34 63.99 2a7r n VAL 319 Cb 0.38 0.05 0.00 0.00 -0.91 0.00 0.00 33.84 33.36 2a7r n VAL 319 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2a7r n GLY 320 N 1.28 0.90 3.55 2.92 0.00 0.13 -4.42 105.19 109.55 2a7r n GLY 320 Ca -0.02 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 2a7r n GLY 320 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a7r s ALA 321 N -2.00 3.51 0.07 4.61 0.00 -0.32 -4.92 121.76 122.72 2a7r s ALA 321 Ca 0.00 -1.22 0.10 0.00 0.00 0.00 0.00 51.96 50.84 2a7r s ALA 321 Cb 0.00 -2.73 -0.01 0.00 0.00 0.00 0.00 23.12 20.38 2a7r s ALA 321 CO 0.00 -0.96 1.39 0.00 0.00 0.00 0.00 175.76 176.20 2a7r h ALA 322 N 8.44 0.55 -4.19 0.00 0.00 -1.89 -3.38 119.26 118.79 2a7r h ALA 322 Ca -0.31 -0.71 -0.54 0.00 0.00 0.00 0.00 54.91 53.35 2a7r h ALA 322 Cb 1.15 -0.13 -0.28 0.00 0.00 0.00 0.00 17.79 18.54 2a7r h ALA 322 CO 0.66 0.98 -0.83 -1.59 0.00 0.00 0.00 179.25 178.47 2a7r s LYS 323 N -2.95 1.35 0.54 0.00 0.00 -1.26 -1.56 119.74 115.86 2a7r s LYS 323 Ca 0.01 -0.71 0.32 0.00 0.00 0.00 0.00 55.97 55.59 2a7r s LYS 323 Cb 0.10 -1.35 1.49 0.00 0.00 0.00 0.00 37.83 38.07 2a7r s LYS 323 CO 0.78 0.36 1.88 1.25 0.00 0.00 0.00 175.35 179.62 2a7r h LEU 324 N 5.42 0.00 -1.26 2.77 5.85 -1.48 0.29 115.31 126.90 2a7r h LEU 324 Ca -0.38 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.38 2a7r h LEU 324 Cb 1.16 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 2a7r h LEU 324 CO 0.47 0.00 0.53 0.11 -0.34 0.00 0.00 178.44 179.20 2a7r h LYS 325 N 0.00 0.91 0.00 1.25 6.56 -1.85 -1.87 116.57 121.57 2a7r h LYS 325 Ca 0.44 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.97 2a7r h LYS 325 Cb 1.77 -0.21 0.00 0.00 -0.57 0.00 0.00 32.23 33.22 2a7r h LYS 325 CO -0.00 0.60 0.00 0.93 -2.06 0.00 0.00 179.45 178.92 2a7r h GLU 326 N 0.94 0.00 -0.26 3.15 5.08 -0.80 -3.38 114.58 119.31 2a7r h GLU 326 Ca 0.33 0.00 0.05 0.00 -1.00 0.00 0.00 59.36 58.74 2a7r h GLU 326 Cb 0.12 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.30 2a7r h GLU 326 CO -0.11 0.00 -0.45 1.25 -1.00 0.00 0.00 179.01 178.70 2a7r h LEU 327 N 0.00 -1.47 -0.54 1.33 5.85 -1.34 -0.76 115.31 118.39 2a7r h LEU 327 Ca 0.00 0.20 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 2a7r h LEU 327 Cb 0.65 0.61 -0.02 0.00 0.37 0.00 0.00 40.66 42.27 2a7r h LEU 327 CO 0.00 -0.41 -0.09 0.77 -0.34 0.00 0.00 178.44 178.37 2a7r h SER 328 N -0.43 1.01 -0.42 1.25 4.64 -1.75 -2.23 113.55 115.62 2a7r h SER 328 Ca 0.09 -0.35 0.12 0.00 -0.47 0.00 0.00 61.79 61.19 2a7r h SER 328 Cb 0.62 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.42 2a7r h SER 328 CO -0.49 1.12 0.44 0.03 -0.87 0.00 0.00 176.83 177.06 2a7r h ARG 329 N 0.89 0.00 -0.29 4.77 -0.00 -1.59 0.20 114.38 118.35 2a7r h ARG 329 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.62 2a7r h ARG 329 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.63 2a7r h ARG 329 CO 0.05 0.00 0.00 0.54 0.00 0.00 0.00 179.97 180.56 2a7r n ARG 330 N -3.74 2.90 -3.29 0.04 1.74 -0.35 -5.02 116.66 108.94 2a7r n ARG 330 Ca 0.07 -2.46 -0.38 0.00 -0.77 0.00 0.00 57.85 54.31 2a7r n ARG 330 Cb 0.62 -1.57 -0.06 0.00 -1.02 0.00 0.00 32.46 30.43 2a7r n ARG 330 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2a7r s THR 331 N -1.96 5.16 -0.19 0.55 2.01 0.70 -4.97 115.64 116.95 2a7r s THR 331 Ca 0.33 0.95 -0.00 0.00 0.31 0.00 0.00 61.69 63.28 2a7r s THR 331 Cb 0.23 -3.83 0.05 0.00 0.01 0.00 0.00 72.50 68.96 2a7r s THR 331 CO 0.12 0.27 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.37 2a7r s THR 332 N 1.03 1.22 -0.10 -0.82 2.01 -1.26 -5.03 115.64 112.68 2a7r s THR 332 Ca 0.25 -0.79 -0.23 0.00 0.31 0.00 0.00 61.69 61.23 2a7r s THR 332 Cb -0.15 -1.42 -0.03 0.00 0.01 0.00 0.00 72.50 70.90 2a7r s THR 332 CO 0.10 0.06 0.72 -0.36 -0.69 0.00 0.00 174.62 174.45 2a7r s PHE 333 N 1.57 3.53 -0.19 4.92 0.08 -1.26 -1.73 117.98 124.90 2a7r s PHE 333 Ca -0.01 1.22 -0.13 0.00 0.12 0.00 0.00 56.93 58.13 2a7r s PHE 333 Cb -0.16 -2.84 -0.05 0.00 -0.57 0.00 0.00 43.02 39.40 2a7r s PHE 333 CO -0.07 0.00 0.26 0.42 -0.10 0.00 0.00 175.22 175.73 2a7r s ILE 334 N 1.15 5.32 0.07 0.64 1.09 -0.19 -4.90 121.20 124.37 2a7r s ILE 334 Ca 0.37 0.45 -0.30 0.00 -1.10 0.00 0.00 60.65 60.07 2a7r s ILE 334 Cb -0.17 -3.60 -0.05 0.00 -1.06 0.00 0.00 42.46 37.58 2a7r s ILE 334 CO 0.16 0.37 0.97 0.00 -0.10 0.00 0.00 174.94 176.35 2a7r s ARG 335 N 0.68 4.65 0.09 2.79 3.03 -1.26 -1.52 118.95 127.40 2a7r s ARG 335 Ca 0.14 1.45 0.07 0.00 2.03 0.00 0.00 55.73 59.42 2a7r s ARG 335 Cb -0.13 -3.40 -0.04 0.00 -1.03 0.00 0.00 34.95 30.35 2a7r s ARG 335 CO 0.03 0.12 -0.10 0.08 -1.13 0.00 0.00 175.30 174.30 2a7r s VAL 336 N 0.35 3.35 -0.04 4.99 1.01 -0.64 -4.97 120.40 124.45 2a7r s VAL 336 Ca 0.49 -1.20 -0.22 0.00 0.00 0.00 0.00 61.98 61.05 2a7r s VAL 336 Cb -0.23 -2.54 -0.27 0.00 0.00 0.00 0.00 36.38 33.34 2a7r s VAL 336 CO 0.29 0.17 0.97 0.00 0.00 0.00 0.00 175.10 176.53 2a7r h THR 337 N 3.38 1.52 0.00 3.92 1.03 -1.95 -3.45 112.91 117.36 2a7r h THR 337 Ca -0.49 -2.27 0.00 0.00 -0.01 0.00 0.00 66.41 63.65 2a7r h THR 337 Cb 1.17 2.95 0.00 0.00 -1.07 0.00 0.00 68.15 71.20 2a7r h THR 337 CO 0.52 0.64 0.00 1.67 -0.01 0.00 0.00 175.52 178.34