#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pfd n GLN 3 N 0.00 -0.18 -3.19 -1.46 1.13 -1.25 -4.91 117.38 107.51 2pfd n GLN 3 Ca 0.00 0.03 -0.39 0.00 -1.94 0.00 0.00 57.00 54.70 2pfd n GLN 3 Cb 0.00 -2.39 -0.06 0.00 0.11 0.00 0.00 30.24 27.91 2pfd n GLN 3 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2pfd s LEU 4 N -2.35 4.22 -0.11 1.08 2.01 -0.75 -3.99 118.68 118.80 2pfd s LEU 4 Ca 0.00 0.86 0.02 0.00 0.01 0.00 0.00 54.13 55.02 2pfd s LEU 4 Cb -0.00 -2.82 0.01 0.00 0.01 0.00 0.00 46.19 43.39 2pfd s LEU 4 CO 0.02 -0.14 -0.16 -0.69 1.01 0.00 0.00 176.35 176.39 2pfd s VAL 5 N 1.25 1.54 0.26 -1.59 1.01 -0.37 -0.92 120.40 121.58 2pfd s VAL 5 Ca 0.28 -0.68 -0.16 0.00 0.00 0.00 0.00 61.98 61.43 2pfd s VAL 5 Cb -0.16 -1.40 -0.08 0.00 0.00 0.00 0.00 36.38 34.74 2pfd s VAL 5 CO 0.12 0.45 0.69 -0.70 0.00 0.00 0.00 175.10 175.65 2pfd s GLU 6 N 0.89 4.05 -0.15 2.72 2.12 0.50 -1.49 118.70 127.34 2pfd s GLU 6 Ca -0.08 0.66 -0.04 0.00 0.36 0.00 0.00 54.97 55.86 2pfd s GLU 6 Cb -0.15 -2.64 0.07 0.00 0.26 0.00 0.00 34.13 31.67 2pfd s GLU 6 CO -0.00 0.28 0.26 0.00 -0.54 0.00 0.00 175.26 175.26 2pfd n VAL 8 N 5.35 2.17 -1.76 0.00 0.31 -1.14 -1.93 118.33 121.33 2pfd n VAL 8 Ca -0.06 -5.05 -0.42 0.00 -0.01 0.00 0.00 64.34 58.80 2pfd n VAL 8 Cb 0.50 -2.18 -0.03 0.00 -0.91 0.00 0.00 33.84 31.21 2pfd n VAL 8 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2pfd s PRO 9 N -1.82 4.14 -0.63 5.55 0.04 -1.15 -4.07 135.00 137.05 2pfd s PRO 9 Ca 0.30 2.57 -0.18 0.00 0.04 0.00 0.00 61.00 63.74 2pfd s PRO 9 Cb 0.02 -3.11 0.12 0.00 0.04 0.00 0.00 34.50 31.57 2pfd s PRO 9 CO -0.11 -0.74 0.69 1.21 0.04 0.00 0.00 177.00 178.10 2pfd s ASN 10 N 1.25 6.28 -0.11 6.66 3.84 0.15 -1.58 114.94 131.43 2pfd s ASN 10 Ca 0.74 -1.69 -0.15 0.00 0.21 0.00 0.00 52.86 51.97 2pfd s ASN 10 Cb -0.49 -2.28 -0.05 0.00 -0.55 0.00 0.00 41.25 37.89 2pfd s ASN 10 CO 0.32 -1.00 0.38 -0.36 -2.79 0.00 0.00 177.10 173.65 2pfd s PHE 11 N 2.16 3.54 -1.19 0.43 0.08 -0.29 -0.97 117.98 121.74 2pfd s PHE 11 Ca 0.12 0.77 -0.20 0.00 0.12 0.00 0.00 56.93 57.74 2pfd s PHE 11 Cb -0.23 -2.39 0.03 0.00 -0.57 0.00 0.00 43.02 39.86 2pfd s PHE 11 CO 0.03 0.31 1.73 -1.12 -0.10 0.00 0.00 175.22 176.07 2pfd s SER 12 N 0.18 6.30 0.08 1.36 0.01 0.31 0.48 113.70 122.42 2pfd s SER 12 Ca 0.21 -1.98 0.02 0.00 1.31 0.00 0.00 55.95 55.52 2pfd s SER 12 Cb -0.14 -2.58 0.23 0.00 0.21 0.00 0.00 66.02 63.74 2pfd s SER 12 CO 0.08 -1.72 0.37 1.21 0.41 0.00 0.00 173.24 173.59 2pfd n GLU 13 N 8.51 -0.02 0.00 12.44 2.13 -1.18 -4.78 120.64 137.74 2pfd n GLU 13 Ca 0.44 0.34 0.00 0.00 0.66 0.00 0.00 57.16 58.61 2pfd n GLU 13 Cb 0.47 -0.57 0.00 0.00 0.27 0.00 0.00 31.44 31.61 2pfd n GLU 13 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2pfd n GLY 14 N -1.10 0.62 1.23 8.31 0.00 -1.26 -4.43 105.19 108.56 2pfd n GLY 14 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2pfd n GLY 14 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2pfd n ASN 15 N 1.23 -1.64 0.00 1.61 5.15 -1.26 -5.02 115.26 115.34 2pfd n ASN 15 Ca 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2pfd n ASN 15 Cb 0.00 -0.82 0.00 0.00 -0.53 0.00 0.00 39.78 38.43 2pfd n ASN 15 CO 0.00 0.00 0.00 -0.46 1.40 0.00 0.00 177.26 178.20 2pfd n ASN 16 N -0.09 0.00 0.00 1.20 0.23 -1.26 -5.04 115.26 110.29 2pfd n ASN 16 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 2pfd n ASN 16 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 2pfd n ASN 16 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2pfd n GLN 17 N 0.00 0.00 -0.46 -3.83 1.13 -1.26 0.60 117.38 113.56 2pfd n GLN 17 Ca 0.00 0.00 0.39 0.00 -1.94 0.00 0.00 57.00 55.45 2pfd n GLN 17 Cb 0.00 0.00 0.67 0.00 0.11 0.00 0.00 30.24 31.02 2pfd n GLN 17 CO 0.00 0.00 0.00 0.93 -1.44 0.00 0.00 177.06 176.55 2pfd h GLU 18 N 0.00 0.01 0.06 -1.09 5.08 -1.98 0.33 114.58 116.99 2pfd h GLU 18 Ca 0.00 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2pfd h GLU 18 Cb 0.00 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2pfd h GLU 18 CO 0.00 0.01 -0.03 0.28 -1.00 0.00 0.00 179.01 178.27 2pfd h VAL 19 N 0.01 1.13 0.17 3.13 2.07 -0.19 -3.28 116.25 119.29 2pfd h VAL 19 Ca 0.88 -1.57 -0.01 0.00 0.82 0.00 0.00 66.70 66.82 2pfd h VAL 19 Cb 2.77 2.03 -0.00 0.00 -1.52 0.00 0.00 31.29 34.56 2pfd h VAL 19 CO -0.50 0.34 -0.12 0.40 0.02 0.00 0.00 177.57 177.72 2pfd h ILE 20 N -0.90 0.00 0.00 4.57 2.04 -0.40 -2.13 117.51 120.69 2pfd h ILE 20 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 2pfd h ILE 20 Cb 0.62 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.70 2pfd h ILE 20 CO 0.01 0.00 0.00 0.44 0.00 0.00 0.00 178.15 178.60 2pfd h ASP 21 N -0.27 0.00 0.00 1.72 3.32 -1.36 0.32 116.42 120.15 2pfd h ASP 21 Ca -0.02 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 2pfd h ASP 21 Cb 0.22 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 2pfd h ASP 21 CO 0.02 0.00 -0.26 0.00 -1.72 0.00 0.00 179.24 177.27 2pfd h ALA 22 N 2.04 0.05 -0.08 3.45 0.00 -1.59 -2.72 119.26 120.40 2pfd h ALA 22 Ca 0.00 -0.65 0.04 0.00 0.00 0.00 0.00 54.91 54.30 2pfd h ALA 22 Cb 0.09 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 2pfd h ALA 22 CO 0.00 0.15 -0.19 0.82 0.00 0.00 0.00 179.25 180.02 2pfd h ILE 23 N -1.00 0.52 0.00 0.00 2.04 -0.75 -2.73 117.51 115.59 2pfd h ILE 23 Ca -0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.79 2pfd h ILE 23 Cb 1.07 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 37.67 2pfd h ILE 23 CO -0.04 0.00 0.00 -0.24 0.00 0.00 0.00 178.15 177.87 2pfd n SER 24 N -5.33 0.15 -0.09 1.72 2.88 0.11 -1.82 113.62 111.24 2pfd n SER 24 Ca -0.04 0.57 -0.12 0.00 -1.33 0.00 0.00 58.87 57.95 2pfd n SER 24 Cb 0.24 -0.59 -0.05 0.00 -0.75 0.00 0.00 64.21 63.07 2pfd n SER 24 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2pfd n GLN 25 N -1.70 0.51 -0.30 -1.46 6.02 -1.03 -3.58 117.38 115.85 2pfd n GLN 25 Ca -0.00 0.43 0.29 0.00 -0.01 0.00 0.00 57.00 57.72 2pfd n GLN 25 Cb 0.02 -1.62 0.66 0.00 1.02 0.00 0.00 30.24 30.32 2pfd n GLN 25 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2pfd h ALA 26 N -0.90 2.74 -0.00 -1.58 0.00 -1.15 2.23 119.26 120.59 2pfd h ALA 26 Ca -0.15 -0.00 -0.18 0.00 0.00 0.00 0.00 54.91 54.58 2pfd h ALA 26 Cb 0.91 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2pfd h ALA 26 CO -0.09 -1.09 -0.81 0.97 0.00 0.00 0.00 179.25 178.22 2pfd h ILE 27 N 0.15 1.52 -0.01 0.00 2.10 -1.57 -3.24 117.51 116.46 2pfd h ILE 27 Ca 0.55 -2.59 0.00 0.00 1.08 0.00 0.00 64.86 63.90 2pfd h ILE 27 Cb 1.89 2.42 0.00 0.00 -1.09 0.00 0.00 36.82 40.04 2pfd h ILE 27 CO -0.11 0.75 -0.47 -0.24 -1.08 0.00 0.00 178.15 177.00 2pfd n SER 28 N -3.65 1.32 -1.34 2.19 2.88 0.64 -3.57 113.62 112.09 2pfd n SER 28 Ca -0.02 -1.06 0.08 0.00 -1.33 0.00 0.00 58.87 56.54 2pfd n SER 28 Cb 0.77 0.39 0.32 0.00 -0.75 0.00 0.00 64.21 64.94 2pfd n SER 28 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2pfd n GLN 29 N -0.64 3.71 -3.38 -1.46 6.02 0.46 -4.89 117.38 117.19 2pfd n GLN 29 Ca 0.09 -2.86 -0.39 0.00 -0.01 0.00 0.00 57.00 53.83 2pfd n GLN 29 Cb 0.39 -1.92 -0.08 0.00 1.02 0.00 0.00 30.24 29.65 2pfd n GLN 29 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2pfd s THR 30 N -2.34 5.18 0.12 5.09 2.01 -1.22 -5.00 115.64 119.49 2pfd s THR 30 Ca 0.46 0.66 -0.30 0.00 0.31 0.00 0.00 61.69 62.82 2pfd s THR 30 Cb 0.34 -3.72 -0.07 0.00 0.01 0.00 0.00 72.50 69.06 2pfd s THR 30 CO 0.16 0.21 1.14 -2.84 -0.69 0.00 0.00 174.62 172.60 2pfd s PRO 31 N 1.65 4.52 0.00 4.92 0.02 -1.26 -3.64 135.00 141.21 2pfd s PRO 31 Ca 0.17 1.73 0.00 0.00 0.02 0.00 0.00 61.00 62.93 2pfd s PRO 31 Cb -0.15 -3.31 0.00 0.00 0.02 0.00 0.00 34.50 31.06 2pfd s PRO 31 CO 0.09 -0.07 0.00 0.41 -0.33 0.00 0.00 177.00 177.09 2pfd n GLY 32 N 2.55 0.70 3.33 0.52 0.00 -1.26 -4.86 105.19 106.17 2pfd n GLY 32 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 2pfd n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pfd s VAL 34 N -3.20 1.12 -0.34 0.00 1.01 -0.89 -4.92 120.40 113.18 2pfd s VAL 34 Ca 0.24 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.50 2pfd s VAL 34 Cb 0.03 -1.05 0.01 0.00 0.00 0.00 0.00 36.38 35.37 2pfd s VAL 34 CO 0.07 0.36 1.22 -0.22 0.00 0.00 0.00 175.10 176.53 2pfd s LEU 35 N 0.96 3.84 -0.03 3.92 2.96 -1.26 -2.31 118.68 126.76 2pfd s LEU 35 Ca -0.09 1.03 0.19 0.00 -0.22 0.00 0.00 54.13 55.04 2pfd s LEU 35 Cb -0.15 -3.54 -0.21 0.00 0.50 0.00 0.00 46.19 42.79 2pfd s LEU 35 CO 0.00 -1.07 0.53 0.18 -1.32 0.00 0.00 176.35 174.67 2pfd n LEU 36 N 7.53 0.41 0.00 -0.68 4.77 0.82 -4.98 117.00 124.87 2pfd n LEU 36 Ca 0.14 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 2pfd n LEU 36 Cb 0.47 0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 2pfd n LEU 36 CO 0.64 0.20 0.00 -0.67 -1.33 0.00 0.00 177.39 176.23 2pfd n ASP 37 N -2.69 0.00 -4.00 -1.43 4.64 -0.96 -4.99 116.55 107.12 2pfd n ASP 37 Ca -0.15 0.00 -0.31 0.00 -1.38 0.00 0.00 54.79 52.95 2pfd n ASP 37 Cb 0.86 0.00 -0.14 0.00 -1.04 0.00 0.00 41.12 40.79 2pfd n ASP 37 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 2pfd s VAL 38 N -1.09 2.48 -0.20 5.18 0.11 -1.26 0.15 120.40 125.77 2pfd s VAL 38 Ca 0.00 -2.74 -0.25 0.00 -2.93 0.00 0.00 61.98 56.07 2pfd s VAL 38 Cb 0.00 -2.77 -0.01 0.00 -1.53 0.00 0.00 36.38 32.07 2pfd s VAL 38 CO 0.00 -0.69 0.82 -0.62 -3.33 0.00 0.00 175.10 171.28 2pfd s ASP 39 N 0.46 6.89 -0.00 3.54 -1.08 0.60 -4.94 116.67 122.14 2pfd s ASP 39 Ca 0.13 1.09 0.07 0.00 -0.52 0.00 0.00 52.55 53.33 2pfd s ASP 39 Cb -0.22 -2.44 -0.03 0.00 -1.46 0.00 0.00 42.92 38.78 2pfd s ASP 39 CO -0.05 -0.44 -0.22 0.00 0.52 0.00 0.00 175.17 174.99 2pfd s ALA 40 N 2.41 2.38 -0.28 3.66 0.00 -1.26 0.57 121.76 129.24 2pfd s ALA 40 Ca 0.36 -1.13 -0.02 0.00 0.00 0.00 0.00 51.96 51.16 2pfd s ALA 40 Cb -0.16 -0.67 0.09 0.00 0.00 0.00 0.00 23.12 22.38 2pfd s ALA 40 CO 0.10 0.55 0.10 0.20 0.00 0.00 0.00 175.76 176.71 2pfd s GLY 41 N -0.94 0.78 0.18 0.00 0.00 -0.70 -5.02 107.32 101.64 2pfd s GLY 41 Ca 0.12 -1.26 -0.23 0.00 0.00 0.00 0.00 44.72 43.34 2pfd s GLY 41 CO 0.01 1.76 1.56 -2.55 0.00 0.00 0.00 173.10 173.88 2pfd h PRO 42 N 8.24 -0.14 0.00 2.90 0.11 -1.97 0.89 132.00 142.04 2pfd h PRO 42 Ca -0.16 0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.85 2pfd h PRO 42 Cb 1.03 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 2pfd h PRO 42 CO 0.43 -0.09 -0.49 0.66 -0.21 0.00 0.00 178.00 178.31 2pfd h SER 43 N -0.14 0.00 1.46 -2.05 4.64 -1.97 -1.64 113.55 113.85 2pfd h SER 43 Ca 0.23 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.49 2pfd h SER 43 Cb 0.55 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 2pfd h SER 43 CO -0.78 0.49 -0.26 0.71 -0.87 0.00 0.00 176.83 176.12 2pfd h THR 44 N 0.00 0.48 -6.49 2.95 1.35 -1.69 -2.22 112.91 107.29 2pfd h THR 44 Ca -0.00 -1.49 -0.50 0.00 -0.55 0.00 0.00 66.41 63.87 2pfd h THR 44 Cb 0.92 2.08 -0.03 0.00 -1.73 0.00 0.00 68.15 69.38 2pfd h THR 44 CO 0.06 0.25 -0.90 -3.20 -0.25 0.00 0.00 175.52 171.48 2pfd n ASN 45 N -3.22 -1.16 -4.03 5.36 5.15 0.31 -3.58 115.26 114.08 2pfd n ASN 45 Ca 0.02 -1.03 -0.10 0.00 -0.60 0.00 0.00 54.58 52.87 2pfd n ASN 45 Cb 0.57 -3.00 -0.08 0.00 -0.53 0.00 0.00 39.78 36.74 2pfd n ASN 45 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2pfd s ARG 46 N -6.53 1.15 -0.14 1.20 1.70 -1.20 -3.08 118.95 112.06 2pfd s ARG 46 Ca 0.09 -1.29 -0.02 0.00 -0.47 0.00 0.00 55.73 54.04 2pfd s ARG 46 Cb -0.04 0.34 0.05 0.00 -0.57 0.00 0.00 34.95 34.73 2pfd s ARG 46 CO 0.89 -0.40 0.03 0.99 -1.08 0.00 0.00 175.30 175.72 2pfd s THR 47 N -4.01 0.40 -0.06 4.99 2.01 0.18 -1.71 115.64 117.43 2pfd s THR 47 Ca 0.21 -0.21 -0.26 0.00 0.31 0.00 0.00 61.69 61.75 2pfd s THR 47 Cb 0.04 -0.76 -0.03 0.00 0.01 0.00 0.00 72.50 71.76 2pfd s THR 47 CO 0.02 -0.00 0.80 -0.69 -0.69 0.00 0.00 174.62 174.06 2pfd s VAL 48 N 1.94 4.97 0.01 3.82 1.01 0.19 -1.13 120.40 131.21 2pfd s VAL 48 Ca 0.02 1.64 0.02 0.00 0.00 0.00 0.00 61.98 63.66 2pfd s VAL 48 Cb -0.15 -4.13 -0.04 0.00 0.00 0.00 0.00 36.38 32.06 2pfd s VAL 48 CO -0.07 0.19 0.01 -0.31 0.00 0.00 0.00 175.10 174.92 2pfd s TYR 49 N 1.07 3.09 -0.06 5.22 1.51 -0.61 -0.29 117.35 127.28 2pfd s TYR 49 Ca 0.42 0.08 0.02 0.00 -1.01 0.00 0.00 57.07 56.57 2pfd s TYR 49 Cb -0.18 -1.66 0.02 0.00 -0.11 0.00 0.00 41.96 40.02 2pfd s TYR 49 CO 0.20 0.47 -0.09 0.99 -1.11 0.00 0.00 175.55 176.01 2pfd s THR 50 N -1.13 0.93 0.00 -0.71 2.01 0.12 -2.92 115.64 113.95 2pfd s THR 50 Ca 0.21 -0.35 -0.23 0.00 0.31 0.00 0.00 61.69 61.62 2pfd s THR 50 Cb -0.12 -0.87 0.05 0.00 0.01 0.00 0.00 72.50 71.57 2pfd s THR 50 CO 0.12 0.31 0.52 0.72 -0.69 0.00 0.00 174.62 175.60 2pfd s PHE 51 N 0.77 -0.43 0.46 4.92 -0.71 -0.81 -0.12 117.98 122.05 2pfd s PHE 51 Ca -0.13 0.62 0.01 0.00 -1.04 0.00 0.00 56.93 56.39 2pfd s PHE 51 Cb -0.15 0.30 0.01 0.00 -1.21 0.00 0.00 43.02 41.97 2pfd s PHE 51 CO 0.02 -0.57 0.07 1.33 -1.34 0.00 0.00 175.22 174.73 2pfd n VAL 52 N 0.76 0.00 -0.31 -2.49 0.24 -0.98 -0.21 118.33 115.35 2pfd n VAL 52 Ca -0.19 -2.09 0.00 0.00 -2.04 0.00 0.00 64.34 60.02 2pfd n VAL 52 Cb 0.58 0.33 0.00 0.00 -1.47 0.00 0.00 33.84 33.28 2pfd n VAL 52 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2pfd n GLY 53 N -0.47 0.60 3.77 7.63 0.00 -0.56 -2.09 105.19 114.07 2pfd n GLY 53 Ca -0.16 -1.84 -0.39 0.00 0.00 0.00 0.00 46.02 43.64 2pfd n GLY 53 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2pfd s GLN 54 N -1.63 3.90 0.02 1.61 1.11 -1.22 -1.24 119.66 122.22 2pfd s GLN 54 Ca 0.00 2.07 -0.04 0.00 0.01 0.00 0.00 55.36 57.40 2pfd s GLN 54 Cb 0.00 -2.67 -0.01 0.00 -1.01 0.00 0.00 33.01 29.32 2pfd s GLN 54 CO 0.00 -0.52 0.26 -2.30 0.01 0.00 0.00 175.29 172.74 2pfd n PRO 55 N -0.02 -0.05 0.06 2.91 -0.02 -1.26 -1.07 135.00 135.54 2pfd n PRO 55 Ca 0.05 0.25 -0.08 0.00 -2.02 0.00 0.00 63.50 61.70 2pfd n PRO 55 Cb 0.45 -0.38 -0.12 0.00 -0.02 0.00 0.00 33.50 33.43 2pfd n PRO 55 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 2pfd h GLU 56 N 0.00 0.04 -0.18 -0.52 9.09 -1.99 -3.30 114.58 117.72 2pfd h GLU 56 Ca 0.02 -0.07 -0.00 0.00 0.05 0.00 0.00 59.36 59.36 2pfd h GLU 56 Cb 0.05 0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.17 2pfd h GLU 56 CO -0.12 1.00 0.09 0.00 0.05 0.00 0.00 179.01 180.03 2pfd h VAL 58 N 0.17 1.11 -0.88 0.00 -1.51 -1.23 -2.70 116.25 111.21 2pfd h VAL 58 Ca 0.06 -0.28 0.11 0.00 -1.23 0.00 0.00 66.70 65.36 2pfd h VAL 58 Cb 0.09 0.23 -0.08 0.00 -2.13 0.00 0.00 31.29 29.40 2pfd h VAL 58 CO -0.01 0.15 0.51 0.58 -1.23 0.00 0.00 177.57 177.57 2pfd h VAL 59 N 0.81 0.90 0.06 7.19 2.07 -1.60 0.48 116.25 126.16 2pfd h VAL 59 Ca 0.25 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.49 2pfd h VAL 59 Cb -0.01 -0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 29.72 2pfd h VAL 59 CO -0.09 0.15 -0.26 -0.33 0.02 0.00 0.00 177.57 177.07 2pfd h GLU 60 N 0.84 -0.36 -0.84 1.57 4.39 -1.29 0.17 114.58 119.06 2pfd h GLU 60 Ca 0.43 0.02 0.20 0.00 0.34 0.00 0.00 59.36 60.35 2pfd h GLU 60 Cb 0.42 0.08 -0.12 0.00 -0.10 0.00 0.00 28.75 29.03 2pfd h GLU 60 CO -0.26 -0.24 0.29 0.78 -1.16 0.00 0.00 179.01 178.42 2pfd h GLY 61 N -0.37 1.32 0.11 -3.84 0.00 -1.17 2.97 103.07 102.08 2pfd h GLY 61 Ca -0.00 -0.10 0.01 0.00 0.00 0.00 0.00 47.33 47.24 2pfd h GLY 61 CO -0.14 -0.25 -0.50 0.00 0.00 0.00 0.00 176.54 175.66 2pfd h ALA 62 N 1.68 -0.97 0.00 3.60 0.00 0.50 0.56 119.26 124.63 2pfd h ALA 62 Ca 0.50 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 2pfd h ALA 62 Cb 0.93 0.88 -0.00 0.00 0.00 0.00 0.00 17.79 19.59 2pfd h ALA 62 CO -0.54 -1.09 -0.16 1.37 0.00 0.00 0.00 179.25 178.83 2pfd h LEU 63 N -0.70 0.00 -1.55 0.00 8.10 0.65 -2.98 115.31 118.83 2pfd h LEU 63 Ca -0.01 0.00 -0.05 0.00 0.11 0.00 0.00 57.88 57.93 2pfd h LEU 63 Cb 0.71 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.92 2pfd h LEU 63 CO -0.27 0.08 -0.24 -1.28 -4.11 0.00 0.00 178.44 172.63 2pfd h SER 64 N 0.00 0.00 1.10 0.17 0.87 0.55 -2.81 113.55 113.42 2pfd h SER 64 Ca -0.00 0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.41 2pfd h SER 64 Cb 1.07 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.00 2pfd h SER 64 CO 0.01 0.24 -0.96 0.00 -0.53 0.00 0.00 176.83 175.59 2pfd h ALA 65 N 1.76 0.63 0.02 6.23 0.00 -0.78 -3.33 119.26 123.79 2pfd h ALA 65 Ca -0.00 -0.70 -0.20 0.00 0.00 0.00 0.00 54.91 54.01 2pfd h ALA 65 Cb 0.47 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2pfd h ALA 65 CO 0.03 0.85 -0.93 0.00 0.00 0.00 0.00 179.25 179.20 2pfd h ALA 66 N 1.39 0.46 0.00 0.00 0.00 -1.37 -2.67 119.26 117.07 2pfd h ALA 66 Ca -0.08 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.05 2pfd h ALA 66 Cb 1.53 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.23 2pfd h ALA 66 CO 0.07 1.02 0.00 2.89 0.00 0.00 0.00 179.25 183.23 2pfd n ARG 67 N -3.55 0.18 -0.06 0.00 1.85 -1.08 -0.39 116.66 113.61 2pfd n ARG 67 Ca -0.03 0.15 -0.13 0.00 -1.00 0.00 0.00 57.85 56.85 2pfd n ARG 67 Cb 0.86 -1.71 -0.14 0.00 -1.05 0.00 0.00 32.46 30.41 2pfd n ARG 67 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2pfd n THR 68 N -2.02 1.56 0.11 8.89 -1.04 -1.20 -3.95 114.28 116.63 2pfd n THR 68 Ca 0.06 -0.76 -0.02 0.00 -2.04 0.00 0.00 64.05 61.29 2pfd n THR 68 Cb 0.39 -1.05 0.03 0.00 -1.82 0.00 0.00 70.33 67.88 2pfd n THR 68 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2pfd h ALA 69 N 0.68 0.63 -0.32 2.41 0.00 -1.47 -3.27 119.26 117.91 2pfd h ALA 69 Ca -0.43 -0.65 0.06 0.00 0.00 0.00 0.00 54.91 53.89 2pfd h ALA 69 Cb 2.07 -0.12 -0.08 0.00 0.00 0.00 0.00 17.79 19.66 2pfd h ALA 69 CO 0.04 0.90 -0.39 0.66 0.00 0.00 0.00 179.25 180.46 2pfd h SER 70 N 0.00 -1.28 -0.77 0.00 4.64 -0.87 -1.80 113.55 113.48 2pfd h SER 70 Ca -0.01 0.20 -0.49 0.00 -0.47 0.00 0.00 61.79 61.02 2pfd h SER 70 Cb 1.44 0.56 -0.20 0.00 -0.31 0.00 0.00 62.40 63.88 2pfd h SER 70 CO 0.09 -0.37 0.62 0.00 -0.87 0.00 0.00 176.83 176.30 2pfd n GLN 71 N -5.42 2.22 0.00 4.77 1.13 -1.24 -4.07 117.38 114.77 2pfd n GLN 71 Ca -0.01 -2.35 0.00 0.00 -1.94 0.00 0.00 57.00 52.70 2pfd n GLN 71 Cb 0.35 -1.93 0.00 0.00 0.11 0.00 0.00 30.24 28.77 2pfd n GLN 71 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 2pfd n LEU 72 N -0.13 0.00 -3.83 1.08 4.77 -0.78 -5.04 117.00 113.07 2pfd n LEU 72 Ca 0.45 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 56.21 2pfd n LEU 72 Cb 0.59 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 41.51 2pfd n LEU 72 CO 0.54 0.05 -0.40 -0.63 -1.33 0.00 0.00 177.39 175.63 2pfd s ILE 73 N 0.00 0.47 0.07 -0.08 1.01 -0.75 -4.91 121.20 117.02 2pfd s ILE 73 Ca 0.00 -0.00 0.01 0.00 0.00 0.00 0.00 60.65 60.66 2pfd s ILE 73 Cb 0.00 -0.57 0.01 0.00 0.01 0.00 0.00 42.46 41.91 2pfd s ILE 73 CO 0.00 0.25 0.08 0.47 0.00 0.00 0.00 174.94 175.74 2pfd n ASP 74 N 4.66 0.61 0.00 3.58 8.00 -1.26 -4.66 116.55 127.47 2pfd n ASP 74 Ca -0.15 -1.21 0.00 0.00 0.71 0.00 0.00 54.79 54.13 2pfd n ASP 74 Cb 0.50 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.57 2pfd n ASP 74 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2pfd n ARG 76 N -0.99 0.00 -0.95 -1.24 1.74 -1.25 -3.44 116.66 110.53 2pfd n ARG 76 Ca 0.01 0.00 -0.02 0.00 -0.77 0.00 0.00 57.85 57.07 2pfd n ARG 76 Cb 0.08 -0.45 0.32 0.00 -1.02 0.00 0.00 32.46 31.38 2pfd n ARG 76 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2pfd n LYS 77 N 0.00 3.96 -4.40 5.56 5.02 -1.26 -4.93 118.16 122.10 2pfd n LYS 77 Ca 0.00 -2.95 -0.34 0.00 -2.02 0.00 0.00 58.31 52.99 2pfd n LYS 77 Cb 0.00 -2.20 -0.10 0.00 -0.02 0.00 0.00 35.03 32.71 2pfd n LYS 77 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 2pfd s HIS 78 N -2.81 3.09 -0.38 2.13 2.46 -1.22 -5.03 115.29 113.52 2pfd s HIS 78 Ca 0.52 0.03 0.04 0.00 0.47 0.00 0.00 55.06 56.12 2pfd s HIS 78 Cb 0.41 -1.84 0.18 0.00 -0.13 0.00 0.00 32.58 31.21 2pfd s HIS 78 CO 0.14 0.29 0.72 0.15 -2.47 0.00 0.00 174.74 173.56 2pfd s LYS 79 N -0.46 0.66 0.25 2.88 1.02 -1.26 -5.13 119.74 117.69 2pfd s LYS 79 Ca 0.08 -0.13 0.06 0.00 0.02 0.00 0.00 55.97 56.00 2pfd s LYS 79 Cb -0.12 0.10 -0.03 0.00 -0.52 0.00 0.00 37.83 37.26 2pfd s LYS 79 CO 0.02 -0.98 0.26 0.20 -0.92 0.00 0.00 175.35 173.93 2pfd s GLY 80 N 2.00 1.34 -0.09 -3.33 0.00 -1.26 -4.98 107.32 101.00 2pfd s GLY 80 Ca 0.15 -1.35 -0.00 0.00 0.00 0.00 0.00 44.72 43.52 2pfd s GLY 80 CO -0.11 -1.38 1.96 1.18 0.00 0.00 0.00 173.10 174.75 2pfd n GLU 81 N -1.27 1.22 -3.71 2.90 1.02 -0.84 -4.70 120.64 115.26 2pfd n GLU 81 Ca -0.08 -0.43 -0.15 0.00 -0.02 0.00 0.00 57.16 56.48 2pfd n GLU 81 Cb 0.58 -1.17 -0.15 0.00 -0.02 0.00 0.00 31.44 30.68 2pfd n GLU 81 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2pfd s HIS 82 N -0.50 -0.15 0.00 -0.32 2.46 -1.23 -4.67 115.29 110.87 2pfd s HIS 82 Ca 0.08 0.51 -0.05 0.00 0.47 0.00 0.00 55.06 56.08 2pfd s HIS 82 Cb 0.07 -0.19 -0.06 0.00 -0.13 0.00 0.00 32.58 32.27 2pfd s HIS 82 CO -0.00 -0.21 0.56 -2.30 -2.47 0.00 0.00 174.74 170.32 2pfd n PRO 83 N 4.75 0.00 -0.11 2.88 -0.02 -1.26 -5.03 135.00 136.21 2pfd n PRO 83 Ca -0.16 -0.23 -0.04 0.00 -2.02 0.00 0.00 63.50 61.05 2pfd n PRO 83 Cb 0.51 -1.39 0.03 0.00 -0.02 0.00 0.00 33.50 32.63 2pfd n PRO 83 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2pfd n ARG 84 N 4.05 -1.55 0.00 -0.52 0.00 -1.26 -4.85 116.66 112.53 2pfd n ARG 84 Ca 0.07 -0.21 0.00 0.00 -0.00 0.00 0.00 57.85 57.71 2pfd n ARG 84 Cb 0.14 -0.22 0.00 0.00 -0.00 0.00 0.00 32.46 32.39 2pfd n ARG 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2pfd n GLY 86 N 0.99 0.00 0.10 2.89 0.00 -0.89 -4.02 105.19 104.26 2pfd n GLY 86 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 2pfd n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pfd h ALA 87 N -0.05 0.65 -3.60 4.61 0.00 -1.84 -3.39 119.26 115.63 2pfd h ALA 87 Ca 0.00 -0.85 -0.65 0.00 0.00 0.00 0.00 54.91 53.41 2pfd h ALA 87 Cb 0.00 0.23 -0.40 0.00 0.00 0.00 0.00 17.79 17.61 2pfd h ALA 87 CO 0.00 0.95 -0.71 -1.17 0.00 0.00 0.00 179.25 178.33 2pfd s LEU 88 N -5.96 4.52 0.00 0.00 0.20 -1.26 0.12 118.68 116.30 2pfd s LEU 88 Ca -0.02 -2.26 0.00 0.00 0.69 0.00 0.00 54.13 52.54 2pfd s LEU 88 Cb 0.08 -1.58 0.00 0.00 -0.43 0.00 0.00 46.19 44.27 2pfd s LEU 88 CO 0.80 -0.36 0.00 0.47 -0.29 0.00 0.00 176.35 176.97 2pfd n ASP 89 N 4.10 0.00 -4.70 3.68 8.00 -0.14 -4.18 116.55 123.31 2pfd n ASP 89 Ca 0.04 0.00 -0.44 0.00 0.71 0.00 0.00 54.79 55.10 2pfd n ASP 89 Cb 0.40 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.48 2pfd n ASP 89 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2pfd n VAL 90 N 0.00 1.00 -3.67 2.53 0.24 -1.26 -3.33 118.33 113.83 2pfd n VAL 90 Ca 0.00 -0.25 -0.29 0.00 -2.04 0.00 0.00 64.34 61.76 2pfd n VAL 90 Cb 0.00 -1.66 -0.13 0.00 -1.47 0.00 0.00 33.84 30.58 2pfd n VAL 90 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2pfd s PRO 92 N 0.55 3.31 -0.19 0.00 0.04 -1.26 -3.06 135.00 134.40 2pfd s PRO 92 Ca 0.17 -0.39 -0.03 0.00 0.04 0.00 0.00 61.00 60.79 2pfd s PRO 92 Cb -0.24 -2.61 0.06 0.00 0.04 0.00 0.00 34.50 31.75 2pfd s PRO 92 CO -0.01 -0.03 0.04 -0.06 0.04 0.00 0.00 177.00 176.98 2pfd s PHE 93 N -2.43 0.96 0.11 0.56 0.40 0.17 -2.88 117.98 114.88 2pfd s PHE 93 Ca 0.44 -0.79 0.08 0.00 -0.60 0.00 0.00 56.93 56.06 2pfd s PHE 93 Cb -0.10 -1.00 -0.04 0.00 0.51 0.00 0.00 43.02 42.40 2pfd s PHE 93 CO 0.37 -0.59 -0.16 0.96 0.70 0.00 0.00 175.22 176.50 2pfd s ILE 94 N 1.88 2.97 0.57 0.64 -0.00 0.05 -4.05 121.20 123.26 2pfd s ILE 94 Ca -0.01 -1.44 -0.16 0.00 -0.00 0.00 0.00 60.65 59.04 2pfd s ILE 94 Cb -0.17 -2.37 -0.05 0.00 -0.00 0.00 0.00 42.46 39.88 2pfd s ILE 94 CO -0.08 0.11 1.04 -2.16 -0.00 0.00 0.00 174.94 173.85 2pfd s PRO 95 N -2.15 3.46 0.05 0.37 0.04 -1.26 -0.37 135.00 135.14 2pfd s PRO 95 Ca 0.19 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.41 2pfd s PRO 95 Cb -0.11 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2pfd s PRO 95 CO 0.11 -0.69 0.00 0.28 0.04 0.00 0.00 177.00 176.74 2pfd n VAL 96 N -1.86 0.22 -3.76 -0.36 0.31 -0.10 -4.68 118.33 108.10 2pfd n VAL 96 Ca 0.08 0.07 -0.13 0.00 -0.01 0.00 0.00 64.34 64.36 2pfd n VAL 96 Cb 0.53 -1.13 -0.10 0.00 -0.91 0.00 0.00 33.84 32.23 2pfd n VAL 96 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2pfd s ARG 97 N -2.00 0.51 0.00 5.55 1.70 -1.10 -4.96 118.95 118.65 2pfd s ARG 97 Ca 0.00 0.19 0.00 0.00 -0.47 0.00 0.00 55.73 55.45 2pfd s ARG 97 Cb 0.00 0.24 0.00 0.00 -0.57 0.00 0.00 34.95 34.62 2pfd s ARG 97 CO 0.00 -0.10 0.00 0.41 -1.08 0.00 0.00 175.30 174.53 2pfd n GLY 98 N 2.22 1.39 3.71 3.88 0.00 -1.26 -1.80 105.19 113.33 2pfd n GLY 98 Ca -0.17 -0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2pfd n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pfd s VAL 99 N 0.00 3.94 0.00 1.61 0.11 -1.26 -5.00 120.40 119.79 2pfd s VAL 99 Ca 0.00 1.40 0.00 0.00 -2.93 0.00 0.00 61.98 60.45 2pfd s VAL 99 Cb 0.00 -3.90 0.00 0.00 -1.53 0.00 0.00 36.38 30.95 2pfd s VAL 99 CO 0.00 0.12 0.00 -0.24 -3.33 0.00 0.00 175.10 171.65 2pfd n SER 100 N 3.83 0.00 0.00 3.54 2.88 -1.26 -4.62 113.62 117.99 2pfd n SER 100 Ca 0.09 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 2pfd n SER 100 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 2pfd n SER 100 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 2pfd n ASP 102 N 0.00 0.00 0.07 -3.46 8.00 -1.26 -2.36 116.55 117.54 2pfd n ASP 102 Ca 0.00 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.37 2pfd n ASP 102 Cb 0.00 0.00 -0.09 0.00 -0.02 0.00 0.00 41.12 41.01 2pfd n ASP 102 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2pfd h GLU 103 N 0.00 -0.20 -0.71 -1.24 5.08 -1.99 -2.83 114.58 112.68 2pfd h GLU 103 Ca 0.00 0.01 0.17 0.00 -1.00 0.00 0.00 59.36 58.54 2pfd h GLU 103 Cb 0.00 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.25 2pfd h GLU 103 CO 0.00 0.17 0.49 0.00 -1.00 0.00 0.00 179.01 178.67 2pfd h VAL 105 N 0.23 1.26 0.00 0.00 2.07 -1.84 -2.67 116.25 115.29 2pfd h VAL 105 Ca 0.35 -1.15 -0.13 0.00 0.82 0.00 0.00 66.70 66.59 2pfd h VAL 105 Cb 1.04 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.76 2pfd h VAL 105 CO -0.07 0.40 -0.62 -0.07 0.02 0.00 0.00 177.57 177.23 2pfd h LEU 106 N 0.77 0.00 -0.53 2.57 -0.00 0.48 -2.52 115.31 116.08 2pfd h LEU 106 Ca 0.13 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.93 2pfd h LEU 106 Cb 0.57 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.21 2pfd h LEU 106 CO 0.03 0.62 0.00 0.00 -0.00 0.00 0.00 178.44 179.10 2pfd h ALA 108 N 0.95 1.45 -0.43 0.00 0.00 -1.39 -0.71 119.26 119.13 2pfd h ALA 108 Ca 0.15 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2pfd h ALA 108 Cb 0.52 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2pfd h ALA 108 CO 0.03 0.50 0.06 0.87 0.00 0.00 0.00 179.25 180.71 2pfd h LYS 109 N 1.07 0.66 0.33 0.00 1.79 -0.99 -2.18 116.57 117.25 2pfd h LYS 109 Ca 0.30 -0.14 -0.02 0.00 -2.18 0.00 0.00 60.65 58.62 2pfd h LYS 109 Cb -0.08 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.47 2pfd h LYS 109 CO -0.07 0.64 -0.16 0.00 -1.08 0.00 0.00 179.45 178.78 2pfd h ALA 110 N 1.43 -0.47 -0.41 3.86 0.00 -0.43 -2.97 119.26 120.26 2pfd h ALA 110 Ca 0.14 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.04 2pfd h ALA 110 Cb 0.31 0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.18 2pfd h ALA 110 CO 0.00 -0.44 -0.16 0.35 0.00 0.00 0.00 179.25 179.01 2pfd h PHE 111 N -1.03 -0.37 -0.64 0.00 3.57 -1.23 -1.71 116.94 115.53 2pfd h PHE 111 Ca -0.05 0.04 0.12 0.00 3.53 0.00 0.00 57.97 61.62 2pfd h PHE 111 Cb 0.34 0.23 -0.09 0.00 2.79 0.00 0.00 35.95 39.22 2pfd h PHE 111 CO 0.01 -0.24 0.16 0.78 -2.23 0.00 0.00 178.31 176.80 2pfd h GLY 112 N -0.07 0.86 0.00 2.40 0.00 -1.51 -0.39 103.07 104.36 2pfd h GLY 112 Ca 0.20 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.48 2pfd h GLY 112 CO -0.46 -0.11 0.00 -0.18 0.00 0.00 0.00 176.54 175.78 2pfd n GLN 113 N -5.10 0.00 0.14 4.80 7.27 -0.96 -3.12 117.38 120.40 2pfd n GLN 113 Ca 0.10 0.37 0.17 0.00 0.07 0.00 0.00 57.00 57.71 2pfd n GLN 113 Cb 0.35 -1.18 0.54 0.00 2.41 0.00 0.00 30.24 32.36 2pfd n GLN 113 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2pfd h ARG 114 N 0.00 0.00 0.00 3.69 3.08 -1.33 -2.55 114.38 117.28 2pfd h ARG 114 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2pfd h ARG 114 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 2pfd h ARG 114 CO 0.00 0.00 -0.00 1.25 -1.07 0.00 0.00 179.97 180.15 2pfd h LEU 115 N 0.00 0.00 -2.26 3.04 5.85 -1.14 -2.63 115.31 118.17 2pfd h LEU 115 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2pfd h LEU 115 Cb 1.58 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.61 2pfd h LEU 115 CO -0.00 0.33 0.20 0.00 -0.34 0.00 0.00 178.44 178.62 2pfd h ALA 116 N -1.35 1.19 0.07 1.25 0.00 -1.45 -1.17 119.26 117.80 2pfd h ALA 116 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2pfd h ALA 116 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2pfd h ALA 116 CO 0.00 -0.19 -0.03 0.93 0.00 0.00 0.00 179.25 179.96 2pfd h GLU 117 N 0.00 -0.09 0.00 0.00 4.39 -1.58 -1.30 114.58 116.00 2pfd h GLU 117 Ca 0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2pfd h GLU 117 Cb 0.39 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.06 2pfd h GLU 117 CO 0.00 0.28 0.00 0.39 -1.16 0.00 0.00 179.01 178.52 2pfd n GLU 118 N -4.80 0.33 0.00 2.33 1.02 -0.70 -3.82 120.64 115.01 2pfd n GLU 118 Ca -0.05 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 2pfd n GLU 118 Cb 0.20 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 2pfd n GLU 118 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2pfd n LEU 119 N -1.24 0.96 -1.53 -4.62 4.77 -0.53 -5.07 117.00 109.74 2pfd n LEU 119 Ca 0.10 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2pfd n LEU 119 Cb 0.14 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2pfd n LEU 119 CO 0.14 0.16 0.00 -3.20 -1.33 0.00 0.00 177.39 173.16 2pfd n ASN 120 N -2.83 -2.13 -3.71 -1.43 2.85 -0.49 -5.08 115.26 102.44 2pfd n ASN 120 Ca 0.00 0.01 -0.13 0.00 -0.11 0.00 0.00 54.58 54.35 2pfd n ASN 120 Cb 0.50 -1.09 -0.07 0.00 1.24 0.00 0.00 39.78 40.35 2pfd n ASN 120 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 2pfd s VAL 121 N -1.30 0.06 -0.11 3.44 -7.23 -1.24 -4.90 120.40 109.11 2pfd s VAL 121 Ca 0.00 -0.50 -0.30 0.00 -1.81 0.00 0.00 61.98 59.38 2pfd s VAL 121 Cb -0.00 -0.84 -0.03 0.00 0.56 0.00 0.00 36.38 36.07 2pfd s VAL 121 CO 0.02 -0.28 1.33 -2.84 -0.31 0.00 0.00 175.10 173.02 2pfd s PRO 122 N -2.05 4.25 -0.07 4.82 0.02 -1.26 -4.26 135.00 136.44 2pfd s PRO 122 Ca -0.08 1.78 0.01 0.00 0.02 0.00 0.00 61.00 62.73 2pfd s PRO 122 Cb -0.02 -3.75 0.02 0.00 0.02 0.00 0.00 34.50 30.77 2pfd s PRO 122 CO 0.00 -0.68 -0.07 0.54 -0.33 0.00 0.00 177.00 176.46 2pfd s VAL 123 N 3.29 0.78 -0.09 3.83 0.11 -0.75 -1.37 120.40 126.21 2pfd s VAL 123 Ca 0.59 -0.23 0.03 0.00 -2.93 0.00 0.00 61.98 59.44 2pfd s VAL 123 Cb -0.25 -0.79 -0.02 0.00 -1.53 0.00 0.00 36.38 33.80 2pfd s VAL 123 CO 0.19 0.29 -0.16 -0.31 -3.33 0.00 0.00 175.10 171.78 2pfd s TYR 124 N 1.10 2.69 0.20 1.54 1.51 -1.08 0.06 117.35 123.37 2pfd s TYR 124 Ca -0.07 -0.51 -0.27 0.00 -1.01 0.00 0.00 57.07 55.20 2pfd s TYR 124 Cb -0.14 -1.71 -0.08 0.00 -0.11 0.00 0.00 41.96 39.91 2pfd s TYR 124 CO -0.01 -0.08 0.84 -0.48 -1.11 0.00 0.00 175.55 174.71 2pfd s LEU 125 N -0.13 4.61 0.46 -1.29 2.34 -1.26 -2.92 118.68 120.49 2pfd s LEU 125 Ca -0.02 1.77 0.03 0.00 0.06 0.00 0.00 54.13 55.97 2pfd s LEU 125 Cb -0.14 -3.44 -0.04 0.00 -0.56 0.00 0.00 46.19 42.02 2pfd s LEU 125 CO 0.04 0.18 0.03 -0.72 -1.06 0.00 0.00 176.35 174.82 2pfd s TYR 126 N -1.18 2.03 0.00 3.48 1.13 0.15 -3.29 117.35 119.67 2pfd s TYR 126 Ca 0.38 -0.93 0.00 0.00 -1.41 0.00 0.00 57.07 55.11 2pfd s TYR 126 Cb -0.24 -1.56 0.00 0.00 -1.10 0.00 0.00 41.96 39.06 2pfd s TYR 126 CO 0.28 0.19 0.00 0.41 -2.51 0.00 0.00 175.55 173.93 2pfd n GLY 127 N -1.09 1.12 0.00 5.49 0.00 -1.20 -2.21 105.19 107.29 2pfd n GLY 127 Ca -0.12 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.19 2pfd n GLY 127 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2pfd n GLU 128 N 5.63 0.00 0.00 1.61 -0.58 0.60 -3.09 120.64 124.81 2pfd n GLU 128 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2pfd n GLU 128 Cb 0.00 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 2pfd n GLU 128 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2pfd n ALA 129 N -0.73 0.00 0.00 0.62 0.00 -0.94 -4.86 120.51 114.60 2pfd n ALA 129 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2pfd n ALA 129 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2pfd n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pfd n ALA 130 N -2.41 -0.44 -1.74 0.00 0.00 -1.18 -4.93 120.51 109.81 2pfd n ALA 130 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.08 2pfd n ALA 130 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 2pfd n ALA 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2pfd n GLN 131 N 0.00 3.90 -2.71 0.00 3.00 -1.26 -4.87 117.38 115.44 2pfd n GLN 131 Ca 0.00 -2.93 -0.05 0.00 -0.01 0.00 0.00 57.00 54.01 2pfd n GLN 131 Cb 0.00 -2.52 0.04 0.00 0.00 0.00 0.00 30.24 27.76 2pfd n GLN 131 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.06 174.76 2pfd n PRO 133 N 1.85 1.87 0.00 -1.09 -0.02 -1.26 -5.02 135.00 131.33 2pfd n PRO 133 Ca 0.61 -3.56 0.00 0.00 -2.02 0.00 0.00 63.50 58.53 2pfd n PRO 133 Cb 0.34 -1.63 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 2pfd n PRO 133 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2pfd n SER 134 N -0.50 0.02 -0.18 2.55 3.41 -1.26 -4.84 113.62 112.82 2pfd n SER 134 Ca 0.12 -0.09 0.06 0.00 -0.26 0.00 0.00 58.87 58.71 2pfd n SER 134 Cb 0.82 0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 64.92 2pfd n SER 134 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2pfd n ARG 135 N -0.18 2.34 0.15 4.33 1.74 -1.26 -4.46 116.66 119.32 2pfd n ARG 135 Ca 0.00 -0.43 0.02 0.00 -0.77 0.00 0.00 57.85 56.67 2pfd n ARG 135 Cb 0.00 -1.13 0.38 0.00 -1.02 0.00 0.00 32.46 30.69 2pfd n ARG 135 CO 0.00 0.00 0.00 -0.56 -1.52 0.00 0.00 177.63 175.55 2pfd h GLN 136 N 0.87 0.14 -6.25 5.56 3.07 -1.88 -3.30 115.11 113.32 2pfd h GLN 136 Ca 0.00 -0.04 -0.57 0.00 0.09 0.00 0.00 58.65 58.13 2pfd h GLN 136 Cb 0.37 -0.01 -0.06 0.00 0.08 0.00 0.00 27.48 27.86 2pfd h GLN 136 CO 0.00 0.38 0.85 -0.08 0.09 0.00 0.00 178.83 180.06 2pfd s THR 137 N -4.49 4.52 0.10 1.86 -1.32 -1.26 -3.22 115.64 111.83 2pfd s THR 137 Ca -0.04 1.77 -0.19 0.00 -1.21 0.00 0.00 61.69 62.02 2pfd s THR 137 Cb 0.15 -4.36 -0.07 0.00 -1.51 0.00 0.00 72.50 66.71 2pfd s THR 137 CO 0.73 -0.39 1.63 0.25 -2.21 0.00 0.00 174.62 174.63 2pfd h LEU 138 N 9.97 0.35 -2.37 9.08 5.85 -1.95 -3.07 115.31 133.19 2pfd h LEU 138 Ca -0.21 -0.18 0.03 0.00 0.84 0.00 0.00 57.88 58.36 2pfd h LEU 138 Cb 1.06 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.00 2pfd h LEU 138 CO 1.02 0.44 0.11 1.55 -0.34 0.00 0.00 178.44 181.21 2pfd h PRO 139 N 0.25 0.00 -0.38 5.25 0.13 -1.95 -2.16 132.00 133.14 2pfd h PRO 139 Ca 0.08 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.11 2pfd h PRO 139 Cb 0.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.32 2pfd h PRO 139 CO -0.01 0.00 -0.16 0.00 -0.23 0.00 0.00 178.00 177.61 2pfd h ALA 140 N 1.87 0.53 -0.44 -0.56 0.00 -1.88 -3.23 119.26 115.54 2pfd h ALA 140 Ca 0.04 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.55 2pfd h ALA 140 Cb 0.25 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2pfd h ALA 140 CO -0.00 0.45 0.05 0.82 0.00 0.00 0.00 179.25 180.57 2pfd h ILE 141 N 0.58 1.25 0.00 0.00 2.04 -1.45 -3.29 117.51 116.63 2pfd h ILE 141 Ca 0.09 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 65.01 2pfd h ILE 141 Cb 0.70 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 2pfd h ILE 141 CO 0.05 0.33 0.52 0.54 0.00 0.00 0.00 178.15 179.59 2pfd n ARG 142 N -4.45 0.00 -0.01 2.37 1.74 -1.03 -4.76 116.66 110.52 2pfd n ARG 142 Ca 0.00 -0.14 0.00 0.00 -0.77 0.00 0.00 57.85 56.94 2pfd n ARG 142 Cb 0.26 -1.44 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 2pfd n ARG 142 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2pfd n ALA 143 N 3.28 0.95 -1.77 7.54 0.00 -1.24 -2.57 120.51 126.71 2pfd n ALA 143 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2pfd n ALA 143 Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.17 2pfd n ALA 143 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pfd n GLY 144 N 3.52 0.84 7.00 0.00 0.00 -1.26 -4.81 105.19 110.49 2pfd n GLY 144 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2pfd n GLY 144 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2pfd n GLU 145 N -0.70 0.00 -0.33 1.61 0.28 -1.06 -4.29 120.64 116.15 2pfd n GLU 145 Ca 0.00 0.00 -0.09 0.00 -0.16 0.00 0.00 57.16 56.91 2pfd n GLU 145 Cb 0.39 0.00 -0.08 0.00 1.43 0.00 0.00 31.44 33.19 2pfd n GLU 145 CO 0.00 0.00 0.00 0.98 -0.16 0.00 0.00 177.13 177.95 2pfd n TYR 146 N 0.29 -0.34 -2.40 -1.84 9.36 -1.26 -3.11 117.16 117.86 2pfd n TYR 146 Ca 0.00 0.97 -0.37 0.00 3.32 0.00 0.00 57.90 61.82 2pfd n TYR 146 Cb 0.00 -0.56 -0.03 0.00 -0.63 0.00 0.00 39.34 38.12 2pfd n TYR 146 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 2pfd s GLU 147 N -5.23 3.36 0.28 2.98 8.01 -1.26 -4.09 118.70 122.74 2pfd s GLU 147 Ca -0.09 -1.24 0.00 0.00 0.01 0.00 0.00 54.97 53.65 2pfd s GLU 147 Cb 0.09 -5.34 0.00 0.00 -4.31 0.00 0.00 34.13 24.56 2pfd s GLU 147 CO 0.48 -2.70 0.00 0.00 0.01 0.00 0.00 175.26 173.06 2pfd n ALA 148 N 10.47 1.88 -0.21 5.21 0.00 -1.18 -4.87 120.51 131.80 2pfd n ALA 148 Ca 0.41 0.00 0.31 0.00 0.00 0.00 0.00 53.44 54.16 2pfd n ALA 148 Cb 0.48 0.00 0.65 0.00 0.00 0.00 0.00 19.45 20.58 2pfd n ALA 148 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2pfd h LEU 149 N 0.00 0.00 0.00 0.00 3.38 -1.83 0.43 115.31 117.29 2pfd h LEU 149 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pfd h LEU 149 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2pfd h LEU 149 CO 0.00 0.00 0.00 -0.81 0.09 0.00 0.00 178.44 177.72 2pfd n PRO 150 N -3.67 0.19 0.00 1.13 -0.04 -1.26 -3.66 135.00 127.69 2pfd n PRO 150 Ca 0.22 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 2pfd n PRO 150 Cb 1.27 -1.23 0.00 0.00 -0.04 0.00 0.00 33.50 33.50 2pfd n PRO 150 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2pfd n GLU 151 N -0.73 0.13 0.10 0.54 0.28 0.81 -5.00 120.64 116.78 2pfd n GLU 151 Ca 0.02 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 57.09 2pfd n GLU 151 Cb 0.01 -0.14 0.00 0.00 1.43 0.00 0.00 31.44 32.74 2pfd n GLU 151 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 2pfd h LYS 152 N 0.00 0.00 -0.66 3.44 1.57 -0.40 -3.23 116.57 117.29 2pfd h LYS 152 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2pfd h LYS 152 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2pfd h LYS 152 CO 0.00 0.17 0.00 1.47 -0.57 0.00 0.00 179.45 180.52 2pfd n LEU 153 N -2.90 1.75 -2.97 2.94 -0.00 -1.25 -3.50 117.00 111.07 2pfd n LEU 153 Ca -0.02 -0.88 -0.17 0.00 -0.00 0.00 0.00 56.01 54.94 2pfd n LEU 153 Cb 0.67 -0.40 -0.01 0.00 -0.00 0.00 0.00 43.42 43.68 2pfd n LEU 153 CO 0.40 0.31 -0.13 1.17 -0.00 0.00 0.00 177.39 179.13 2pfd n LYS 154 N 0.11 1.40 -3.68 1.47 4.81 -1.22 -4.63 118.16 116.42 2pfd n LYS 154 Ca 0.06 -3.57 -0.17 0.00 -0.87 0.00 0.00 58.31 53.77 2pfd n LYS 154 Cb 0.37 -1.66 -0.16 0.00 0.02 0.00 0.00 35.03 33.60 2pfd n LYS 154 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2pfd s GLN 155 N -2.80 0.02 0.58 1.64 -0.21 -1.23 -5.00 119.66 112.66 2pfd s GLN 155 Ca 0.38 0.50 0.35 0.00 0.02 0.00 0.00 55.36 56.61 2pfd s GLN 155 Cb 0.38 -0.30 1.34 0.00 1.00 0.00 0.00 33.01 35.42 2pfd s GLN 155 CO -0.06 -0.29 1.55 0.00 -2.12 0.00 0.00 175.29 174.36 2pfd h ALA 156 N 8.24 3.14 0.40 6.09 0.00 -1.97 0.50 119.26 135.66 2pfd h ALA 156 Ca -0.17 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2pfd h ALA 156 Cb 1.12 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2pfd h ALA 156 CO 0.18 -1.75 -0.19 1.49 0.00 0.00 0.00 179.25 178.97 2pfd h GLU 157 N 0.00 -0.52 -0.96 0.00 4.81 -1.94 -3.35 114.58 112.61 2pfd h GLU 157 Ca 0.59 0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.76 2pfd h GLU 157 Cb 2.81 0.12 -0.06 0.00 0.63 0.00 0.00 28.75 32.25 2pfd h GLU 157 CO -0.01 -0.35 0.12 0.91 -0.73 0.00 0.00 179.01 178.96 2pfd n TRP 158 N -4.48 0.78 -1.68 0.92 7.02 0.16 -4.93 117.44 115.23 2pfd n TRP 158 Ca -0.07 -0.64 -0.48 0.00 -1.02 0.00 0.00 57.50 55.29 2pfd n TRP 158 Cb 0.21 -0.37 -0.05 0.00 -2.42 0.00 0.00 31.31 28.69 2pfd n TRP 158 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 2pfd n VAL 159 N 0.08 0.36 -1.90 -0.99 0.31 -0.64 -4.75 118.33 110.81 2pfd n VAL 159 Ca 0.14 -0.07 -0.40 0.00 -0.01 0.00 0.00 64.34 64.00 2pfd n VAL 159 Cb 0.72 -1.71 0.01 0.00 -0.91 0.00 0.00 33.84 31.95 2pfd n VAL 159 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2pfd s PRO 160 N 2.91 3.86 0.50 5.55 0.02 -1.26 -4.92 135.00 141.66 2pfd s PRO 160 Ca 0.88 2.34 0.29 0.00 0.02 0.00 0.00 61.00 64.53 2pfd s PRO 160 Cb -0.71 -2.74 1.15 0.00 0.02 0.00 0.00 34.50 32.21 2pfd s PRO 160 CO 0.48 -0.65 1.91 -0.44 -0.33 0.00 0.00 177.00 177.97 2pfd h ASP 161 N 2.57 0.00 -5.15 2.53 5.19 -1.90 -3.44 116.42 116.22 2pfd h ASP 161 Ca -0.50 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 55.80 2pfd h ASP 161 Cb 1.25 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.61 2pfd h ASP 161 CO 0.62 0.09 -0.47 -0.36 -3.12 0.00 0.00 179.24 176.00 2pfd s PHE 162 N -3.65 0.23 0.07 4.55 0.40 0.11 -4.94 117.98 114.74 2pfd s PHE 162 Ca 0.01 -0.64 0.00 0.00 -0.60 0.00 0.00 56.93 55.70 2pfd s PHE 162 Cb 0.09 -0.15 0.00 0.00 0.51 0.00 0.00 43.02 43.48 2pfd s PHE 162 CO 0.59 -0.46 0.00 0.41 0.70 0.00 0.00 175.22 176.46 2pfd n GLY 163 N 0.24 -3.36 0.00 4.36 0.00 -1.26 -1.82 105.19 103.35 2pfd n GLY 163 Ca -0.16 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.84 2pfd n GLY 163 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2pfd n PRO 164 N -0.73 0.00 -0.03 1.61 -0.02 -1.26 -4.64 135.00 129.93 2pfd n PRO 164 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2pfd n PRO 164 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2pfd n PRO 164 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2pfd n SER 165 N 0.00 0.00 -4.85 2.55 7.64 -1.26 -4.71 113.62 112.99 2pfd n SER 165 Ca 0.00 -0.48 -0.31 0.00 1.01 0.00 0.00 58.87 59.09 2pfd n SER 165 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2pfd n SER 165 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2pfd s SER 166 N 0.00 6.23 -0.12 6.43 0.15 -1.26 -4.61 113.70 120.52 2pfd s SER 166 Ca 0.00 1.51 0.00 0.00 0.70 0.00 0.00 55.95 58.16 2pfd s SER 166 Cb 0.00 -2.49 -0.02 0.00 -1.71 0.00 0.00 66.02 61.80 2pfd s SER 166 CO 0.00 -0.87 -0.13 0.12 1.20 0.00 0.00 173.24 173.57 2pfd s PHE 167 N -2.95 2.81 -0.07 3.44 2.19 -1.26 -4.37 117.98 117.77 2pfd s PHE 167 Ca 0.57 -0.55 0.02 0.00 0.33 0.00 0.00 56.93 57.30 2pfd s PHE 167 Cb -0.11 -1.82 -0.02 0.00 -1.31 0.00 0.00 43.02 39.75 2pfd s PHE 167 CO 0.46 -0.14 -0.12 0.08 1.83 0.00 0.00 175.22 177.33 2pfd s VAL 168 N 0.20 3.23 0.13 3.12 1.01 -1.26 -5.05 120.40 121.78 2pfd s VAL 168 Ca -0.07 -0.65 -0.19 0.00 0.00 0.00 0.00 61.98 61.07 2pfd s VAL 168 Cb -0.15 -2.30 -0.02 0.00 0.00 0.00 0.00 36.38 33.91 2pfd s VAL 168 CO 0.05 0.58 1.72 1.55 0.00 0.00 0.00 175.10 179.00 2pfd h PRO 169 N 5.62 0.08 -0.63 2.72 0.13 -2.02 -3.15 132.00 134.76 2pfd h PRO 169 Ca -0.42 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2pfd h PRO 169 Cb 1.17 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2pfd h PRO 169 CO 0.52 0.05 0.00 -1.13 -0.23 0.00 0.00 178.00 177.22 2pfd n SER 170 N -5.13 3.98 -4.21 1.44 3.41 -1.26 -3.96 113.62 107.88 2pfd n SER 170 Ca -0.02 -2.36 -0.12 0.00 -0.26 0.00 0.00 58.87 56.12 2pfd n SER 170 Cb 0.12 -0.52 -0.10 0.00 -0.26 0.00 0.00 64.21 63.45 2pfd n SER 170 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2pfd s TRP 171 N -1.78 1.10 -0.31 7.33 -0.11 -1.19 -4.34 118.94 119.64 2pfd s TRP 171 Ca 0.42 -1.09 0.17 0.00 1.22 0.00 0.00 56.10 56.82 2pfd s TRP 171 Cb 0.27 -0.63 0.46 0.00 -1.50 0.00 0.00 33.47 32.07 2pfd s TRP 171 CO 0.20 -0.31 1.23 0.41 -4.62 0.00 0.00 176.95 173.86 2pfd n GLY 172 N -0.20 1.74 0.67 5.86 0.00 -1.26 -4.47 105.19 107.53 2pfd n GLY 172 Ca -0.06 -0.73 0.08 0.00 0.00 0.00 0.00 46.02 45.31 2pfd n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pfd n ALA 173 N -0.75 -1.76 -3.22 4.61 0.00 -1.26 -2.10 120.51 116.03 2pfd n ALA 173 Ca -0.01 0.41 -0.13 0.00 0.00 0.00 0.00 53.44 53.72 2pfd n ALA 173 Cb 0.83 -0.72 -0.09 0.00 0.00 0.00 0.00 19.45 19.47 2pfd n ALA 173 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2pfd s THR 174 N -3.37 0.04 -0.22 0.00 2.01 -0.47 -3.52 115.64 110.11 2pfd s THR 174 Ca 0.00 -0.34 0.00 0.00 0.31 0.00 0.00 61.69 61.67 2pfd s THR 174 Cb 0.00 -0.55 0.06 0.00 0.01 0.00 0.00 72.50 72.01 2pfd s THR 174 CO 0.00 -0.18 -0.05 0.68 -0.69 0.00 0.00 174.62 174.37 2pfd s VAL 175 N -0.85 1.45 0.69 3.82 -7.23 -1.21 -2.64 120.40 114.44 2pfd s VAL 175 Ca -0.09 -1.12 -0.05 0.00 -1.81 0.00 0.00 61.98 58.92 2pfd s VAL 175 Cb -0.04 -1.71 0.07 0.00 0.56 0.00 0.00 36.38 35.26 2pfd s VAL 175 CO 0.03 -0.06 0.98 -0.89 -0.31 0.00 0.00 175.10 174.85 2pfd s THR 176 N 1.44 2.33 -3.96 5.32 2.01 -1.15 0.46 115.64 122.09 2pfd s THR 176 Ca -0.05 -0.39 0.00 0.00 0.31 0.00 0.00 61.69 61.57 2pfd s THR 176 Cb -0.18 -2.94 0.00 0.00 0.01 0.00 0.00 72.50 69.39 2pfd s THR 176 CO -0.07 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.47 2pfd n GLY 177 N -2.83 -2.07 2.93 4.40 0.00 -1.17 0.31 105.19 106.75 2pfd n GLY 177 Ca 0.09 -1.21 -0.13 0.00 0.00 0.00 0.00 46.02 44.77 2pfd n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pfd s ALA 178 N -1.59 -0.24 0.19 4.61 0.00 -1.23 -0.66 121.76 122.84 2pfd s ALA 178 Ca 0.00 0.54 0.02 0.00 0.00 0.00 0.00 51.96 52.51 2pfd s ALA 178 Cb 0.00 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.76 2pfd s ALA 178 CO 0.00 -0.12 0.06 2.89 0.00 0.00 0.00 175.76 178.59 2pfd n ARG 179 N 3.83 0.84 -2.18 0.00 1.85 -1.26 -0.30 116.66 119.45 2pfd n ARG 179 Ca -0.22 -1.61 -0.28 0.00 -1.00 0.00 0.00 57.85 54.73 2pfd n ARG 179 Cb 0.54 0.83 0.03 0.00 -1.05 0.00 0.00 32.46 32.80 2pfd n ARG 179 CO 0.00 0.00 0.00 0.21 -0.01 0.00 0.00 177.63 177.83 2pfd s LYS 180 N -2.74 3.07 0.23 2.89 2.47 -1.26 -4.58 119.74 119.82 2pfd s LYS 180 Ca 0.09 0.28 -0.30 0.00 -1.56 0.00 0.00 55.97 54.48 2pfd s LYS 180 Cb 0.00 -2.17 -0.09 0.00 -1.46 0.00 0.00 37.83 34.11 2pfd s LYS 180 CO 0.06 -0.74 1.31 0.12 0.16 0.00 0.00 175.35 176.26 2pfd s PHE 181 N -3.11 3.22 -0.11 4.03 2.19 -1.26 -4.99 117.98 117.94 2pfd s PHE 181 Ca 0.55 1.25 0.01 0.00 0.33 0.00 0.00 56.93 59.07 2pfd s PHE 181 Cb -0.11 -3.62 -0.01 0.00 -1.31 0.00 0.00 43.02 37.97 2pfd s PHE 181 CO 0.49 -1.88 -0.15 -1.17 1.83 0.00 0.00 175.22 174.33 2pfd s LEU 182 N -0.45 2.60 -0.10 6.12 2.96 -1.26 -4.41 118.68 124.14 2pfd s LEU 182 Ca 0.55 -0.35 -0.00 0.00 -0.22 0.00 0.00 54.13 54.11 2pfd s LEU 182 Cb -0.37 -1.56 -0.03 0.00 0.50 0.00 0.00 46.19 44.73 2pfd s LEU 182 CO 0.41 0.19 -0.07 -0.63 -1.32 0.00 0.00 176.35 174.93 2pfd s ILE 183 N 0.19 3.63 -0.35 6.68 1.01 -0.96 -4.99 121.20 126.42 2pfd s ILE 183 Ca -0.09 -0.49 -0.21 0.00 0.00 0.00 0.00 60.65 59.86 2pfd s ILE 183 Cb -0.15 -2.51 0.00 0.00 0.01 0.00 0.00 42.46 39.81 2pfd s ILE 183 CO 0.05 0.56 0.69 0.00 0.00 0.00 0.00 174.94 176.25 2pfd s ALA 184 N -0.39 3.46 -0.07 9.38 0.00 -1.26 -1.43 121.76 131.46 2pfd s ALA 184 Ca 0.06 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.29 2pfd s ALA 184 Cb -0.12 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.78 2pfd s ALA 184 CO 0.02 -1.35 -0.14 0.12 0.00 0.00 0.00 175.76 174.41 2pfd s PHE 185 N 2.83 1.60 0.01 0.00 5.36 -0.36 -1.02 117.98 126.39 2pfd s PHE 185 Ca 0.27 -0.58 0.06 0.00 -0.96 0.00 0.00 56.93 55.72 2pfd s PHE 185 Cb -0.14 -1.14 -0.03 0.00 -0.34 0.00 0.00 43.02 41.37 2pfd s PHE 185 CO 0.15 -0.28 -0.19 -0.80 -1.46 0.00 0.00 175.22 172.65 2pfd s ASN 186 N 0.56 3.73 -0.20 6.13 0.01 -0.57 0.78 114.94 125.38 2pfd s ASN 186 Ca -0.14 -0.38 -0.01 0.00 -0.71 0.00 0.00 52.86 51.62 2pfd s ASN 186 Cb -0.16 -0.62 0.01 0.00 0.41 0.00 0.00 41.25 40.89 2pfd s ASN 186 CO 0.04 0.29 -0.13 -0.63 -1.51 0.00 0.00 177.10 175.16 2pfd s ILE 187 N -0.83 2.62 -0.46 0.60 1.01 0.69 -2.38 121.20 122.45 2pfd s ILE 187 Ca 0.13 -0.75 -0.29 0.00 0.00 0.00 0.00 60.65 59.74 2pfd s ILE 187 Cb -0.10 -2.15 0.03 0.00 0.01 0.00 0.00 42.46 40.25 2pfd s ILE 187 CO 0.03 0.49 1.15 0.20 0.00 0.00 0.00 174.94 176.81 2pfd s ASN 188 N 1.36 6.63 -0.15 3.58 0.01 -0.57 -0.41 114.94 125.38 2pfd s ASN 188 Ca 0.05 0.52 -0.06 0.00 -0.71 0.00 0.00 52.86 52.67 2pfd s ASN 188 Cb -0.14 -2.55 -0.04 0.00 0.41 0.00 0.00 41.25 38.94 2pfd s ASN 188 CO -0.09 -1.25 0.04 -0.76 -1.51 0.00 0.00 177.10 173.54 2pfd s LEU 189 N 4.47 3.73 0.00 0.60 1.43 -1.16 0.15 118.68 127.91 2pfd s LEU 189 Ca 0.49 0.09 0.00 0.00 -1.03 0.00 0.00 54.13 53.68 2pfd s LEU 189 Cb -0.08 -1.92 0.00 0.00 0.03 0.00 0.00 46.19 44.23 2pfd s LEU 189 CO 0.31 0.23 0.68 0.18 0.23 0.00 0.00 176.35 177.98 2pfd n LEU 190 N 3.13 1.83 0.00 1.79 4.77 0.14 -2.98 117.00 125.68 2pfd n LEU 190 Ca -0.17 -0.92 0.00 0.00 -0.03 0.00 0.00 56.01 54.89 2pfd n LEU 190 Cb 0.53 -0.45 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2pfd n LEU 190 CO 0.33 0.34 0.00 -1.54 -1.33 0.00 0.00 177.39 175.19 2pfd n SER 191 N 0.32 0.00 -4.27 -1.43 3.41 -1.26 -4.84 113.62 105.54 2pfd n SER 191 Ca 0.00 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.40 2pfd n SER 191 Cb 0.34 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.17 2pfd n SER 191 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2pfd s THR 192 N 3.90 1.58 0.31 6.66 -1.32 -1.26 -4.54 115.64 120.96 2pfd s THR 192 Ca 0.00 -1.64 0.07 0.00 -1.21 0.00 0.00 61.69 58.91 2pfd s THR 192 Cb 0.00 -1.55 0.30 0.00 -1.51 0.00 0.00 72.50 69.74 2pfd s THR 192 CO 0.00 -0.22 1.77 0.50 -2.21 0.00 0.00 174.62 174.46 2pfd h LYS 193 N 3.78 0.72 0.20 7.08 3.64 -1.97 0.27 116.57 130.28 2pfd h LYS 193 Ca -0.43 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.90 2pfd h LYS 193 Cb 1.19 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 2pfd h LYS 193 CO 0.45 0.47 -0.09 0.93 -2.27 0.00 0.00 179.45 178.94 2pfd h GLU 194 N 0.74 -0.25 0.08 1.90 3.07 -1.97 -1.84 114.58 116.31 2pfd h GLU 194 Ca 0.59 0.02 0.02 0.00 -0.50 0.00 0.00 59.36 59.48 2pfd h GLU 194 Cb 0.95 0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.89 2pfd h GLU 194 CO -0.39 -0.02 -0.19 1.96 -1.40 0.00 0.00 179.01 178.97 2pfd h GLN 195 N -0.46 -0.33 -0.62 2.33 4.20 -1.62 -0.84 115.11 117.77 2pfd h GLN 195 Ca -0.03 0.02 0.13 0.00 0.06 0.00 0.00 58.65 58.83 2pfd h GLN 195 Cb 0.35 0.08 -0.10 0.00 0.30 0.00 0.00 27.48 28.11 2pfd h GLN 195 CO 0.04 -0.22 0.05 0.00 -0.67 0.00 0.00 178.83 178.04 2pfd h ALA 196 N 0.50 0.67 -0.52 3.87 0.00 -0.53 0.12 119.26 123.37 2pfd h ALA 196 Ca 0.03 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 2pfd h ALA 196 Cb 0.38 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2pfd h ALA 196 CO -0.12 -0.37 0.19 1.25 0.00 0.00 0.00 179.25 180.20 2pfd h HIS 197 N 0.17 0.76 0.19 0.00 -0.00 -0.98 -1.73 115.15 113.56 2pfd h HIS 197 Ca 0.33 -0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.65 2pfd h HIS 197 Cb 0.53 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.41 27.70 2pfd h HIS 197 CO -0.32 0.60 -0.17 -0.09 -0.00 0.00 0.00 177.93 177.95 2pfd h ARG 198 N 0.74 -0.34 -0.88 5.26 2.43 0.63 -1.66 114.38 120.57 2pfd h ARG 198 Ca 0.18 0.02 0.26 0.00 -0.81 0.00 0.00 59.98 59.63 2pfd h ARG 198 Cb 0.18 0.08 -0.16 0.00 -0.42 0.00 0.00 29.97 29.64 2pfd h ARG 198 CO -0.01 -0.22 0.08 -0.89 -1.51 0.00 0.00 179.97 177.41 2pfd n ILE 199 N -3.31 -0.37 -0.12 1.20 5.41 -0.32 0.01 119.36 121.86 2pfd n ILE 199 Ca -0.04 1.92 -0.07 0.00 1.00 0.00 0.00 62.75 65.56 2pfd n ILE 199 Cb 0.16 -2.84 0.10 0.00 -0.71 0.00 0.00 39.64 36.35 2pfd n ILE 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2pfd h ALA 200 N 1.76 0.95 0.00 -1.39 0.00 -1.05 -1.79 119.26 117.74 2pfd h ALA 200 Ca 0.56 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 2pfd h ALA 200 Cb 1.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2pfd h ALA 200 CO -0.81 0.62 -0.22 -0.07 0.00 0.00 0.00 179.25 178.77 2pfd h LEU 201 N 0.77 0.00 0.05 0.00 3.38 0.55 0.79 115.31 120.86 2pfd h LEU 201 Ca 0.13 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.85 2pfd h LEU 201 Cb 0.59 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2pfd h LEU 201 CO 0.04 0.22 -1.19 0.78 0.09 0.00 0.00 178.44 178.38 2pfd h ASN 202 N 0.00 0.17 0.06 -0.43 -0.26 -0.98 -3.34 115.58 110.81 2pfd h ASN 202 Ca -0.00 -0.20 -0.00 0.00 -0.56 0.00 0.00 56.30 55.54 2pfd h ASN 202 Cb 0.45 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.65 2pfd h ASN 202 CO 0.03 1.16 -0.03 -0.07 -1.06 0.00 0.00 177.43 177.46 2pfd h LEU 203 N 0.03 -0.07 -9.75 1.61 3.38 -1.00 0.10 115.31 109.62 2pfd h LEU 203 Ca -0.10 -0.27 -0.57 0.00 0.09 0.00 0.00 57.88 57.03 2pfd h LEU 203 Cb 1.88 0.02 0.15 0.00 0.09 0.00 0.00 40.66 42.80 2pfd h LEU 203 CO 0.15 0.54 0.09 -2.11 0.09 0.00 0.00 178.44 177.20 2pfd n ARG 204 N -4.80 1.02 0.12 1.13 1.85 0.24 -1.74 116.66 114.48 2pfd n ARG 204 Ca -0.04 0.38 -0.01 0.00 -1.00 0.00 0.00 57.85 57.18 2pfd n ARG 204 Cb 0.16 -2.09 0.24 0.00 -1.05 0.00 0.00 32.46 29.72 2pfd n ARG 204 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 2pfd h GLU 205 N 0.80 0.13 0.00 2.89 4.81 -1.03 -1.87 114.58 120.31 2pfd h GLU 205 Ca -0.47 -0.07 -0.05 0.00 -0.13 0.00 0.00 59.36 58.65 2pfd h GLU 205 Cb 1.36 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.73 2pfd h GLU 205 CO 0.52 0.57 -0.22 0.37 -0.73 0.00 0.00 179.01 179.52 2pfd h GLN 206 N 0.11 0.00 0.00 1.92 4.15 -1.89 -3.11 115.11 116.28 2pfd h GLN 206 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2pfd h GLN 206 Cb 0.85 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.54 2pfd h GLN 206 CO 0.07 0.22 0.00 0.41 -1.93 0.00 0.00 178.83 177.60 2pfd n GLY 207 N 0.42 -0.61 3.56 2.39 0.00 -0.82 -4.30 105.19 105.83 2pfd n GLY 207 Ca 0.01 -0.98 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 2pfd n GLY 207 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pfd s ARG 208 N 0.00 2.96 3.96 1.61 0.52 -1.18 -4.75 118.95 122.07 2pfd s ARG 208 Ca 0.00 -0.32 0.00 0.00 -0.52 0.00 0.00 55.73 54.89 2pfd s ARG 208 Cb 0.00 -4.86 0.00 0.00 0.52 0.00 0.00 34.95 30.61 2pfd s ARG 208 CO 0.00 -2.72 0.00 0.41 0.02 0.00 0.00 175.30 173.01 2pfd n GLY 209 N 6.39 0.48 0.00 -3.53 0.00 -1.26 -4.78 105.19 102.48 2pfd n GLY 209 Ca 0.28 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2pfd n GLY 209 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2pfd n LYS 210 N 8.27 0.00 -1.24 1.61 4.76 -1.26 -4.87 118.16 125.42 2pfd n LYS 210 Ca 0.00 0.00 -0.48 0.00 -2.87 0.00 0.00 58.31 54.96 2pfd n LYS 210 Cb 0.00 0.00 -0.07 0.00 -1.84 0.00 0.00 35.03 33.12 2pfd n LYS 210 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2pfd n ASP 211 N 0.00 0.83 -0.55 4.39 2.03 -1.26 -3.88 116.55 118.11 2pfd n ASP 211 Ca 0.00 0.85 0.00 0.00 0.52 0.00 0.00 54.79 56.16 2pfd n ASP 211 Cb 0.00 -0.63 0.00 0.00 -0.72 0.00 0.00 41.12 39.77 2pfd n ASP 211 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 2pfd n GLN 212 N 2.79 0.00 -0.58 -0.67 7.27 -1.26 -4.90 117.38 120.02 2pfd n GLN 212 Ca 0.22 0.18 -0.28 0.00 0.07 0.00 0.00 57.00 57.19 2pfd n GLN 212 Cb -0.04 -0.55 0.25 0.00 2.41 0.00 0.00 30.24 32.32 2pfd n GLN 212 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2pfd s PRO 213 N -1.70 -1.15 0.00 3.69 0.04 -1.25 -3.08 135.00 131.54 2pfd s PRO 213 Ca 0.00 0.68 0.00 0.00 0.04 0.00 0.00 61.00 61.72 2pfd s PRO 213 Cb 0.00 -1.54 0.00 0.00 0.04 0.00 0.00 34.50 33.00 2pfd s PRO 213 CO 0.00 -3.84 0.00 0.41 0.04 0.00 0.00 177.00 173.61 2pfd n GLY 214 N 0.68 -0.40 0.09 0.56 0.00 -0.77 -4.69 105.19 100.66 2pfd n GLY 214 Ca 0.04 -1.59 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 2pfd n GLY 214 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pfd n ARG 215 N 0.00 0.50 -2.36 1.61 1.74 0.36 -4.87 116.66 113.65 2pfd n ARG 215 Ca 0.00 0.40 -0.42 0.00 -0.77 0.00 0.00 57.85 57.06 2pfd n ARG 215 Cb 0.00 -1.60 -0.03 0.00 -1.02 0.00 0.00 32.46 29.82 2pfd n ARG 215 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2pfd s LEU 216 N -8.01 4.36 0.37 0.55 1.43 -0.91 -4.98 118.68 111.49 2pfd s LEU 216 Ca -0.23 2.08 -0.23 0.00 -1.03 0.00 0.00 54.13 54.72 2pfd s LEU 216 Cb 0.04 -3.58 -0.10 0.00 0.03 0.00 0.00 46.19 42.58 2pfd s LEU 216 CO 0.36 -0.53 0.92 -0.54 0.23 0.00 0.00 176.35 176.80 2pfd s LYS 217 N 1.19 4.36 -1.29 1.70 -0.14 -1.26 -3.50 119.74 120.79 2pfd s LYS 217 Ca 0.60 1.16 -0.00 0.00 -1.36 0.00 0.00 55.97 56.37 2pfd s LYS 217 Cb -0.31 -2.47 0.00 0.00 -1.68 0.00 0.00 37.83 33.37 2pfd s LYS 217 CO 0.29 0.12 0.01 1.63 -0.76 0.00 0.00 175.35 176.64 2pfd n LYS 218 N -0.08 -2.08 -4.30 1.68 4.76 -1.26 -4.36 118.16 112.52 2pfd n LYS 218 Ca 0.04 0.73 -0.33 0.00 -2.87 0.00 0.00 58.31 55.89 2pfd n LYS 218 Cb 0.52 -5.36 -0.16 0.00 -1.84 0.00 0.00 35.03 28.20 2pfd n LYS 218 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2pfd s VAL 219 N -2.76 2.17 0.09 -0.18 1.01 -1.25 -0.42 120.40 119.06 2pfd s VAL 219 Ca 0.00 -0.92 0.10 0.00 0.00 0.00 0.00 61.98 61.16 2pfd s VAL 219 Cb -0.00 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2pfd s VAL 219 CO 0.01 0.53 -0.25 -1.58 0.00 0.00 0.00 175.10 173.81 2pfd s GLN 220 N 1.13 1.51 0.00 2.72 0.74 -0.73 -0.86 119.66 124.18 2pfd s GLN 220 Ca 0.01 -1.20 0.00 0.00 0.05 0.00 0.00 55.36 54.22 2pfd s GLN 220 Cb -0.14 -1.83 0.00 0.00 1.10 0.00 0.00 33.01 32.14 2pfd s GLN 220 CO -0.08 0.45 0.00 0.41 -0.55 0.00 0.00 175.29 175.52 2pfd n GLY 221 N 1.35 -0.59 1.59 2.59 0.00 -1.26 0.21 105.19 109.08 2pfd n GLY 221 Ca -0.18 -1.12 -0.08 0.00 0.00 0.00 0.00 46.02 44.65 2pfd n GLY 221 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2pfd n ILE 222 N -0.47 0.00 -3.63 -0.61 -5.35 0.21 -4.76 119.36 104.75 2pfd n ILE 222 Ca 0.00 -0.95 -0.36 0.00 -0.27 0.00 0.00 62.75 61.16 2pfd n ILE 222 Cb 0.00 0.54 -0.06 0.00 -1.74 0.00 0.00 39.64 38.39 2pfd n ILE 222 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2pfd s GLY 223 N -2.07 2.35 0.20 3.28 0.00 -1.26 0.31 107.32 110.13 2pfd s GLY 223 Ca 0.16 -0.40 -0.14 0.00 0.00 0.00 0.00 44.72 44.33 2pfd s GLY 223 CO 0.11 -0.13 0.46 0.86 0.00 0.00 0.00 173.10 174.40 2pfd s TRP 224 N -1.22 0.11 -0.15 1.90 -0.00 0.75 -4.79 118.94 115.55 2pfd s TRP 224 Ca 0.26 -0.47 -0.04 0.00 -0.00 0.00 0.00 56.10 55.86 2pfd s TRP 224 Cb -0.14 0.25 0.07 0.00 -0.00 0.00 0.00 33.47 33.64 2pfd s TRP 224 CO 0.14 -0.89 0.22 -0.47 -0.00 0.00 0.00 176.95 175.94 2pfd s TYR 225 N -3.93 -0.29 -0.13 5.86 6.04 -1.26 0.27 117.35 123.90 2pfd s TYR 225 Ca 0.14 0.56 -0.29 0.00 0.04 0.00 0.00 57.07 57.52 2pfd s TYR 225 Cb -0.00 -0.23 -0.03 0.00 -1.04 0.00 0.00 41.96 40.66 2pfd s TYR 225 CO 0.01 -0.43 1.42 -0.51 -1.54 0.00 0.00 175.55 174.49 2pfd s LEU 226 N 2.35 4.21 0.01 6.97 1.43 0.43 -4.94 118.68 129.14 2pfd s LEU 226 Ca 0.04 1.87 -0.25 0.00 -1.03 0.00 0.00 54.13 54.76 2pfd s LEU 226 Cb -0.14 -3.54 -0.17 0.00 0.03 0.00 0.00 46.19 42.38 2pfd s LEU 226 CO -0.09 -0.85 1.31 -0.33 0.23 0.00 0.00 176.35 176.62 2pfd h GLU 227 N 8.83 -0.31 0.00 1.70 4.39 -1.98 -2.37 114.58 124.85 2pfd h GLU 227 Ca -0.31 0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.39 2pfd h GLU 227 Cb 1.13 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.85 2pfd h GLU 227 CO 0.97 0.00 -0.08 1.05 -1.16 0.00 0.00 179.01 179.79 2pfd h GLU 228 N -0.64 0.00 0.00 2.33 4.11 -1.97 -3.06 114.58 115.36 2pfd h GLU 228 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.40 2pfd h GLU 228 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2pfd h GLU 228 CO 0.05 0.08 -1.34 1.63 0.07 0.00 0.00 179.01 179.51 2pfd n LYS 229 N -3.23 0.40 -1.84 1.06 4.76 -1.23 -4.97 118.16 113.11 2pfd n LYS 229 Ca 0.00 -0.07 -0.12 0.00 -2.87 0.00 0.00 58.31 55.25 2pfd n LYS 229 Cb 0.34 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 32.02 2pfd n LYS 229 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 2pfd n ASN 230 N -1.76 -4.10 -4.25 4.39 5.15 -0.91 -4.97 115.26 108.81 2pfd n ASN 230 Ca 0.01 0.12 -0.32 0.00 -0.60 0.00 0.00 54.58 53.80 2pfd n ASN 230 Cb 0.40 -3.02 -0.17 0.00 -0.53 0.00 0.00 39.78 36.47 2pfd n ASN 230 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2pfd s LEU 231 N -3.12 2.14 0.78 1.20 2.96 -1.10 -4.99 118.68 116.54 2pfd s LEU 231 Ca 0.00 -0.52 -0.12 0.00 -0.22 0.00 0.00 54.13 53.27 2pfd s LEU 231 Cb 0.00 -1.42 0.06 0.00 0.50 0.00 0.00 46.19 45.34 2pfd s LEU 231 CO 0.00 0.19 1.13 0.00 -1.32 0.00 0.00 176.35 176.35 2pfd s ALA 232 N 0.17 2.57 -0.17 5.97 0.00 -1.16 -0.43 121.76 128.71 2pfd s ALA 232 Ca -0.13 -0.46 -0.10 0.00 0.00 0.00 0.00 51.96 51.27 2pfd s ALA 232 Cb -0.16 -3.01 0.06 0.00 0.00 0.00 0.00 23.12 20.00 2pfd s ALA 232 CO 0.07 -1.57 0.41 -0.65 0.00 0.00 0.00 175.76 174.02 2pfd s GLN 233 N -5.40 0.40 -0.82 0.00 -0.21 0.14 -2.98 119.66 110.79 2pfd s GLN 233 Ca 0.61 0.76 -0.22 0.00 0.02 0.00 0.00 55.36 56.53 2pfd s GLN 233 Cb -0.12 0.01 0.09 0.00 1.00 0.00 0.00 33.01 33.98 2pfd s GLN 233 CO 0.51 -0.15 1.12 0.08 -2.12 0.00 0.00 175.29 174.73 2pfd s VAL 234 N 1.25 4.37 -0.22 1.09 1.01 0.45 -0.17 120.40 128.17 2pfd s VAL 234 Ca -0.08 -0.80 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 2pfd s VAL 234 Cb -0.08 -4.79 -0.03 0.00 0.00 0.00 0.00 36.38 31.48 2pfd s VAL 234 CO -0.11 -1.58 0.53 -0.55 0.00 0.00 0.00 175.10 173.40 2pfd s SER 235 N 3.86 6.53 0.20 3.32 0.15 0.15 -0.22 113.70 127.68 2pfd s SER 235 Ca 0.30 0.64 0.03 0.00 0.70 0.00 0.00 55.95 57.63 2pfd s SER 235 Cb -0.09 -2.30 -0.05 0.00 -1.71 0.00 0.00 66.02 61.87 2pfd s SER 235 CO 0.00 -0.23 -0.03 0.42 1.20 0.00 0.00 173.24 174.60 2pfd s THR 236 N 1.93 0.98 -0.18 6.45 -4.23 0.23 0.65 115.64 121.48 2pfd s THR 236 Ca 0.24 -2.03 0.01 0.00 -1.18 0.00 0.00 61.69 58.73 2pfd s THR 236 Cb -0.15 -2.16 0.03 0.00 1.34 0.00 0.00 72.50 71.55 2pfd s THR 236 CO 0.09 -0.47 -0.16 0.20 -0.54 0.00 0.00 174.62 173.75 2pfd s ASN 237 N -3.24 3.13 -0.32 3.99 0.01 0.56 -1.22 114.94 117.85 2pfd s ASN 237 Ca 0.24 -0.70 -0.29 0.00 -0.71 0.00 0.00 52.86 51.40 2pfd s ASN 237 Cb 0.05 -1.34 0.01 0.00 0.41 0.00 0.00 41.25 40.38 2pfd s ASN 237 CO 0.05 -0.06 1.19 -0.76 -1.51 0.00 0.00 177.10 176.01 2pfd s LEU 238 N 1.36 3.89 0.29 0.60 1.02 -0.51 -1.77 118.68 123.55 2pfd s LEU 238 Ca 0.03 1.08 0.24 0.00 0.02 0.00 0.00 54.13 55.49 2pfd s LEU 238 Cb -0.14 -3.54 0.34 0.00 0.02 0.00 0.00 46.19 42.87 2pfd s LEU 238 CO -0.11 -1.00 1.45 -0.07 0.02 0.00 0.00 176.35 176.64 2pfd h LEU 239 N 10.54 0.00 -6.00 1.79 3.38 -1.05 -2.54 115.31 121.44 2pfd h LEU 239 Ca -0.23 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.71 2pfd h LEU 239 Cb 1.08 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 41.62 2pfd h LEU 239 CO 1.04 0.02 -0.39 -0.62 0.09 0.00 0.00 178.44 178.57 2pfd s ASP 240 N -5.37 -1.60 0.00 -0.43 -1.08 -1.25 -4.64 116.67 102.30 2pfd s ASP 240 Ca 0.06 -0.06 0.03 0.00 -0.52 0.00 0.00 52.55 52.06 2pfd s ASP 240 Cb 0.09 2.01 0.16 0.00 -1.46 0.00 0.00 42.92 43.72 2pfd s ASP 240 CO 0.69 -0.26 0.88 2.22 0.52 0.00 0.00 175.17 179.22 2pfd n PHE 241 N 5.16 0.00 0.05 -5.34 1.16 -1.26 -1.09 117.46 116.14 2pfd n PHE 241 Ca 0.07 0.00 -0.21 0.00 -1.87 0.00 0.00 57.45 55.43 2pfd n PHE 241 Cb 0.55 -0.24 -0.15 0.00 -1.61 0.00 0.00 39.48 38.03 2pfd n PHE 241 CO 0.00 0.00 0.00 0.93 -1.87 0.00 0.00 176.76 175.82 2pfd h GLU 242 N 0.00 0.33 0.06 3.97 4.39 -1.97 -3.34 114.58 118.02 2pfd h GLU 242 Ca 0.00 -0.56 -0.00 0.00 0.34 0.00 0.00 59.36 59.14 2pfd h GLU 242 Cb 0.02 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2pfd h GLU 242 CO 0.00 1.24 -0.03 0.28 -1.16 0.00 0.00 179.01 179.34 2pfd h VAL 243 N 0.09 0.10 -3.36 3.13 2.07 -1.50 -3.43 116.25 113.34 2pfd h VAL 243 Ca -0.36 -1.00 -0.65 0.00 0.82 0.00 0.00 66.70 65.51 2pfd h VAL 243 Cb 2.07 0.18 -0.26 0.00 -1.52 0.00 0.00 31.29 31.76 2pfd h VAL 243 CO 0.15 0.03 -0.72 -0.89 0.02 0.00 0.00 177.57 176.16 2pfd s THR 244 N -1.88 3.42 0.71 2.57 2.01 -1.08 -5.00 115.64 116.40 2pfd s THR 244 Ca -0.02 -0.50 -0.10 0.00 0.31 0.00 0.00 61.69 61.38 2pfd s THR 244 Cb -0.00 -2.52 0.04 0.00 0.01 0.00 0.00 72.50 70.03 2pfd s THR 244 CO 0.08 0.46 1.07 0.00 -0.69 0.00 0.00 174.62 175.54 2pfd s ALA 245 N 0.97 2.95 0.48 7.40 0.00 -1.26 -4.01 121.76 128.29 2pfd s ALA 245 Ca -0.00 -0.58 0.14 0.00 0.00 0.00 0.00 51.96 51.52 2pfd s ALA 245 Cb -0.15 -2.87 1.11 0.00 0.00 0.00 0.00 23.12 21.22 2pfd s ALA 245 CO 0.00 -1.24 2.08 -0.07 0.00 0.00 0.00 175.76 176.54 2pfd h LEU 246 N -0.66 0.08 0.13 0.00 3.38 -1.80 -2.56 115.31 113.88 2pfd h LEU 246 Ca -0.45 -0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.18 2pfd h LEU 246 Cb 1.28 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.00 2pfd h LEU 246 CO 0.63 0.12 -1.75 1.12 0.09 0.00 0.00 178.44 178.66 2pfd h HIS 247 N 0.09 0.48 0.00 1.13 2.07 -1.93 -3.21 115.15 113.79 2pfd h HIS 247 Ca 0.02 -0.35 -0.01 0.00 -2.85 0.00 0.00 60.37 57.18 2pfd h HIS 247 Cb 0.10 -0.02 -0.00 0.00 2.57 0.00 0.00 27.41 30.06 2pfd h HIS 247 CO 0.00 1.54 -0.06 1.79 -3.07 0.00 0.00 177.93 178.12 2pfd h THR 248 N 0.07 0.22 0.00 6.12 1.35 -1.90 1.65 112.91 120.43 2pfd h THR 248 Ca -0.33 -0.51 0.00 0.00 -0.55 0.00 0.00 66.41 65.03 2pfd h THR 248 Cb 2.05 1.41 0.00 0.00 -1.73 0.00 0.00 68.15 69.87 2pfd h THR 248 CO 0.14 0.06 0.00 0.52 -0.25 0.00 0.00 175.52 175.99 2pfd n VAL 249 N -3.27 0.00 -0.25 6.82 0.31 -0.98 -2.92 118.33 118.04 2pfd n VAL 249 Ca -0.01 1.04 -0.08 0.00 -0.01 0.00 0.00 64.34 65.28 2pfd n VAL 249 Cb 0.26 -1.96 -0.07 0.00 -0.91 0.00 0.00 33.84 31.17 2pfd n VAL 249 CO 0.00 0.00 0.00 0.22 -1.32 0.00 0.00 176.83 175.73 2pfd h TYR 250 N 0.00 -1.25 -0.14 3.52 3.20 -1.38 0.53 116.97 121.44 2pfd h TYR 250 Ca 0.00 0.08 0.04 0.00 3.14 0.00 0.00 58.73 61.99 2pfd h TYR 250 Cb 0.00 0.63 -0.01 0.00 1.54 0.00 0.00 36.73 38.89 2pfd h TYR 250 CO 0.12 -0.26 0.26 0.93 -1.64 0.00 0.00 178.16 177.56 2pfd h GLU 251 N -0.05 0.00 0.00 1.82 4.39 0.23 0.19 114.58 121.16 2pfd h GLU 251 Ca 0.10 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.73 2pfd h GLU 251 Cb 0.30 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 2pfd h GLU 251 CO -0.59 0.00 -0.41 1.49 -1.16 0.00 0.00 179.01 178.34 2pfd h GLU 252 N 0.00 0.00 -0.95 2.33 4.57 -0.86 -3.01 114.58 116.66 2pfd h GLU 252 Ca 0.07 0.00 0.13 0.00 -1.18 0.00 0.00 59.36 58.38 2pfd h GLU 252 Cb 0.58 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 29.10 2pfd h GLU 252 CO -0.00 0.88 0.60 0.00 -1.18 0.00 0.00 179.01 179.32 2pfd h ALA 253 N -0.27 1.66 -0.54 2.92 0.00 -0.08 0.15 119.26 123.10 2pfd h ALA 253 Ca -0.11 0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.92 2pfd h ALA 253 Cb 1.00 -0.17 -0.11 0.00 0.00 0.00 0.00 17.79 18.51 2pfd h ALA 253 CO -0.07 0.09 -0.31 0.00 0.00 0.00 0.00 179.25 178.96 2pfd h ARG 254 N 0.85 -0.16 0.25 0.00 2.47 -0.74 -1.34 114.38 115.70 2pfd h ARG 254 Ca 0.47 0.01 -0.01 0.00 -1.26 0.00 0.00 59.98 59.19 2pfd h ARG 254 Cb 0.59 0.04 0.00 0.00 -1.65 0.00 0.00 29.97 28.95 2pfd h ARG 254 CO -0.24 -0.11 -0.12 0.00 0.56 0.00 0.00 179.97 180.07 2pfd h ARG 255 N -0.17 -0.32 -0.71 0.04 3.08 -0.93 -1.54 114.38 113.82 2pfd h ARG 255 Ca 0.22 0.02 0.23 0.00 0.07 0.00 0.00 59.98 60.52 2pfd h ARG 255 Cb 0.54 0.07 -0.13 0.00 0.08 0.00 0.00 29.97 30.53 2pfd h ARG 255 CO -0.64 -0.01 0.12 -1.91 -1.07 0.00 0.00 179.97 176.46 2pfd n GLU 256 N -5.10 -0.05 0.09 0.04 4.07 0.36 -0.87 120.64 119.18 2pfd n GLU 256 Ca -0.09 1.05 -0.23 0.00 -0.06 0.00 0.00 57.16 57.82 2pfd n GLU 256 Cb 0.24 -1.72 -0.15 0.00 -0.06 0.00 0.00 31.44 29.75 2pfd n GLU 256 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2pfd h ALA 257 N 1.43 0.09 0.00 4.31 0.00 -1.10 -3.11 119.26 120.87 2pfd h ALA 257 Ca 0.48 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2pfd h ALA 257 Cb 1.10 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.28 2pfd h ALA 257 CO -0.64 0.95 0.00 1.04 0.00 0.00 0.00 179.25 180.61 2pfd n GLN 258 N -3.62 0.12 0.12 0.00 6.02 -0.06 0.10 117.38 120.06 2pfd n GLN 258 Ca -0.23 0.21 0.08 0.00 -0.01 0.00 0.00 57.00 57.05 2pfd n GLN 258 Cb 1.08 -1.50 0.02 0.00 1.02 0.00 0.00 30.24 30.87 2pfd n GLN 258 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 2pfd h GLU 259 N 0.00 0.00 -0.06 -1.09 5.08 -0.93 -3.35 114.58 114.23 2pfd h GLU 259 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2pfd h GLU 259 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2pfd h GLU 259 CO 0.00 0.15 0.00 1.28 -1.00 0.00 0.00 179.01 179.44 2pfd n LEU 260 N -2.91 2.20 -3.58 1.33 4.77 -0.13 -5.03 117.00 113.65 2pfd n LEU 260 Ca -0.01 -2.09 -0.20 0.00 -0.03 0.00 0.00 56.01 53.68 2pfd n LEU 260 Cb 0.64 -0.08 0.05 0.00 -2.33 0.00 0.00 43.42 41.71 2pfd n LEU 260 CO 0.39 0.55 -0.01 0.59 -1.33 0.00 0.00 177.39 177.59 2pfd n ASN 261 N -0.40 -2.25 -4.10 -1.43 5.03 0.12 -5.01 115.26 107.21 2pfd n ASN 261 Ca 0.03 -0.77 -0.26 0.00 0.87 0.00 0.00 54.58 54.45 2pfd n ASN 261 Cb 0.32 -4.42 -0.16 0.00 -1.02 0.00 0.00 39.78 34.49 2pfd n ASN 261 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2pfd s LEU 262 N -6.44 1.84 0.23 3.41 1.43 -0.94 -5.03 118.68 113.17 2pfd s LEU 262 Ca 0.08 -0.36 -0.30 0.00 -1.03 0.00 0.00 54.13 52.52 2pfd s LEU 262 Cb -0.02 -0.97 -0.09 0.00 0.03 0.00 0.00 46.19 45.14 2pfd s LEU 262 CO 0.79 0.11 1.11 -2.16 0.23 0.00 0.00 176.35 176.43 2pfd s PRO 263 N 0.32 4.60 -0.22 1.29 0.04 -1.26 -4.32 135.00 135.45 2pfd s PRO 263 Ca -0.10 1.79 -0.11 0.00 0.04 0.00 0.00 61.00 62.61 2pfd s PRO 263 Cb -0.14 -3.22 -0.05 0.00 0.04 0.00 0.00 34.50 31.13 2pfd s PRO 263 CO 0.04 0.13 0.19 0.08 0.04 0.00 0.00 177.00 177.48 2pfd s VAL 264 N -0.70 5.35 -0.66 -0.36 1.01 -1.26 -0.68 120.40 123.09 2pfd s VAL 264 Ca 0.47 0.28 0.04 0.00 0.00 0.00 0.00 61.98 62.78 2pfd s VAL 264 Cb -0.31 -3.53 0.31 0.00 0.00 0.00 0.00 36.38 32.85 2pfd s VAL 264 CO 0.38 0.37 1.01 1.33 0.00 0.00 0.00 175.10 178.19 2pfd n VAL 265 N 4.00 3.29 -3.86 2.92 0.24 0.40 -4.94 118.33 120.39 2pfd n VAL 265 Ca -0.14 -5.55 0.00 0.00 -2.04 0.00 0.00 64.34 56.60 2pfd n VAL 265 Cb 0.52 -1.61 0.00 0.00 -1.47 0.00 0.00 33.84 31.28 2pfd n VAL 265 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2pfd n GLY 266 N 0.09 -0.35 3.82 7.63 0.00 -1.26 -4.63 105.19 110.50 2pfd n GLY 266 Ca 0.32 -1.13 -0.03 0.00 0.00 0.00 0.00 46.02 45.18 2pfd n GLY 266 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2pfd s SER 267 N -4.00 -0.06 -0.07 1.61 1.04 -0.62 -1.51 113.70 110.08 2pfd s SER 267 Ca 0.00 -0.58 -0.06 0.00 0.48 0.00 0.00 55.95 55.78 2pfd s SER 267 Cb 0.00 0.50 0.02 0.00 0.10 0.00 0.00 66.02 66.65 2pfd s SER 267 CO 0.00 -0.98 0.19 0.00 0.98 0.00 0.00 173.24 173.44 2pfd s GLN 268 N -2.60 0.21 0.07 4.02 -2.07 -1.00 -4.27 119.66 114.02 2pfd s GLN 268 Ca 0.18 0.30 -0.20 0.00 -1.82 0.00 0.00 55.36 53.82 2pfd s GLN 268 Cb -0.02 0.06 -0.07 0.00 -1.09 0.00 0.00 33.01 31.90 2pfd s GLN 268 CO 0.04 -0.05 0.58 -0.51 -1.32 0.00 0.00 175.29 174.04 2pfd s LEU 269 N 0.30 4.53 -0.22 2.60 1.43 -1.26 -1.52 118.68 124.53 2pfd s LEU 269 Ca -0.02 1.28 -0.04 0.00 -1.03 0.00 0.00 54.13 54.33 2pfd s LEU 269 Cb -0.03 -2.92 -0.00 0.00 0.03 0.00 0.00 46.19 43.26 2pfd s LEU 269 CO -0.01 0.26 -0.05 -0.69 0.23 0.00 0.00 176.35 176.09 2pfd s VAL 270 N -1.06 3.32 0.00 -1.59 1.01 -0.19 -4.99 120.40 116.90 2pfd s VAL 270 Ca 0.29 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.73 2pfd s VAL 270 Cb -0.20 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.66 2pfd s VAL 270 CO 0.19 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.31 2pfd n GLY 271 N 4.79 0.15 3.82 4.51 0.00 -1.26 -4.10 105.19 113.10 2pfd n GLY 271 Ca -0.18 -1.28 -0.32 0.00 0.00 0.00 0.00 46.02 44.24 2pfd n GLY 271 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pfd s LEU 272 N 0.00 4.00 0.03 0.99 1.43 -1.26 -4.97 118.68 118.89 2pfd s LEU 272 Ca 0.00 0.13 0.07 0.00 -1.03 0.00 0.00 54.13 53.30 2pfd s LEU 272 Cb 0.00 -2.51 -0.02 0.00 0.03 0.00 0.00 46.19 43.68 2pfd s LEU 272 CO 0.00 0.21 -0.21 0.54 0.23 0.00 0.00 176.35 177.13 2pfd s VAL 273 N -1.34 1.68 0.32 -1.59 0.11 -1.08 -4.88 120.40 113.62 2pfd s VAL 273 Ca 0.28 -1.16 -0.27 0.00 -2.93 0.00 0.00 61.98 57.91 2pfd s VAL 273 Cb -0.12 -1.45 -0.10 0.00 -1.53 0.00 0.00 36.38 33.18 2pfd s VAL 273 CO 0.20 0.25 0.98 -2.84 -3.33 0.00 0.00 175.10 170.36 2pfd s PRO 274 N -1.07 4.57 0.16 1.54 0.02 -1.26 -1.72 135.00 137.23 2pfd s PRO 274 Ca 0.08 1.43 -0.17 0.00 0.02 0.00 0.00 61.00 62.36 2pfd s PRO 274 Cb -0.09 -2.88 0.07 0.00 0.02 0.00 0.00 34.50 31.63 2pfd s PRO 274 CO 0.01 0.25 1.70 1.25 -0.33 0.00 0.00 177.00 179.88 2pfd h LEU 275 N 3.30 -0.20 -0.29 -5.54 5.85 -1.96 -2.60 115.31 113.87 2pfd h LEU 275 Ca -0.47 0.09 0.07 0.00 0.84 0.00 0.00 57.88 58.41 2pfd h LEU 275 Cb 1.20 0.17 -0.07 0.00 0.37 0.00 0.00 40.66 42.33 2pfd h LEU 275 CO 0.65 -0.06 -0.17 0.50 -0.34 0.00 0.00 178.44 179.03 2pfd h LYS 276 N 0.07 -0.13 -0.85 1.25 3.64 -1.95 -0.42 116.57 118.18 2pfd h LYS 276 Ca 0.17 0.01 0.11 0.00 -1.27 0.00 0.00 60.65 59.67 2pfd h LYS 276 Cb 0.25 0.03 -0.12 0.00 -0.41 0.00 0.00 32.23 31.97 2pfd h LYS 276 CO -0.31 -0.08 -0.39 0.00 -2.27 0.00 0.00 179.45 176.39 2pfd n ALA 277 N -2.72 -0.27 1.21 5.00 0.00 -0.98 0.07 120.51 122.81 2pfd n ALA 277 Ca 0.00 0.80 0.13 0.00 0.00 0.00 0.00 53.44 54.36 2pfd n ALA 277 Cb 0.25 -0.28 0.31 0.00 0.00 0.00 0.00 19.45 19.73 2pfd n ALA 277 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2pfd n LEU 278 N -5.17 1.23 0.06 0.00 -0.00 -1.04 -3.42 117.00 108.65 2pfd n LEU 278 Ca 0.06 -0.36 0.00 0.00 -0.00 0.00 0.00 56.01 55.71 2pfd n LEU 278 Cb 0.29 -0.10 -0.06 0.00 -0.00 0.00 0.00 43.42 43.56 2pfd n LEU 278 CO -0.12 0.23 -0.11 0.25 -0.00 0.00 0.00 177.39 177.64 2pfd h LEU 279 N 1.47 0.00 0.01 1.47 6.46 0.14 -2.79 115.31 122.07 2pfd h LEU 279 Ca 0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 2pfd h LEU 279 Cb 0.55 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.48 2pfd h LEU 279 CO 0.00 0.57 -0.01 0.44 -0.62 0.00 0.00 178.44 178.82 2pfd h ASP 280 N 0.00 -0.02 -0.87 1.25 3.32 -0.71 -2.78 116.42 116.62 2pfd h ASP 280 Ca -0.12 -0.67 0.09 0.00 0.02 0.00 0.00 57.03 56.34 2pfd h ASP 280 Cb 1.54 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 40.98 2pfd h ASP 280 CO 0.05 0.68 -0.48 0.00 -1.72 0.00 0.00 179.24 177.77 2pfd n ALA 281 N -2.48 -0.47 -0.22 3.45 0.00 -1.22 -0.39 120.51 119.19 2pfd n ALA 281 Ca -0.09 0.76 -0.08 0.00 0.00 0.00 0.00 53.44 54.03 2pfd n ALA 281 Cb 0.34 -0.17 -0.07 0.00 0.00 0.00 0.00 19.45 19.55 2pfd n ALA 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pfd h ALA 282 N 0.57 -0.45 -0.45 0.00 0.00 -1.50 -0.86 119.26 116.56 2pfd h ALA 282 Ca 0.17 0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.26 2pfd h ALA 282 Cb 0.39 1.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 2pfd h ALA 282 CO -0.82 -0.70 0.36 0.00 0.00 0.00 0.00 179.25 178.09 2pfd h ALA 283 N -0.16 2.32 -0.04 0.00 0.00 -0.42 -0.14 119.26 120.83 2pfd h ALA 283 Ca 0.09 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 2pfd h ALA 283 Cb 0.32 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2pfd h ALA 283 CO -0.55 -0.60 0.01 0.35 0.00 0.00 0.00 179.25 178.46 2pfd h PHE 284 N 0.00 0.07 0.00 0.00 3.57 0.61 -1.28 116.94 119.91 2pfd h PHE 284 Ca 0.21 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.71 2pfd h PHE 284 Cb 0.94 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.66 2pfd h PHE 284 CO 0.00 0.29 0.00 0.66 -2.23 0.00 0.00 178.31 177.03 2pfd n TYR 285 N -4.92 0.31 -0.06 0.41 4.02 -0.08 -1.35 117.16 115.48 2pfd n TYR 285 Ca -0.07 0.13 -0.19 0.00 -0.01 0.00 0.00 57.90 57.76 2pfd n TYR 285 Cb 0.15 -0.71 -0.13 0.00 -0.02 0.00 0.00 39.34 38.63 2pfd n TYR 285 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2pfd h ASP 287 N 0.03 -0.78 0.43 0.00 1.82 -0.99 -0.54 116.42 116.39 2pfd h ASP 287 Ca -0.49 0.13 -0.31 0.00 -0.39 0.00 0.00 57.03 55.97 2pfd h ASP 287 Cb 1.98 0.36 -0.03 0.00 0.68 0.00 0.00 39.33 42.32 2pfd h ASP 287 CO 0.01 -0.29 -1.66 0.07 -1.61 0.00 0.00 179.24 175.76 2pfd h LYS 288 N -0.29 0.15 -0.00 0.28 2.10 -1.36 -3.26 116.57 114.19 2pfd h LYS 288 Ca 0.12 -0.26 0.00 0.00 -2.00 0.00 0.00 60.65 58.51 2pfd h LYS 288 Cb 0.47 0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.89 2pfd h LYS 288 CO -0.35 0.92 -0.00 -1.91 -2.00 0.00 0.00 179.45 176.11 2pfd n GLU 289 N -3.32 0.92 -3.42 0.07 2.13 -0.54 -4.93 120.64 111.56 2pfd n GLU 289 Ca -0.19 -0.05 -0.19 0.00 0.66 0.00 0.00 57.16 57.39 2pfd n GLU 289 Cb 1.04 -1.50 0.06 0.00 0.27 0.00 0.00 31.44 31.32 2pfd n GLU 289 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 2pfd n LYS 290 N -1.00 -3.16 -3.21 5.31 5.02 -0.34 -4.99 118.16 115.79 2pfd n LYS 290 Ca 0.22 0.76 -0.14 0.00 -2.02 0.00 0.00 58.31 57.12 2pfd n LYS 290 Cb 0.15 -5.45 -0.03 0.00 -0.02 0.00 0.00 35.03 29.68 2pfd n LYS 290 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 2pfd n LEU 291 N -3.69 0.00 -3.49 -0.35 -0.00 -0.46 -5.04 117.00 103.96 2pfd n LEU 291 Ca -0.14 -1.46 -0.26 0.00 -0.00 0.00 0.00 56.01 54.15 2pfd n LEU 291 Cb 0.63 0.22 -0.13 0.00 -0.00 0.00 0.00 43.42 44.14 2pfd n LEU 291 CO 0.62 -0.21 -0.29 0.12 -0.00 0.00 0.00 177.39 177.63 2pfd s PHE 292 N -1.91 0.19 -0.31 1.47 5.36 -1.26 -4.85 117.98 116.67 2pfd s PHE 292 Ca 0.02 -0.84 0.03 0.00 -0.96 0.00 0.00 56.93 55.17 2pfd s PHE 292 Cb 0.00 -0.79 0.09 0.00 -0.34 0.00 0.00 43.02 41.98 2pfd s PHE 292 CO 0.01 -0.85 0.01 0.08 -1.46 0.00 0.00 175.22 173.00 2pfd s VAL 293 N 1.97 2.07 -0.09 3.12 1.01 -1.26 -5.01 120.40 122.21 2pfd s VAL 293 Ca 0.11 -2.00 -0.01 0.00 0.00 0.00 0.00 61.98 60.08 2pfd s VAL 293 Cb -0.17 -2.43 -0.00 0.00 0.00 0.00 0.00 36.38 33.78 2pfd s VAL 293 CO -0.29 -0.43 -0.02 0.25 0.00 0.00 0.00 175.10 174.61 2pfd h LEU 294 N 7.72 0.00 -9.78 3.92 6.46 -1.98 -3.45 115.31 118.20 2pfd h LEU 294 Ca -0.10 0.00 -0.52 0.00 -0.12 0.00 0.00 57.88 57.15 2pfd h LEU 294 Cb 1.03 0.00 0.03 0.00 -0.73 0.00 0.00 40.66 40.99 2pfd h LEU 294 CO 0.49 0.46 0.56 -0.70 -0.62 0.00 0.00 178.44 178.63 2pfd s GLU 295 N -1.55 4.50 0.07 1.25 2.56 -1.26 -4.95 118.70 119.33 2pfd s GLU 295 Ca -0.01 1.96 -0.26 0.00 0.00 0.00 0.00 54.97 56.66 2pfd s GLU 295 Cb 0.00 -3.17 -0.16 0.00 2.00 0.00 0.00 34.13 32.80 2pfd s GLU 295 CO 0.02 -0.02 1.65 1.49 -0.56 0.00 0.00 175.26 177.84 2pfd h GLU 296 N 4.23 -0.23 -0.99 4.30 4.81 -2.00 -2.64 114.58 122.06 2pfd h GLU 296 Ca -0.47 0.02 0.16 0.00 -0.13 0.00 0.00 59.36 58.94 2pfd h GLU 296 Cb 1.22 0.05 -0.17 0.00 0.63 0.00 0.00 28.75 30.48 2pfd h GLU 296 CO 0.70 -0.11 -0.36 1.49 -0.73 0.00 0.00 179.01 180.00 2pfd h GLU 297 N -0.29 -0.00 -0.54 1.92 4.81 -2.00 0.29 114.58 118.76 2pfd h GLU 297 Ca -0.02 0.00 0.06 0.00 -0.13 0.00 0.00 59.36 59.27 2pfd h GLU 297 Cb 0.23 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 2pfd h GLU 297 CO 0.04 -0.00 0.36 0.45 -0.73 0.00 0.00 179.01 179.13 2pfd h HIS 298 N -0.00 0.49 -0.25 0.92 3.86 -1.87 0.32 115.15 118.61 2pfd h HIS 298 Ca 0.37 0.01 -0.05 0.00 -1.16 0.00 0.00 60.37 59.54 2pfd h HIS 298 Cb 0.62 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.92 2pfd h HIS 298 CO -0.85 0.26 -0.08 0.00 0.86 0.00 0.00 177.93 178.12 2pfd h ARG 299 N 0.49 0.40 -0.40 2.45 3.08 -0.23 -0.99 114.38 119.18 2pfd h ARG 299 Ca 0.23 -0.09 -0.15 0.00 0.07 0.00 0.00 59.98 60.05 2pfd h ARG 299 Cb 0.31 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.29 2pfd h ARG 299 CO -0.06 0.49 -0.31 0.82 -1.07 0.00 0.00 179.97 179.83 2pfd h ILE 300 N 0.38 1.27 -0.76 2.04 5.03 0.21 -2.24 117.51 123.45 2pfd h ILE 300 Ca 0.08 -1.48 0.04 0.00 -0.12 0.00 0.00 64.86 63.37 2pfd h ILE 300 Cb 0.38 1.32 -0.05 0.00 -3.03 0.00 0.00 36.82 35.45 2pfd h ILE 300 CO 0.02 0.50 0.47 -0.09 -0.68 0.00 0.00 178.15 178.37 2pfd h ARG 301 N 0.75 0.88 0.38 2.37 2.43 -0.63 -0.46 114.38 120.10 2pfd h ARG 301 Ca 0.08 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.17 2pfd h ARG 301 Cb 0.90 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.26 2pfd h ARG 301 CO 0.08 0.58 -0.18 1.25 -1.51 0.00 0.00 179.97 180.19 2pfd h LEU 302 N 0.90 -0.43 -0.16 3.80 5.85 -1.14 -2.81 115.31 121.33 2pfd h LEU 302 Ca 0.31 0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.05 2pfd h LEU 302 Cb 0.07 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.21 2pfd h LEU 302 CO -0.13 -0.31 0.04 0.55 -0.34 0.00 0.00 178.44 178.26 2pfd n VAL 303 N -3.37 1.73 0.00 1.05 3.14 -0.85 -0.77 118.33 119.26 2pfd n VAL 303 Ca -0.06 0.53 0.00 0.00 -2.96 0.00 0.00 64.34 61.85 2pfd n VAL 303 Cb 0.20 -1.53 0.00 0.00 -1.06 0.00 0.00 33.84 31.45 2pfd n VAL 303 CO 0.00 0.00 0.00 0.52 -6.46 0.00 0.00 176.83 170.89 2pfd n VAL 304 N -1.55 0.00 -0.25 1.55 0.31 -0.19 -3.79 118.33 114.41 2pfd n VAL 304 Ca -0.00 0.32 0.24 0.00 -0.01 0.00 0.00 64.34 64.90 2pfd n VAL 304 Cb 0.05 -0.68 0.45 0.00 -0.91 0.00 0.00 33.84 32.75 2pfd n VAL 304 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 2pfd n ASN 305 N -0.42 0.26 -0.17 4.52 2.85 -0.69 0.11 115.26 121.73 2pfd n ASN 305 Ca 0.00 1.28 -0.03 0.00 -0.11 0.00 0.00 54.58 55.72 2pfd n ASN 305 Cb 0.00 -0.62 0.18 0.00 1.24 0.00 0.00 39.78 40.58 2pfd n ASN 305 CO 0.00 0.00 0.00 0.03 -2.11 0.00 0.00 177.26 175.18 2pfd h ARG 306 N 0.00 0.91 -0.68 1.20 2.47 -1.15 -2.83 114.38 114.29 2pfd h ARG 306 Ca 0.65 -0.17 0.00 0.00 -1.26 0.00 0.00 59.98 59.21 2pfd h ARG 306 Cb 1.72 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 29.89 2pfd h ARG 306 CO -0.60 0.77 0.00 1.28 0.56 0.00 0.00 179.97 181.98 2pfd n LEU 307 N -4.29 3.87 -3.87 3.04 4.77 0.30 -4.98 117.00 115.84 2pfd n LEU 307 Ca 0.05 -1.93 -0.32 0.00 -0.03 0.00 0.00 56.01 53.78 2pfd n LEU 307 Cb 0.20 -0.45 0.01 0.00 -2.33 0.00 0.00 43.42 40.84 2pfd n LEU 307 CO 0.40 0.95 -0.21 0.61 -1.33 0.00 0.00 177.39 177.81 2pfd n GLY 308 N 1.60 -1.07 0.21 -0.72 0.00 -0.31 -2.74 105.19 102.16 2pfd n GLY 308 Ca 0.23 0.47 0.12 0.00 0.00 0.00 0.00 46.02 46.85 2pfd n GLY 308 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2pfd h LEU 309 N -1.06 0.00 -7.73 0.99 3.38 -1.74 -1.66 115.31 107.49 2pfd h LEU 309 Ca -0.64 0.00 -0.73 0.00 0.09 0.00 0.00 57.88 56.60 2pfd h LEU 309 Cb 1.33 0.00 -0.31 0.00 0.09 0.00 0.00 40.66 41.77 2pfd h LEU 309 CO 0.40 0.00 -0.23 1.51 0.09 0.00 0.00 178.44 180.22 2pfd s ASP 310 N -6.07 5.81 0.00 -0.43 1.47 -1.26 -4.59 116.67 111.61 2pfd s ASP 310 Ca 0.07 -2.61 0.00 0.00 1.18 0.00 0.00 52.55 51.19 2pfd s ASP 310 Cb 0.06 -2.00 0.00 0.00 -0.34 0.00 0.00 42.92 40.64 2pfd s ASP 310 CO 0.66 -0.50 0.00 -1.54 0.68 0.00 0.00 175.17 174.47 2pfd n SER 311 N 3.93 0.00 -0.00 2.11 3.41 -1.26 -4.82 113.62 116.99 2pfd n SER 311 Ca 0.06 0.00 0.05 0.00 -0.26 0.00 0.00 58.87 58.72 2pfd n SER 311 Cb 0.41 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.30 2pfd n SER 311 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2pfd n LEU 312 N -0.30 0.35 0.00 1.04 4.77 -1.26 -5.04 117.00 116.56 2pfd n LEU 312 Ca 0.00 -0.38 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 2pfd n LEU 312 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2pfd n LEU 312 CO 0.00 0.09 0.00 0.00 -1.33 0.00 0.00 177.39 176.15 2pfd n ALA 313 N -1.39 0.00 -1.78 -1.18 0.00 -1.26 -5.15 120.51 109.75 2pfd n ALA 313 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.13 2pfd n ALA 313 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.64 2pfd n ALA 313 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2pfd s PRO 314 N -2.00 3.55 -0.52 0.00 0.04 -1.26 -4.24 135.00 130.56 2pfd s PRO 314 Ca 0.00 0.92 -0.09 0.00 0.04 0.00 0.00 61.00 61.87 2pfd s PRO 314 Cb 0.00 -2.07 0.13 0.00 0.04 0.00 0.00 34.50 32.60 2pfd s PRO 314 CO 0.00 -0.61 0.39 0.12 0.04 0.00 0.00 177.00 176.94 2pfd s PHE 315 N -2.87 3.46 -0.63 0.56 5.36 -1.26 -4.95 117.98 117.65 2pfd s PHE 315 Ca 0.58 -1.99 -0.23 0.00 -0.96 0.00 0.00 56.93 54.33 2pfd s PHE 315 Cb -0.12 -3.49 0.06 0.00 -0.34 0.00 0.00 43.02 39.12 2pfd s PHE 315 CO 0.44 -0.98 0.98 0.34 -1.46 0.00 0.00 175.22 174.54 2pfd s ASP 316 N 2.40 6.23 0.43 6.13 3.68 -1.26 -4.87 116.67 129.41 2pfd s ASP 316 Ca 0.08 -0.73 0.23 0.00 2.13 0.00 0.00 52.55 54.26 2pfd s ASP 316 Cb -0.24 -2.43 0.84 0.00 -1.45 0.00 0.00 42.92 39.63 2pfd s ASP 316 CO -0.02 -1.39 1.79 1.55 0.13 0.00 0.00 175.17 177.23 2pfd h PRO 317 N 9.51 0.00 0.00 4.34 0.13 -1.97 -0.11 132.00 143.89 2pfd h PRO 317 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2pfd h PRO 317 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 2pfd h PRO 317 CO 1.15 0.25 0.00 1.17 -0.23 0.00 0.00 178.00 180.34 2pfd n LYS 318 N -3.39 0.17 0.00 0.86 4.81 -1.26 -2.09 118.16 117.26 2pfd n LYS 318 Ca 0.00 0.12 0.00 0.00 -0.87 0.00 0.00 58.31 57.56 2pfd n LYS 318 Cb 0.46 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.01 2pfd n LYS 318 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 2pfd n GLU 319 N -1.16 0.00 -0.05 1.64 2.13 -0.19 -4.48 120.64 118.53 2pfd n GLU 319 Ca 0.05 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.82 2pfd n GLU 319 Cb 0.05 -0.19 -0.08 0.00 0.27 0.00 0.00 31.44 31.48 2pfd n GLU 319 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2pfd n ARG 320 N 0.00 2.20 -3.14 5.31 5.12 -0.43 -4.98 116.66 120.74 2pfd n ARG 320 Ca 0.00 -0.01 -0.39 0.00 -1.93 0.00 0.00 57.85 55.52 2pfd n ARG 320 Cb 0.12 -1.27 -0.05 0.00 -1.16 0.00 0.00 32.46 30.10 2pfd n ARG 320 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2pfd s ILE 321 N -2.28 4.84 0.03 0.55 1.01 -0.89 -2.63 121.20 121.84 2pfd s ILE 321 Ca -0.05 1.37 -0.31 0.00 0.00 0.00 0.00 60.65 61.66 2pfd s ILE 321 Cb 0.03 -3.99 -0.17 0.00 0.01 0.00 0.00 42.46 38.34 2pfd s ILE 321 CO 0.43 0.41 1.30 0.40 0.00 0.00 0.00 174.94 177.48 2pfd h ILE 322 N 4.10 0.05 0.00 2.92 2.04 -1.68 -0.66 117.51 124.29 2pfd h ILE 322 Ca -0.45 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.22 2pfd h ILE 322 Cb 1.20 0.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.35 2pfd h ILE 322 CO 0.70 0.01 0.25 -0.62 0.00 0.00 0.00 178.15 178.49 2pfd n GLU 323 N -5.50 0.08 -0.11 2.37 4.71 -1.26 0.08 120.64 121.01 2pfd n GLU 323 Ca -0.14 0.54 -0.16 0.00 -0.01 0.00 0.00 57.16 57.39 2pfd n GLU 323 Cb 0.43 -2.02 -0.13 0.00 -1.01 0.00 0.00 31.44 28.71 2pfd n GLU 323 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 2pfd n TYR 324 N -1.96 0.09 -0.05 -0.32 4.02 -1.16 -3.74 117.16 114.04 2pfd n TYR 324 Ca -0.01 0.02 -0.09 0.00 -0.01 0.00 0.00 57.90 57.82 2pfd n TYR 324 Cb 0.27 -1.01 -0.02 0.00 -0.02 0.00 0.00 39.34 38.56 2pfd n TYR 324 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 176.86 175.78 2pfd h LEU 325 N 0.00 0.08 -7.02 7.72 4.07 0.13 -3.35 115.31 116.93 2pfd h LEU 325 Ca -0.56 0.02 -0.62 0.00 0.08 0.00 0.00 57.88 56.80 2pfd h LEU 325 Cb 1.98 0.02 -0.41 0.00 1.08 0.00 0.00 40.66 43.33 2pfd h LEU 325 CO -0.05 0.07 -0.67 0.68 -1.08 0.00 0.00 178.44 177.39 2pfd s VAL 326 N -6.18 2.20 1.07 1.22 -7.23 -0.42 -5.10 120.40 105.97 2pfd s VAL 326 Ca -0.13 -3.54 -0.14 0.00 -1.81 0.00 0.00 61.98 56.35 2pfd s VAL 326 Cb 0.10 -2.48 0.15 0.00 0.56 0.00 0.00 36.38 34.71 2pfd s VAL 326 CO 0.69 -0.98 0.54 -2.65 -0.31 0.00 0.00 175.10 172.39 2pfd n PRO 327 N 2.61 -1.41 -3.16 4.82 -0.02 -1.25 -4.69 135.00 131.91 2pfd n PRO 327 Ca 0.16 -0.38 -0.39 0.00 -2.02 0.00 0.00 63.50 60.88 2pfd n PRO 327 Cb 0.36 -1.96 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 2pfd n PRO 327 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2pfd n ASP 328 N -2.89 5.60 0.03 2.55 5.75 -1.26 -4.67 116.55 121.65 2pfd n ASP 328 Ca 0.04 -3.39 -0.01 0.00 -0.01 0.00 0.00 54.79 51.41 2pfd n ASP 328 Cb 0.57 -1.11 -0.01 0.00 -1.03 0.00 0.00 41.12 39.54 2pfd n ASP 328 CO 0.00 0.00 0.00 0.77 -0.11 0.00 0.00 177.20 177.86 2pfd h SER 329 N 5.19 -0.08 0.00 -1.12 4.64 -1.96 -3.35 113.55 116.86 2pfd h SER 329 Ca 0.20 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 2pfd h SER 329 Cb 0.65 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 2pfd h SER 329 CO 1.17 -0.01 0.00 0.61 -0.87 0.00 0.00 176.83 177.73 2pfd n GLY 330 N 0.71 -0.77 3.76 -0.77 0.00 -1.26 -4.92 105.19 101.95 2pfd n GLY 330 Ca -0.01 -2.02 -0.38 0.00 0.00 0.00 0.00 46.02 43.61 2pfd n GLY 330 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2pfd s PRO 331 N 0.00 4.21 0.59 1.61 0.04 -1.26 -4.92 135.00 135.27 2pfd s PRO 331 Ca 0.00 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.50 2pfd s PRO 331 Cb 0.00 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.19 2pfd s PRO 331 CO 0.00 0.36 0.00 0.39 0.04 0.00 0.00 177.00 177.79 2pfd n GLU 332 N 2.93 -3.16 -2.27 4.56 -0.58 -1.26 -4.93 120.64 115.93 2pfd n GLU 332 Ca -0.09 2.59 -0.29 0.00 -0.42 0.00 0.00 57.16 58.95 2pfd n GLU 332 Cb 0.52 -3.72 0.01 0.00 -0.57 0.00 0.00 31.44 27.68 2pfd n GLU 332 CO 0.00 0.00 0.00 -0.65 -0.48 0.00 0.00 177.13 176.00 2pfd s GLN 333 N -4.44 3.37 0.49 3.49 -0.21 -1.26 -5.06 119.66 116.04 2pfd s GLN 333 Ca 0.00 0.36 -0.18 0.00 0.02 0.00 0.00 55.36 55.56 2pfd s GLN 333 Cb 0.00 -2.22 -0.09 0.00 1.00 0.00 0.00 33.01 31.70 2pfd s GLN 333 CO 0.00 -0.50 0.98 0.45 -2.12 0.00 0.00 175.29 174.10 2pfd s SER 334 N -4.19 6.65 0.34 5.90 0.15 -1.26 -4.96 113.70 116.32 2pfd s SER 334 Ca 0.52 1.66 0.08 0.00 0.70 0.00 0.00 55.95 58.92 2pfd s SER 334 Cb -0.11 -2.53 0.61 0.00 -1.71 0.00 0.00 66.02 62.29 2pfd s SER 334 CO 0.49 -0.57 1.80 -0.07 1.20 0.00 0.00 173.24 176.09 2pfd h LEU 335 N 1.29 0.22 -0.80 3.45 4.07 -1.95 -3.03 115.31 118.56 2pfd h LEU 335 Ca -0.48 -0.07 0.16 0.00 0.08 0.00 0.00 57.88 57.57 2pfd h LEU 335 Cb 1.19 -0.06 -0.02 0.00 1.08 0.00 0.00 40.66 42.85 2pfd h LEU 335 CO 0.61 0.51 1.03 -0.07 -1.08 0.00 0.00 178.44 179.44 2pfd h LEU 336 N 0.20 0.00 -0.90 1.67 3.38 -1.94 0.92 115.31 118.64 2pfd h LEU 336 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2pfd h LEU 336 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2pfd h LEU 336 CO 0.05 0.00 -0.37 0.47 0.09 0.00 0.00 178.44 178.68 2pfd n ASP 337 N -2.99 1.70 -4.69 -0.43 8.00 -1.14 -4.93 116.55 112.07 2pfd n ASP 337 Ca 0.12 -1.35 -0.32 0.00 0.71 0.00 0.00 54.79 53.95 2pfd n ASP 337 Cb 1.20 0.48 -0.09 0.00 -0.02 0.00 0.00 41.12 42.69 2pfd n ASP 337 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pfd s ALA 338 N -2.02 3.30 0.50 2.24 0.00 0.32 -5.06 121.76 121.02 2pfd s ALA 338 Ca 0.14 -0.96 -0.16 0.00 0.00 0.00 0.00 51.96 50.99 2pfd s ALA 338 Cb 0.14 -1.34 -0.13 0.00 0.00 0.00 0.00 23.12 21.79 2pfd s ALA 338 CO 0.44 0.65 -0.19 -1.13 0.00 0.00 0.00 175.76 175.53 2pfd n SER 339 N 1.32 -3.47 -0.14 0.00 3.41 -1.26 -4.20 113.62 109.28 2pfd n SER 339 Ca -0.14 0.51 -0.08 0.00 -0.26 0.00 0.00 58.87 58.90 2pfd n SER 339 Cb 0.53 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.72 2pfd n SER 339 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2pfd h LEU 340 N -0.13 -1.28 -0.83 1.04 5.85 -1.97 0.42 115.31 118.42 2pfd h LEU 340 Ca -0.36 0.21 0.21 0.00 0.84 0.00 0.00 57.88 58.78 2pfd h LEU 340 Cb 1.24 0.58 -0.14 0.00 0.37 0.00 0.00 40.66 42.71 2pfd h LEU 340 CO 0.34 -0.34 0.11 -0.09 -0.34 0.00 0.00 178.44 178.12 2pfd h ARG 341 N -0.28 0.14 0.35 1.25 2.43 -1.99 -0.16 114.38 116.12 2pfd h ARG 341 Ca 0.16 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.32 2pfd h ARG 341 Cb 0.56 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 30.07 2pfd h ARG 341 CO -0.58 0.09 -0.31 0.00 -1.51 0.00 0.00 179.97 177.67 2pfd h ALA 342 N 1.76 -0.67 -0.23 2.80 0.00 -0.54 -0.40 119.26 121.98 2pfd h ALA 342 Ca 0.49 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.34 2pfd h ALA 342 Cb 0.93 0.42 -0.06 0.00 0.00 0.00 0.00 17.79 19.08 2pfd h ALA 342 CO -0.68 -0.91 -0.18 0.35 0.00 0.00 0.00 179.25 177.84 2pfd h PHE 343 N -0.67 -0.45 0.19 0.00 3.57 0.36 -2.97 116.94 116.98 2pfd h PHE 343 Ca -0.02 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2pfd h PHE 343 Cb 0.59 0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.57 2pfd h PHE 343 CO -0.17 -0.25 -0.09 -0.24 -2.23 0.00 0.00 178.31 175.33 2pfd h VAL 344 N -0.17 0.83 -0.60 1.41 3.04 -0.99 -2.47 116.25 117.29 2pfd h VAL 344 Ca 0.13 -0.05 -0.36 0.00 -1.01 0.00 0.00 66.70 65.41 2pfd h VAL 344 Cb 0.37 0.86 -0.13 0.00 -2.01 0.00 0.00 31.29 30.38 2pfd h VAL 344 CO -0.33 0.01 0.08 0.54 -1.01 0.00 0.00 177.57 176.86 2pfd n ARG 345 N -5.19 2.18 0.11 4.17 1.74 -0.17 -3.14 116.66 116.36 2pfd n ARG 345 Ca -0.09 -1.72 0.00 0.00 -0.77 0.00 0.00 57.85 55.27 2pfd n ARG 345 Cb 0.13 -2.03 0.00 0.00 -1.02 0.00 0.00 32.46 29.55 2pfd n ARG 345 CO 0.00 0.00 0.00 -1.91 -1.52 0.00 0.00 177.63 174.20 2pfd n GLU 346 N 1.49 0.00 -0.29 5.56 4.07 -1.16 -4.67 120.64 125.64 2pfd n GLU 346 Ca 0.44 0.00 0.07 0.00 -0.06 0.00 0.00 57.16 57.61 2pfd n GLU 346 Cb 0.69 0.00 0.18 0.00 -0.06 0.00 0.00 31.44 32.25 2pfd n GLU 346 CO 0.00 0.00 0.00 -0.39 -0.06 0.00 0.00 177.13 176.68 2pfd h VAL 347 N 0.00 0.23 0.00 6.31 -1.51 -1.39 0.84 116.25 120.73 2pfd h VAL 347 Ca 0.00 -0.02 0.00 0.00 -1.23 0.00 0.00 66.70 65.45 2pfd h VAL 347 Cb 0.00 0.16 0.00 0.00 -2.13 0.00 0.00 31.29 29.32 2pfd h VAL 347 CO 0.00 0.01 0.00 0.61 -1.23 0.00 0.00 177.57 176.96 2pfd n GLY 348 N -1.46 -0.32 3.78 5.19 0.00 -1.19 -4.47 105.19 106.72 2pfd n GLY 348 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 2pfd n GLY 348 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pfd s ALA 349 N -1.75 1.71 -1.02 4.61 0.00 0.29 -4.80 121.76 120.80 2pfd s ALA 349 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.42 2pfd s ALA 349 Cb 0.00 -3.03 0.00 0.00 0.00 0.00 0.00 23.12 20.09 2pfd s ALA 349 CO 0.00 -2.35 0.00 -2.13 0.00 0.00 0.00 175.76 171.28 2pfd n ARG 350 N -3.81 0.00 -1.58 0.00 3.00 -1.26 -4.67 116.66 108.34 2pfd n ARG 350 Ca 0.07 0.00 -0.43 0.00 -0.00 0.00 0.00 57.85 57.49 2pfd n ARG 350 Cb 0.59 -0.92 -0.03 0.00 0.00 0.00 0.00 32.46 32.10 2pfd n ARG 350 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.63 176.50 2pfd n SER 351 N 0.12 3.10 0.24 6.15 3.41 -1.26 -4.77 113.62 120.60 2pfd n SER 351 Ca 0.00 0.15 0.09 0.00 -0.26 0.00 0.00 58.87 58.85 2pfd n SER 351 Cb 0.00 -1.54 0.61 0.00 -0.26 0.00 0.00 64.21 63.02 2pfd n SER 351 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2pfd h ALA 352 N 15.32 1.46 -3.00 7.33 0.00 -1.90 -3.43 119.26 135.04 2pfd h ALA 352 Ca -0.39 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.38 2pfd h ALA 352 Cb 1.25 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2pfd h ALA 352 CO 0.98 0.21 0.00 0.00 0.00 0.00 0.00 179.25 180.44 2pfd n ALA 353 N -2.39 0.00 -1.35 0.00 0.00 -1.26 -4.69 120.51 110.81 2pfd n ALA 353 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.09 2pfd n ALA 353 Cb 0.25 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.78 2pfd n ALA 353 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2pfd s PRO 354 N 0.00 2.30 0.00 0.00 0.04 -1.26 -4.96 135.00 131.13 2pfd s PRO 354 Ca 0.00 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.60 2pfd s PRO 354 Cb 0.00 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.67 2pfd s PRO 354 CO 0.00 -1.67 0.00 0.41 0.04 0.00 0.00 177.00 175.78 2pfd n GLY 355 N -0.09 4.43 6.13 0.56 0.00 -1.26 -4.64 105.19 110.32 2pfd n GLY 355 Ca 0.12 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2pfd n GLY 355 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pfd n GLY 356 N -1.99 0.39 0.36 -0.02 0.00 -1.26 -1.78 105.19 100.89 2pfd n GLY 356 Ca 0.00 0.53 0.18 0.00 0.00 0.00 0.00 46.02 46.73 2pfd n GLY 356 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2pfd h GLY 357 N 0.00 0.00 0.00 -0.02 0.00 -1.97 0.27 103.07 101.35 2pfd h GLY 357 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 2pfd h GLY 357 CO 0.00 0.00 -0.34 0.23 0.00 0.00 0.00 176.54 176.43 2pfd h SER 358 N 0.00 0.00 -0.07 0.19 0.87 -1.73 -3.02 113.55 109.79 2pfd h SER 358 Ca 0.11 -0.45 -0.01 0.00 -1.23 0.00 0.00 61.79 60.21 2pfd h SER 358 Cb 0.84 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.79 2pfd h SER 358 CO -0.00 0.91 0.03 1.62 -0.53 0.00 0.00 176.83 178.86 2pfd h VAL 359 N -1.00 1.06 -0.12 2.23 3.04 -1.62 -0.74 116.25 119.09 2pfd h VAL 359 Ca -0.07 -0.19 0.03 0.00 -1.01 0.00 0.00 66.70 65.46 2pfd h VAL 359 Cb 0.69 0.94 -0.06 0.00 -2.01 0.00 0.00 31.29 30.85 2pfd h VAL 359 CO -0.04 0.07 -0.54 0.00 -1.01 0.00 0.00 177.57 176.05 2pfd h ALA 360 N 1.88 -0.88 -0.53 3.17 0.00 -0.58 -0.00 119.26 122.31 2pfd h ALA 360 Ca 0.04 -0.06 0.10 0.00 0.00 0.00 0.00 54.91 54.99 2pfd h ALA 360 Cb 0.06 0.99 -0.08 0.00 0.00 0.00 0.00 17.79 18.76 2pfd h ALA 360 CO -0.00 -1.09 0.07 0.00 0.00 0.00 0.00 179.25 178.23 2pfd h ALA 361 N -0.28 0.58 -0.22 0.00 0.00 -1.05 -1.94 119.26 116.35 2pfd h ALA 361 Ca 0.03 0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 2pfd h ALA 361 Cb 0.69 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 2pfd h ALA 361 CO -0.43 -0.34 -0.17 0.00 0.00 0.00 0.00 179.25 178.32 2pfd h ALA 362 N 1.44 0.32 -0.84 0.00 0.00 -0.96 0.41 119.26 119.63 2pfd h ALA 362 Ca 0.27 -0.34 0.07 0.00 0.00 0.00 0.00 54.91 54.92 2pfd h ALA 362 Cb 0.40 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.06 2pfd h ALA 362 CO -0.39 0.23 0.55 0.28 0.00 0.00 0.00 179.25 179.92 2pfd h VAL 363 N 0.21 1.04 -0.16 0.00 2.07 -0.92 0.38 116.25 118.87 2pfd h VAL 363 Ca 0.04 -0.31 -0.15 0.00 0.82 0.00 0.00 66.70 67.09 2pfd h VAL 363 Cb 0.70 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.50 2pfd h VAL 363 CO 0.04 0.17 -0.55 0.00 0.02 0.00 0.00 177.57 177.25 2pfd h ALA 364 N 1.55 0.75 -0.00 1.67 0.00 -0.91 -1.05 119.26 121.27 2pfd h ALA 364 Ca 0.37 -0.51 -0.17 0.00 0.00 0.00 0.00 54.91 54.60 2pfd h ALA 364 Cb 0.25 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2pfd h ALA 364 CO -0.14 0.69 -0.78 0.00 0.00 0.00 0.00 179.25 179.03 2pfd h ALA 365 N 1.04 0.70 -0.45 0.00 0.00 0.05 -1.40 119.26 119.20 2pfd h ALA 365 Ca 0.01 -0.69 -0.05 0.00 0.00 0.00 0.00 54.91 54.18 2pfd h ALA 365 Cb 1.08 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2pfd h ALA 365 CO 0.10 0.93 0.08 -0.07 0.00 0.00 0.00 179.25 180.29 2pfd h LEU 366 N 0.03 0.63 0.95 0.00 -0.00 -0.13 -2.53 115.31 114.27 2pfd h LEU 366 Ca -0.02 -0.11 -0.05 0.00 -0.00 0.00 0.00 57.88 57.71 2pfd h LEU 366 Cb 1.37 -0.17 0.01 0.00 -0.00 0.00 0.00 40.66 41.87 2pfd h LEU 366 CO 0.11 0.65 -0.46 1.23 -0.00 0.00 0.00 178.44 179.97 2pfd h GLY 367 N 0.89 -1.33 0.30 0.83 0.00 -0.15 -2.45 103.07 101.15 2pfd h GLY 367 Ca 0.15 0.49 0.06 0.00 0.00 0.00 0.00 47.33 48.03 2pfd h GLY 367 CO 0.00 -0.48 -0.17 0.00 0.00 0.00 0.00 176.54 175.89 2pfd h ALA 368 N -1.37 -0.01 -0.77 3.60 0.00 -1.37 -2.21 119.26 117.13 2pfd h ALA 368 Ca -0.13 0.08 0.12 0.00 0.00 0.00 0.00 54.91 54.98 2pfd h ALA 368 Cb 0.98 0.37 -0.05 0.00 0.00 0.00 0.00 17.79 19.09 2pfd h ALA 368 CO 0.21 -0.59 0.50 0.00 0.00 0.00 0.00 179.25 179.38 2pfd h ALA 369 N 0.97 1.90 0.11 0.00 0.00 -1.41 0.15 119.26 120.98 2pfd h ALA 369 Ca 0.13 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2pfd h ALA 369 Cb 0.36 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2pfd h ALA 369 CO -0.33 -0.08 -0.05 -0.07 0.00 0.00 0.00 179.25 178.72 2pfd h LEU 370 N 0.60 -0.13 -0.45 0.00 3.38 -0.90 -3.03 115.31 114.78 2pfd h LEU 370 Ca 0.36 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.31 2pfd h LEU 370 Cb 0.60 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 2pfd h LEU 370 CO -0.13 -0.06 0.29 0.00 0.09 0.00 0.00 178.44 178.62 2pfd h ALA 371 N 0.71 0.58 0.00 1.53 0.00 -0.79 -1.78 119.26 119.50 2pfd h ALA 371 Ca -0.02 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2pfd h ALA 371 Cb 0.14 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2pfd h ALA 371 CO 0.03 0.05 0.00 0.45 0.00 0.00 0.00 179.25 179.78 2pfd n SER 372 N -4.75 0.00 0.00 0.00 2.88 0.30 -1.79 113.62 110.26 2pfd n SER 372 Ca 0.01 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.55 2pfd n SER 372 Cb 0.04 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.50 2pfd n SER 372 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 2pfd n VAL 374 N 0.13 0.00 -0.13 2.46 0.31 -0.67 -1.93 118.33 118.50 2pfd n VAL 374 Ca 0.00 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 2pfd n VAL 374 Cb 0.00 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 32.97 2pfd n VAL 374 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 2pfd h GLY 375 N 0.00 0.55 -3.46 2.92 0.00 -1.62 0.32 103.07 101.78 2pfd h GLY 375 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 47.33 47.22 2pfd h GLY 375 CO 0.00 0.01 -0.03 -1.06 0.00 0.00 0.00 176.54 175.46 2pfd n GLN 376 N -5.02 0.89 0.00 4.80 6.02 -0.81 -2.88 117.38 120.38 2pfd n GLN 376 Ca 0.03 -0.15 0.00 0.00 -0.01 0.00 0.00 57.00 56.87 2pfd n GLN 376 Cb 0.17 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 30.15 2pfd n GLN 376 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2pfd n THR 378 N 1.83 0.00 -4.54 5.09 -1.04 0.11 -4.67 114.28 111.07 2pfd n THR 378 Ca 0.07 0.00 -0.25 0.00 -2.04 0.00 0.00 64.05 61.82 2pfd n THR 378 Cb 0.43 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.84 2pfd n THR 378 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 2pfd s TYR 379 N 0.00 2.29 0.00 -1.42 5.04 -1.14 -4.81 117.35 117.31 2pfd s TYR 379 Ca 0.00 -0.68 0.00 0.00 -2.44 0.00 0.00 57.07 53.95 2pfd s TYR 379 Cb 0.00 -1.47 0.00 0.00 0.35 0.00 0.00 41.96 40.84 2pfd s TYR 379 CO 0.00 0.38 0.00 0.41 -1.34 0.00 0.00 175.55 175.00 2pfd n GLY 380 N -0.80 2.95 0.00 8.97 0.00 -1.26 -4.93 105.19 110.12 2pfd n GLY 380 Ca -0.05 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2pfd n GLY 380 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2pfd n ARG 381 N 8.66 0.00 -1.16 1.61 0.63 -1.26 -4.68 116.66 120.45 2pfd n ARG 381 Ca 0.00 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.56 2pfd n ARG 381 Cb 0.00 0.00 0.04 0.00 0.45 0.00 0.00 32.46 32.95 2pfd n ARG 381 CO 0.00 0.00 0.00 -2.13 -2.51 0.00 0.00 177.63 172.99 2pfd n ARG 382 N 0.00 0.08 0.00 -0.14 0.63 -1.26 -2.89 116.66 113.09 2pfd n ARG 382 Ca 0.00 0.04 0.00 0.00 -0.92 0.00 0.00 57.85 56.97 2pfd n ARG 382 Cb 0.00 -1.29 0.00 0.00 0.45 0.00 0.00 32.46 31.62 2pfd n ARG 382 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2pfd n GLN 383 N 0.98 0.00 -0.15 -0.14 10.64 -1.26 -4.78 117.38 122.68 2pfd n GLN 383 Ca 0.06 0.00 0.08 0.00 -1.83 0.00 0.00 57.00 55.30 2pfd n GLN 383 Cb 0.51 0.00 0.24 0.00 -0.86 0.00 0.00 30.24 30.13 2pfd n GLN 383 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2pfd n PHE 384 N 0.00 0.39 -0.24 2.61 0.99 -1.14 -4.50 117.46 115.56 2pfd n PHE 384 Ca 0.00 -0.19 0.04 0.00 -0.00 0.00 0.00 57.45 57.29 2pfd n PHE 384 Cb 0.00 0.00 0.14 0.00 -1.00 0.00 0.00 39.48 38.62 2pfd n PHE 384 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 2pfd h ASP 385 N 2.20 -0.33 0.01 4.37 5.19 -1.84 0.24 116.42 126.26 2pfd h ASP 385 Ca 0.00 0.18 0.00 0.00 -0.62 0.00 0.00 57.03 56.59 2pfd h ASP 385 Cb 0.50 0.33 0.00 0.00 0.18 0.00 0.00 39.33 40.33 2pfd h ASP 385 CO 0.00 -0.16 0.00 0.00 -3.12 0.00 0.00 179.24 175.96 2pfd n HIS 386 N -5.33 0.00 0.14 4.55 1.44 -1.26 -0.40 115.22 114.35 2pfd n HIS 386 Ca 0.12 0.00 0.02 0.00 -2.01 0.00 0.00 57.72 55.85 2pfd n HIS 386 Cb 0.43 -0.25 -0.00 0.00 0.12 0.00 0.00 29.99 30.30 2pfd n HIS 386 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2pfd n LEU 387 N -1.25 0.75 -0.26 2.39 4.77 0.82 -4.72 117.00 119.52 2pfd n LEU 387 Ca 0.00 -0.77 0.06 0.00 -0.03 0.00 0.00 56.01 55.27 2pfd n LEU 387 Cb 0.00 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.29 2pfd n LEU 387 CO 0.00 0.17 0.98 -0.78 -1.33 0.00 0.00 177.39 176.43 2pfd h ASP 388 N 0.35 0.17 -0.27 -1.43 1.82 -0.60 -1.13 116.42 115.32 2pfd h ASP 388 Ca 0.00 0.13 0.02 0.00 -0.39 0.00 0.00 57.03 56.79 2pfd h ASP 388 Cb 0.11 0.14 -0.03 0.00 0.68 0.00 0.00 39.33 40.23 2pfd h ASP 388 CO 0.00 0.03 0.11 0.77 -1.61 0.00 0.00 179.24 178.54 2pfd h SER 389 N 0.36 0.14 0.00 2.28 4.64 -1.84 -0.54 113.55 118.58 2pfd h SER 389 Ca 0.43 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.77 2pfd h SER 389 Cb 0.70 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2pfd h SER 389 CO -0.46 0.11 0.00 0.35 -0.87 0.00 0.00 176.83 175.96 2pfd n THR 390 N -5.01 0.23 0.00 2.95 -2.24 -0.43 -2.72 114.28 107.06 2pfd n THR 390 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2pfd n THR 390 Cb 0.09 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 67.81 2pfd n THR 390 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2pfd n ARG 392 N 0.65 0.00 0.07 -0.78 1.74 -0.21 -2.53 116.66 115.59 2pfd n ARG 392 Ca 0.00 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.00 2pfd n ARG 392 Cb 0.15 0.00 -0.09 0.00 -1.02 0.00 0.00 32.46 31.50 2pfd n ARG 392 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 2pfd h ARG 393 N 0.00 0.05 0.00 5.56 2.43 -1.76 -3.41 114.38 117.25 2pfd h ARG 393 Ca 0.00 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 2pfd h ARG 393 Cb 0.00 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.58 2pfd h ARG 393 CO 0.00 0.99 -0.98 1.47 -1.51 0.00 0.00 179.97 179.95 2pfd n LEU 394 N -3.43 0.00 -0.30 3.80 -0.00 -1.05 -4.61 117.00 111.41 2pfd n LEU 394 Ca -0.01 0.00 0.07 0.00 -0.00 0.00 0.00 56.01 56.07 2pfd n LEU 394 Cb 0.92 0.00 0.23 0.00 -0.00 0.00 0.00 43.42 44.56 2pfd n LEU 394 CO 0.48 0.00 1.11 0.40 -0.00 0.00 0.00 177.39 179.37 2pfd h ILE 395 N 0.00 0.74 0.06 1.47 2.04 -1.82 -3.26 117.51 116.74 2pfd h ILE 395 Ca 0.00 -0.22 -0.00 0.00 1.00 0.00 0.00 64.86 65.64 2pfd h ILE 395 Cb 0.19 0.04 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 2pfd h ILE 395 CO 0.00 0.12 -0.04 -0.65 0.00 0.00 0.00 178.15 177.58 2pfd h PRO 396 N 0.65 -0.09 -1.01 2.37 0.11 -1.81 -2.29 132.00 129.92 2pfd h PRO 396 Ca 0.47 0.01 0.39 0.00 0.11 0.00 0.00 66.00 66.98 2pfd h PRO 396 Cb 0.65 0.02 -0.15 0.00 0.11 0.00 0.00 31.00 31.63 2pfd h PRO 396 CO -0.36 -0.06 0.59 -0.35 -0.21 0.00 0.00 178.00 177.61 2pfd n PRO 397 N -2.40 -0.05 0.16 1.05 -0.04 -1.23 -0.11 135.00 132.38 2pfd n PRO 397 Ca -0.01 1.19 -0.12 0.00 -0.04 0.00 0.00 63.50 64.52 2pfd n PRO 397 Cb 0.04 -2.21 -0.07 0.00 -0.04 0.00 0.00 33.50 31.22 2pfd n PRO 397 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2pfd h PHE 398 N 0.00 -0.44 -0.24 0.54 -1.00 -1.63 0.12 116.94 114.29 2pfd h PHE 398 Ca 0.77 -0.01 0.06 0.00 2.81 0.00 0.00 57.97 61.60 2pfd h PHE 398 Cb 2.19 0.14 -0.06 0.00 3.61 0.00 0.00 35.95 41.83 2pfd h PHE 398 CO -0.01 -0.11 -0.18 1.25 -1.61 0.00 0.00 178.31 177.65 2pfd h HIS 399 N -0.96 -0.46 -0.22 -0.55 2.76 0.09 0.99 115.15 116.81 2pfd h HIS 399 Ca -0.05 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.14 2pfd h HIS 399 Cb 0.52 0.24 -0.01 0.00 1.55 0.00 0.00 27.41 29.71 2pfd h HIS 399 CO 0.03 -0.25 0.07 0.00 -1.30 0.00 0.00 177.93 176.47 2pfd h ALA 400 N 0.96 0.30 -0.99 5.26 0.00 -0.64 -2.59 119.26 121.56 2pfd h ALA 400 Ca 0.14 -0.14 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2pfd h ALA 400 Cb 0.38 -0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 2pfd h ALA 400 CO -0.35 -0.07 0.64 0.00 0.00 0.00 0.00 179.25 179.48 2pfd h ALA 401 N 0.89 1.26 -0.10 0.00 0.00 -0.82 -2.21 119.26 118.29 2pfd h ALA 401 Ca 0.07 -0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.93 2pfd h ALA 401 Cb 0.25 -0.40 -0.06 0.00 0.00 0.00 0.00 17.79 17.57 2pfd h ALA 401 CO -0.00 0.67 -0.53 1.03 0.00 0.00 0.00 179.25 180.42 2pfd h SER 402 N 1.35 -1.67 -0.50 0.00 0.87 0.13 -1.18 113.55 112.56 2pfd h SER 402 Ca 0.36 0.19 0.01 0.00 -1.23 0.00 0.00 61.79 61.13 2pfd h SER 402 Cb -0.13 0.65 -0.03 0.00 -0.44 0.00 0.00 62.40 62.45 2pfd h SER 402 CO -0.08 -0.48 0.33 0.00 -0.53 0.00 0.00 176.83 176.07 2pfd h ALA 403 N -0.37 1.68 -0.45 6.23 0.00 -1.37 -1.61 119.26 123.37 2pfd h ALA 403 Ca 0.03 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2pfd h ALA 403 Cb 0.67 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 2pfd h ALA 403 CO -0.41 0.28 -0.05 0.37 0.00 0.00 0.00 179.25 179.44 2pfd h GLN 404 N 0.64 0.78 0.04 0.00 4.15 -0.67 -0.21 115.11 119.83 2pfd h GLN 404 Ca 0.19 -0.23 -0.26 0.00 0.77 0.00 0.00 58.65 59.12 2pfd h GLN 404 Cb -0.02 -0.08 0.02 0.00 0.21 0.00 0.00 27.48 27.60 2pfd h GLN 404 CO -0.04 0.82 -1.07 -0.07 -1.93 0.00 0.00 178.83 176.53 2pfd h LEU 405 N 0.71 0.74 -1.14 -2.39 3.38 -0.88 -2.85 115.31 112.89 2pfd h LEU 405 Ca 0.13 -0.63 0.09 0.00 0.09 0.00 0.00 57.88 57.57 2pfd h LEU 405 Cb 0.51 -0.23 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 2pfd h LEU 405 CO 0.03 1.43 0.59 0.74 0.09 0.00 0.00 178.44 181.32 2pfd h THR 406 N 0.29 0.99 0.00 0.22 2.02 -1.00 0.15 112.91 115.58 2pfd h THR 406 Ca -0.13 -0.33 -0.01 0.00 0.77 0.00 0.00 66.41 66.71 2pfd h THR 406 Cb 1.73 -0.05 -0.00 0.00 -1.74 0.00 0.00 68.15 68.08 2pfd h THR 406 CO 0.20 0.18 -0.06 -1.28 0.37 0.00 0.00 175.52 174.92 2pfd h SER 407 N 0.96 0.00 0.82 4.18 0.87 -0.94 -2.90 113.55 116.54 2pfd h SER 407 Ca 0.42 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.98 2pfd h SER 407 Cb 0.35 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 2pfd h SER 407 CO -0.18 0.06 0.00 -0.07 -0.53 0.00 0.00 176.83 176.11 2pfd h LEU 408 N 0.00 0.00 -0.78 2.23 3.38 -0.46 -1.87 115.31 117.81 2pfd h LEU 408 Ca -0.00 0.00 0.16 0.00 0.09 0.00 0.00 57.88 58.13 2pfd h LEU 408 Cb 0.54 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.19 2pfd h LEU 408 CO 0.01 0.00 0.31 0.58 0.09 0.00 0.00 178.44 179.43 2pfd h VAL 409 N 0.00 0.62 0.00 1.22 2.07 -1.47 -1.47 116.25 117.22 2pfd h VAL 409 Ca 0.00 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.37 2pfd h VAL 409 Cb 0.41 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2pfd h VAL 409 CO 0.00 0.08 0.00 0.47 0.02 0.00 0.00 177.57 178.14 2pfd n ASP 410 N -5.02 0.00 0.00 0.57 10.43 -0.71 -2.70 116.55 119.12 2pfd n ASP 410 Ca 0.16 0.64 0.00 0.00 2.57 0.00 0.00 54.79 58.16 2pfd n ASP 410 Cb 0.46 -0.27 0.00 0.00 1.84 0.00 0.00 41.12 43.14 2pfd n ASP 410 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2pfd n ALA 411 N -1.32 0.00 0.00 2.24 0.00 -1.20 0.19 120.51 120.42 2pfd n ALA 411 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 2pfd n ALA 411 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 2pfd n ALA 411 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2pfd h ASP 412 N 0.00 -0.27 -0.43 0.00 3.58 -1.30 0.44 116.42 118.44 2pfd h ASP 412 Ca 0.00 0.06 -0.07 0.00 0.42 0.00 0.00 57.03 57.44 2pfd h ASP 412 Cb 0.00 0.14 -0.02 0.00 1.72 0.00 0.00 39.33 41.17 2pfd h ASP 412 CO 0.00 -0.12 0.04 0.00 -2.88 0.00 0.00 179.24 176.28 2pfd h ALA 413 N 1.00 1.12 0.50 -0.78 0.00 0.24 -2.11 119.26 119.22 2pfd h ALA 413 Ca 0.07 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 2pfd h ALA 413 Cb 0.20 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2pfd h ALA 413 CO -0.17 0.57 -0.24 -0.09 0.00 0.00 0.00 179.25 179.32 2pfd h ARG 414 N 0.77 -0.65 -0.67 0.00 2.43 -0.75 -2.38 114.38 113.13 2pfd h ARG 414 Ca 0.15 0.04 0.06 0.00 -0.81 0.00 0.00 59.98 59.43 2pfd h ARG 414 Cb 0.41 0.15 -0.09 0.00 -0.42 0.00 0.00 29.97 30.02 2pfd h ARG 414 CO 0.01 -0.36 -0.47 0.00 -1.51 0.00 0.00 179.97 177.64 2pfd h ALA 415 N -0.47 -0.52 -0.69 2.80 0.00 -0.85 -1.25 119.26 118.27 2pfd h ALA 415 Ca -0.07 0.07 0.14 0.00 0.00 0.00 0.00 54.91 55.05 2pfd h ALA 415 Cb 0.59 1.23 -0.10 0.00 0.00 0.00 0.00 17.79 19.51 2pfd h ALA 415 CO 0.11 -0.83 0.16 0.35 0.00 0.00 0.00 179.25 179.04 2pfd h PHE 416 N -0.10 0.25 -0.04 0.00 3.57 -1.40 0.33 116.94 119.54 2pfd h PHE 416 Ca 0.11 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 2pfd h PHE 416 Cb 0.38 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.11 2pfd h PHE 416 CO -0.92 -0.07 -0.37 0.00 -2.23 0.00 0.00 178.31 174.72 2pfd h ALA 417 N 1.57 1.30 -0.05 2.41 0.00 -0.72 0.17 119.26 123.93 2pfd h ALA 417 Ca 0.38 -0.36 -0.24 0.00 0.00 0.00 0.00 54.91 54.70 2pfd h ALA 417 Cb 0.63 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.35 2pfd h ALA 417 CO -0.48 0.51 -0.92 0.00 0.00 0.00 0.00 179.25 178.36 2pfd h ALA 418 N 1.55 0.29 -0.83 0.00 0.00 -0.24 -0.28 119.26 119.74 2pfd h ALA 418 Ca 0.01 -0.67 -0.04 0.00 0.00 0.00 0.00 54.91 54.21 2pfd h ALA 418 Cb 0.70 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.46 2pfd h ALA 418 CO 0.05 0.73 0.37 0.00 0.00 0.00 0.00 179.25 180.39 2pfd h LEU 420 N 1.19 0.75 -1.13 0.00 5.85 -0.63 -1.83 115.31 119.52 2pfd h LEU 420 Ca 0.28 -0.38 0.05 0.00 0.84 0.00 0.00 57.88 58.68 2pfd h LEU 420 Cb 0.17 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 40.93 2pfd h LEU 420 CO -0.03 0.96 0.60 1.23 -0.34 0.00 0.00 178.44 180.86 2pfd h GLY 421 N 0.54 1.33 0.53 3.75 0.00 -0.82 -1.92 103.07 106.47 2pfd h GLY 421 Ca 0.09 -0.43 -0.03 0.00 0.00 0.00 0.00 47.33 46.96 2pfd h GLY 421 CO 0.04 0.34 -0.25 0.00 0.00 0.00 0.00 176.54 176.67 2pfd h ALA 422 N 1.49 -1.01 -1.00 3.60 0.00 -1.20 -3.27 119.26 117.87 2pfd h ALA 422 Ca 0.38 -0.15 0.28 0.00 0.00 0.00 0.00 54.91 55.42 2pfd h ALA 422 Cb 0.12 0.27 -0.19 0.00 0.00 0.00 0.00 17.79 18.00 2pfd h ALA 422 CO -0.13 -0.95 0.06 -0.89 0.00 0.00 0.00 179.25 177.33 2pfd n ILE 423 N -4.22 -0.42 0.77 0.00 5.41 -0.70 -0.25 119.36 119.94 2pfd n ILE 423 Ca -0.09 2.18 0.00 0.00 1.00 0.00 0.00 62.75 65.85 2pfd n ILE 423 Cb 0.28 -3.21 0.00 0.00 -0.71 0.00 0.00 39.64 36.00 2pfd n ILE 423 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2pfd n LYS 424 N -5.48 0.77 -4.04 0.38 3.00 -0.74 -4.83 118.16 107.21 2pfd n LYS 424 Ca 0.24 0.00 -0.35 0.00 -0.00 0.00 0.00 58.31 58.21 2pfd n LYS 424 Cb 0.80 -1.27 -0.12 0.00 0.00 0.00 0.00 35.03 34.45 2pfd n LYS 424 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2pfd s LEU 425 N 0.00 3.47 0.00 3.14 1.43 0.65 -5.04 118.68 122.33 2pfd s LEU 425 Ca 0.00 -0.10 0.00 0.00 -1.03 0.00 0.00 54.13 53.00 2pfd s LEU 425 Cb 0.00 -1.88 0.00 0.00 0.03 0.00 0.00 46.19 44.34 2pfd s LEU 425 CO 0.00 0.09 0.00 -2.65 0.23 0.00 0.00 176.35 174.02 2pfd n PRO 426 N 4.06 0.00 0.00 1.29 -0.02 -1.26 -4.95 135.00 134.11 2pfd n PRO 426 Ca -0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.31 2pfd n PRO 426 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.00 2pfd n PRO 426 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2pfd n LYS 427 N 0.00 0.00 0.00 -0.52 4.81 -1.13 -5.08 118.16 116.24 2pfd n LYS 427 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2pfd n LYS 427 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2pfd n LYS 427 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2pfd n ASN 428 N 0.00 0.00 -4.81 3.14 3.02 -1.03 -4.68 115.26 110.89 2pfd n ASN 428 Ca 0.00 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.20 2pfd n ASN 428 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 2pfd n ASN 428 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2pfd s THR 429 N 0.00 4.43 0.32 3.41 -4.23 -1.26 -4.81 115.64 113.50 2pfd s THR 429 Ca 0.00 1.45 0.05 0.00 -1.18 0.00 0.00 61.69 62.00 2pfd s THR 429 Cb 0.00 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.32 2pfd s THR 429 CO 0.00 0.02 1.85 1.55 -0.54 0.00 0.00 174.62 177.50 2pfd h PRO 430 N 2.85 0.83 -0.69 3.99 0.13 -1.99 0.90 132.00 138.02 2pfd h PRO 430 Ca -0.48 -0.05 0.02 0.00 -0.87 0.00 0.00 66.00 64.63 2pfd h PRO 430 Cb 1.19 -0.19 -0.04 0.00 0.13 0.00 0.00 31.00 32.09 2pfd h PRO 430 CO 0.64 0.55 0.44 1.49 -0.23 0.00 0.00 178.00 180.89 2pfd h GLU 431 N 0.86 0.84 -2.24 0.86 4.81 -1.98 -3.11 114.58 114.62 2pfd h GLU 431 Ca 0.47 -0.05 -0.57 0.00 -0.13 0.00 0.00 59.36 59.08 2pfd h GLU 431 Cb 0.59 -0.19 -0.42 0.00 0.63 0.00 0.00 28.75 29.36 2pfd h GLU 431 CO -0.24 0.56 -0.74 -1.91 -0.73 0.00 0.00 179.01 175.95 2pfd n GLU 432 N -4.65 2.83 0.02 1.92 2.13 0.22 -3.99 120.64 119.12 2pfd n GLU 432 Ca 0.07 -4.60 0.00 0.00 0.66 0.00 0.00 57.16 53.29 2pfd n GLU 432 Cb 0.06 -2.14 0.00 0.00 0.27 0.00 0.00 31.44 29.63 2pfd n GLU 432 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2pfd n ARG 433 N -0.15 0.00 0.00 5.31 3.00 -0.66 -2.48 116.66 121.68 2pfd n ARG 433 Ca 0.30 0.00 0.07 0.00 -0.00 0.00 0.00 57.85 58.22 2pfd n ARG 433 Cb 0.44 -0.29 0.40 0.00 0.00 0.00 0.00 32.46 33.01 2pfd n ARG 433 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2pfd n ASP 434 N -2.94 0.00 -0.03 6.15 10.43 -1.18 -0.09 116.55 128.89 2pfd n ASP 434 Ca 0.00 -0.13 -0.03 0.00 2.57 0.00 0.00 54.79 57.21 2pfd n ASP 434 Cb 0.23 -0.18 -0.04 0.00 1.84 0.00 0.00 41.12 42.96 2pfd n ASP 434 CO 0.00 0.00 0.00 -1.14 -1.07 0.00 0.00 177.20 174.99 2pfd n ARG 435 N -1.18 3.06 -0.05 -1.24 0.63 -1.26 -3.82 116.66 112.81 2pfd n ARG 435 Ca 0.09 -0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.90 2pfd n ARG 435 Cb 0.09 -1.14 -0.05 0.00 0.45 0.00 0.00 32.46 31.81 2pfd n ARG 435 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 2pfd h ARG 436 N 0.00 0.27 -0.22 -0.14 2.43 -1.72 -2.79 114.38 112.21 2pfd h ARG 436 Ca -0.14 -0.07 0.05 0.00 -0.81 0.00 0.00 59.98 59.00 2pfd h ARG 436 Cb 1.32 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 30.79 2pfd h ARG 436 CO 0.01 0.43 -0.09 0.00 -1.51 0.00 0.00 179.97 178.81 2pfd h THR 437 N 0.07 0.70 -0.78 0.20 1.03 -0.72 -2.27 112.91 111.13 2pfd h THR 437 Ca 0.05 0.00 0.14 0.00 -0.01 0.00 0.00 66.41 66.59 2pfd h THR 437 Cb 0.29 0.70 -0.05 0.00 -1.07 0.00 0.00 68.15 68.01 2pfd h THR 437 CO 0.00 0.00 0.51 0.00 -0.01 0.00 0.00 175.52 176.03 2pfd h ALA 439 N 1.64 0.35 -0.64 0.00 0.00 -1.20 -3.10 119.26 116.30 2pfd h ALA 439 Ca 0.38 -0.97 -0.04 0.00 0.00 0.00 0.00 54.91 54.28 2pfd h ALA 439 Cb 0.80 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 2pfd h ALA 439 CO -0.13 1.24 0.24 1.25 0.00 0.00 0.00 179.25 181.84 2pfd h LEU 440 N 0.01 0.90 -0.06 0.00 5.85 -0.57 0.41 115.31 121.86 2pfd h LEU 440 Ca -0.07 -0.18 0.02 0.00 0.84 0.00 0.00 57.88 58.49 2pfd h LEU 440 Cb 1.84 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 42.62 2pfd h LEU 440 CO 0.14 0.84 -0.04 -0.61 -0.34 0.00 0.00 178.44 178.43 2pfd h GLN 441 N 0.91 -0.04 0.00 1.25 5.75 -1.54 0.76 115.11 122.20 2pfd h GLN 441 Ca 0.21 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.71 2pfd h GLN 441 Cb 0.23 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.79 2pfd h GLN 441 CO -0.01 -0.03 -0.00 1.49 -2.65 0.00 0.00 178.83 177.62 2pfd h GLU 442 N -0.04 0.00 0.00 1.69 4.22 -1.40 0.04 114.58 119.09 2pfd h GLU 442 Ca 0.04 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.48 2pfd h GLU 442 Cb 0.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 2pfd h GLU 442 CO -0.08 0.00 0.00 0.41 -2.18 0.00 0.00 179.01 177.16 2pfd n GLY 443 N -1.25 -2.77 0.23 1.92 0.00 0.14 -3.28 105.19 100.17 2pfd n GLY 443 Ca -0.03 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.08 2pfd n GLY 443 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pfd n LEU 444 N -0.30 -0.09 -0.28 0.99 4.77 -0.14 0.39 117.00 122.34 2pfd n LEU 444 Ca 0.00 1.13 -0.07 0.00 -0.03 0.00 0.00 56.01 57.04 2pfd n LEU 444 Cb 0.00 -0.40 -0.06 0.00 -2.33 0.00 0.00 43.42 40.62 2pfd n LEU 444 CO 0.00 -1.13 0.33 0.54 -1.33 0.00 0.00 177.39 175.79 2pfd n ARG 445 N -4.90 -0.29 0.08 3.23 1.74 -0.01 1.00 116.66 117.50 2pfd n ARG 445 Ca 0.15 1.02 -0.13 0.00 -0.77 0.00 0.00 57.85 58.12 2pfd n ARG 445 Cb 0.49 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.35 2pfd n ARG 445 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2pfd h GLN 446 N 0.00 -0.13 -0.90 5.56 4.20 -0.05 -1.02 115.11 122.77 2pfd h GLN 446 Ca 0.11 0.01 0.24 0.00 0.06 0.00 0.00 58.65 59.08 2pfd h GLN 446 Cb 0.28 0.03 -0.14 0.00 0.30 0.00 0.00 27.48 27.95 2pfd h GLN 446 CO -0.64 0.04 0.31 0.00 -0.67 0.00 0.00 178.83 177.87 2pfd h ALA 447 N 0.60 1.40 0.27 3.87 0.00 -0.03 -0.65 119.26 124.72 2pfd h ALA 447 Ca -0.01 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 2pfd h ALA 447 Cb 0.23 0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2pfd h ALA 447 CO 0.02 -0.46 -0.13 0.28 0.00 0.00 0.00 179.25 178.96 2pfd h VAL 448 N 0.25 0.73 -0.78 0.00 2.07 0.80 -3.34 116.25 115.97 2pfd h VAL 448 Ca 0.58 -0.71 0.23 0.00 0.82 0.00 0.00 66.70 67.61 2pfd h VAL 448 Cb 1.18 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.01 2pfd h VAL 448 CO -0.63 0.14 0.61 0.00 0.02 0.00 0.00 177.57 177.71 2pfd h ALA 449 N -0.23 2.69 0.34 1.67 0.00 0.26 -2.70 119.26 121.29 2pfd h ALA 449 Ca -0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 2pfd h ALA 449 Cb 0.51 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2pfd h ALA 449 CO 0.06 -1.01 -0.16 -0.24 0.00 0.00 0.00 179.25 177.90 2pfd h VAL 450 N 0.00 0.07 -0.74 0.00 3.04 -1.61 -1.15 116.25 115.86 2pfd h VAL 450 Ca 0.37 -0.70 0.17 0.00 -1.01 0.00 0.00 66.70 65.54 2pfd h VAL 450 Cb 1.58 0.12 -0.13 0.00 -2.01 0.00 0.00 31.29 30.86 2pfd h VAL 450 CO -0.00 0.02 0.03 -0.65 -1.01 0.00 0.00 177.57 175.96 2pfd h PRO 451 N -1.11 0.12 -0.49 4.17 0.11 -1.70 0.30 132.00 133.42 2pfd h PRO 451 Ca -0.05 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 66.15 2pfd h PRO 451 Cb 0.38 -0.03 -0.10 0.00 0.11 0.00 0.00 31.00 31.36 2pfd h PRO 451 CO 0.08 0.08 -0.30 1.25 -0.21 0.00 0.00 178.00 178.90 2pfd h LEU 452 N 0.12 -1.01 0.36 2.35 7.12 -1.55 0.38 115.31 123.09 2pfd h LEU 452 Ca 0.41 0.20 -0.00 0.00 0.13 0.00 0.00 57.88 58.61 2pfd h LEU 452 Cb 0.71 0.50 -0.03 0.00 -0.53 0.00 0.00 40.66 41.32 2pfd h LEU 452 CO -0.63 -0.29 -0.44 0.50 -0.13 0.00 0.00 178.44 177.44 2pfd h LYS 453 N -0.18 -0.81 -1.05 1.25 3.11 0.35 -0.07 116.57 119.17 2pfd h LYS 453 Ca 0.21 0.05 0.39 0.00 -2.81 0.00 0.00 60.65 58.50 2pfd h LYS 453 Cb 0.52 0.18 -0.16 0.00 -1.00 0.00 0.00 32.23 31.77 2pfd h LYS 453 CO -0.59 -0.54 0.59 1.25 -2.81 0.00 0.00 179.45 177.35 2pfd h LEU 454 N -0.84 0.37 0.00 5.20 5.85 0.90 0.63 115.31 127.42 2pfd h LEU 454 Ca -0.03 0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.92 2pfd h LEU 454 Cb 0.77 0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.01 2pfd h LEU 454 CO -0.11 -0.32 0.00 0.00 -0.34 0.00 0.00 178.44 177.67 2pfd n ALA 455 N -2.30 -0.19 -0.18 1.25 0.00 0.12 -2.63 120.51 116.57 2pfd n ALA 455 Ca 0.36 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.81 2pfd n ALA 455 Cb 1.22 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.71 2pfd n ALA 455 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2pfd n GLU 456 N -1.89 -0.09 -0.11 0.00 -0.58 -0.11 -0.33 120.64 117.53 2pfd n GLU 456 Ca 0.00 0.75 -0.10 0.00 -0.42 0.00 0.00 57.16 57.39 2pfd n GLU 456 Cb 0.00 -1.12 -0.03 0.00 -0.57 0.00 0.00 31.44 29.72 2pfd n GLU 456 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2pfd h THR 457 N 0.00 1.23 -0.05 2.62 1.03 0.11 -2.78 112.91 115.06 2pfd h THR 457 Ca 0.19 -0.77 -0.08 0.00 -0.01 0.00 0.00 66.41 65.75 2pfd h THR 457 Cb 0.31 1.12 -0.01 0.00 -1.07 0.00 0.00 68.15 68.51 2pfd h THR 457 CO -0.49 0.25 -0.35 1.62 -0.01 0.00 0.00 175.52 176.55 2pfd h VAL 458 N 0.35 1.27 0.00 0.00 3.04 -0.44 -2.78 116.25 117.69 2pfd h VAL 458 Ca 0.10 -1.27 0.00 0.00 -1.01 0.00 0.00 66.70 64.52 2pfd h VAL 458 Cb 0.31 1.62 0.00 0.00 -2.01 0.00 0.00 31.29 31.21 2pfd h VAL 458 CO 0.00 0.37 0.00 -1.28 -1.01 0.00 0.00 177.57 175.65 2pfd h SER 459 N 0.08 0.00 1.10 3.17 0.87 -0.68 -2.28 113.55 115.82 2pfd h SER 459 Ca 0.01 0.00 -0.17 0.00 -1.23 0.00 0.00 61.79 60.40 2pfd h SER 459 Cb 0.66 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.59 2pfd h SER 459 CO 0.05 0.00 -0.94 1.56 -0.53 0.00 0.00 176.83 176.97 2pfd h GLN 460 N 0.00 0.00 0.00 2.24 4.20 -1.43 -3.34 115.11 116.78 2pfd h GLN 460 Ca 0.00 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.65 2pfd h GLN 460 Cb 0.20 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 2pfd h GLN 460 CO 0.00 0.61 -0.26 -0.07 -0.67 0.00 0.00 178.83 178.44 2pfd h LEU 461 N 0.00 0.00 -0.80 1.46 4.07 -1.53 -3.36 115.31 115.15 2pfd h LEU 461 Ca -0.06 0.00 0.07 0.00 0.08 0.00 0.00 57.88 57.97 2pfd h LEU 461 Cb 1.60 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 43.24 2pfd h LEU 461 CO 0.08 0.26 -0.49 -0.50 -1.08 0.00 0.00 178.44 176.71 2pfd h TRP 462 N 0.00 -1.59 -0.82 1.13 -0.00 -1.68 0.20 115.95 113.19 2pfd h TRP 462 Ca -0.00 0.11 -0.02 0.00 -0.00 0.00 0.00 58.89 58.97 2pfd h TRP 462 Cb 0.87 0.80 -0.04 0.00 -0.00 0.00 0.00 29.16 30.79 2pfd h TRP 462 CO 0.00 -0.32 0.42 -1.00 -0.00 0.00 0.00 178.44 177.54 2pfd h PRO 463 N -0.03 1.16 -0.41 0.49 0.13 -1.87 0.19 132.00 131.68 2pfd h PRO 463 Ca 0.13 -0.15 -0.10 0.00 -0.87 0.00 0.00 66.00 65.01 2pfd h PRO 463 Cb 0.36 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 31.25 2pfd h PRO 463 CO -0.77 0.87 -0.15 0.00 -0.23 0.00 0.00 178.00 177.73 2pfd h ALA 464 N 1.30 0.98 -0.80 -0.56 0.00 -1.61 -1.25 119.26 117.33 2pfd h ALA 464 Ca 0.29 -0.33 0.04 0.00 0.00 0.00 0.00 54.91 54.90 2pfd h ALA 464 Cb 0.07 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2pfd h ALA 464 CO -0.04 0.60 0.50 1.25 0.00 0.00 0.00 179.25 181.57 2pfd h LEU 465 N 0.67 0.82 -0.60 0.00 5.85 0.98 0.71 115.31 123.73 2pfd h LEU 465 Ca 0.11 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.82 2pfd h LEU 465 Cb 0.63 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 2pfd h LEU 465 CO 0.04 0.56 0.35 -0.61 -0.34 0.00 0.00 178.44 178.44 2pfd h GLN 466 N 0.97 0.83 0.00 1.25 5.75 0.07 -0.63 115.11 123.35 2pfd h GLN 466 Ca 0.33 -0.08 -0.20 0.00 -0.15 0.00 0.00 58.65 58.55 2pfd h GLN 466 Cb 0.05 -0.17 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 2pfd h GLN 466 CO -0.13 0.61 -0.88 1.49 -2.65 0.00 0.00 178.83 177.27 2pfd h GLU 467 N 0.82 0.18 0.00 1.69 4.81 -0.92 -2.98 114.58 118.17 2pfd h GLU 467 Ca 0.22 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 59.17 2pfd h GLU 467 Cb 0.00 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 2pfd h GLU 467 CO -0.04 0.95 -0.38 1.25 -0.73 0.00 0.00 179.01 180.05 2pfd h LEU 468 N 0.10 0.00 -0.63 1.64 5.85 -0.47 -2.37 115.31 119.43 2pfd h LEU 468 Ca -0.04 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 2pfd h LEU 468 Cb 1.51 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.54 2pfd h LEU 468 CO 0.13 0.38 -0.06 0.00 -0.34 0.00 0.00 178.44 178.56 2pfd h ALA 469 N 1.62 0.98 -0.28 1.25 0.00 -0.97 -3.27 119.26 118.58 2pfd h ALA 469 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2pfd h ALA 469 Cb 0.73 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2pfd h ALA 469 CO 0.05 0.07 0.00 1.04 0.00 0.00 0.00 179.25 180.41 2pfd n GLN 470 N -3.13 0.00 0.00 0.00 1.13 -0.89 -4.54 117.38 109.95 2pfd n GLN 470 Ca 0.02 0.45 0.00 0.00 -1.94 0.00 0.00 57.00 55.54 2pfd n GLN 470 Cb 0.46 -1.31 0.00 0.00 0.11 0.00 0.00 30.24 29.49 2pfd n GLN 470 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2pfd n GLY 472 N 5.00 -2.87 0.00 0.00 0.00 -1.23 -4.79 105.19 101.29 2pfd n GLY 472 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2pfd n GLY 472 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2pfd n ASN 473 N 0.00 0.00 0.00 1.61 2.85 -1.26 -4.77 115.26 113.69 2pfd n ASN 473 Ca -0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2pfd n ASN 473 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2pfd n ASN 473 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 2pfd n LEU 474 N 0.00 0.00 0.00 1.20 0.00 -1.26 -4.92 117.00 112.02 2pfd n LEU 474 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 56.01 56.15 2pfd n LEU 474 Cb 0.00 0.00 0.69 0.00 0.00 0.00 0.00 43.42 44.11 2pfd n LEU 474 CO 0.00 0.00 0.98 -0.24 0.00 0.00 0.00 177.39 178.13 2pfd n SER 475 N 0.00 0.00 -1.68 1.96 2.88 -1.26 -2.23 113.62 113.29 2pfd n SER 475 Ca 0.00 0.01 0.08 0.00 -1.33 0.00 0.00 58.87 57.62 2pfd n SER 475 Cb 0.00 -0.33 0.37 0.00 -0.75 0.00 0.00 64.21 63.51 2pfd n SER 475 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2pfd h LEU 477 N 3.69 -1.70 -0.61 0.00 5.85 -1.80 0.40 115.31 121.14 2pfd h LEU 477 Ca 0.00 0.23 0.05 0.00 0.84 0.00 0.00 57.88 59.01 2pfd h LEU 477 Cb 1.79 0.71 -0.07 0.00 0.37 0.00 0.00 40.66 43.45 2pfd h LEU 477 CO 0.40 -0.32 -0.36 -1.54 -0.34 0.00 0.00 178.44 176.27 2pfd n SER 478 N -5.04 -0.65 -0.19 1.25 3.41 -1.26 -0.87 113.62 110.28 2pfd n SER 478 Ca -0.02 1.27 0.14 0.00 -0.26 0.00 0.00 58.87 60.00 2pfd n SER 478 Cb 0.29 -0.23 0.47 0.00 -0.26 0.00 0.00 64.21 64.47 2pfd n SER 478 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2pfd h ASP 479 N 0.00 0.47 -0.18 4.04 3.32 -0.64 0.33 116.42 123.76 2pfd h ASP 479 Ca 0.10 0.03 -0.13 0.00 0.02 0.00 0.00 57.03 57.04 2pfd h ASP 479 Cb 0.25 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2pfd h ASP 479 CO -0.57 0.24 -0.40 -0.07 -1.72 0.00 0.00 179.24 176.72 2pfd h LEU 480 N 0.50 0.66 0.03 1.55 -0.00 0.75 -1.58 115.31 117.22 2pfd h LEU 480 Ca 0.39 -0.56 0.02 0.00 -0.00 0.00 0.00 57.88 57.73 2pfd h LEU 480 Cb 0.79 -0.19 -0.03 0.00 -0.00 0.00 0.00 40.66 41.24 2pfd h LEU 480 CO -0.14 1.10 -0.16 1.56 -0.00 0.00 0.00 178.44 180.80 2pfd h GLN 481 N 0.25 -0.26 -0.56 1.13 4.20 0.29 0.45 115.11 120.62 2pfd h GLN 481 Ca 0.00 0.02 0.10 0.00 0.06 0.00 0.00 58.65 58.83 2pfd h GLN 481 Cb 1.00 0.06 -0.08 0.00 0.30 0.00 0.00 27.48 28.76 2pfd h GLN 481 CO 0.09 -0.18 0.13 0.28 -0.67 0.00 0.00 178.83 178.48 2pfd h VAL 482 N -0.27 0.70 -0.04 -0.54 2.07 -1.38 0.45 116.25 117.23 2pfd h VAL 482 Ca 0.04 -0.09 0.03 0.00 0.82 0.00 0.00 66.70 67.50 2pfd h VAL 482 Cb 0.32 0.40 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 2pfd h VAL 482 CO -0.13 0.05 -0.14 0.00 0.02 0.00 0.00 177.57 177.36 2pfd h ALA 483 N 1.43 -0.13 0.02 1.67 0.00 -0.05 0.84 119.26 123.04 2pfd h ALA 483 Ca 0.28 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.24 2pfd h ALA 483 Cb 0.39 0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 2pfd h ALA 483 CO -0.35 -0.62 -0.18 0.00 0.00 0.00 0.00 179.25 178.10 2pfd h ALA 484 N 0.77 -0.24 -0.43 0.00 0.00 0.19 -1.48 119.26 118.08 2pfd h ALA 484 Ca 0.06 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2pfd h ALA 484 Cb 0.31 0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2pfd h ALA 484 CO -0.17 -0.68 0.24 0.87 0.00 0.00 0.00 179.25 179.51 2pfd h LYS 485 N -0.30 0.58 -0.16 0.00 1.79 0.14 -2.30 116.57 116.31 2pfd h LYS 485 Ca 0.05 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 58.35 2pfd h LYS 485 Cb 0.36 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 2pfd h LYS 485 CO -0.16 0.42 -0.35 0.00 -1.08 0.00 0.00 179.45 178.29 2pfd h ALA 486 N 1.68 0.26 -0.16 3.86 0.00 0.16 -2.48 119.26 122.58 2pfd h ALA 486 Ca 0.15 -0.43 -0.02 0.00 0.00 0.00 0.00 54.91 54.61 2pfd h ALA 486 Cb 0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2pfd h ALA 486 CO -0.03 0.32 -0.01 -0.07 0.00 0.00 0.00 179.25 179.46 2pfd h LEU 487 N 0.16 0.21 0.04 0.00 4.07 -1.20 -0.74 115.31 117.86 2pfd h LEU 487 Ca 0.00 -0.02 -0.00 0.00 0.08 0.00 0.00 57.88 57.94 2pfd h LEU 487 Cb 0.95 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.63 2pfd h LEU 487 CO 0.08 0.27 -0.02 -0.08 -1.08 0.00 0.00 178.44 177.60 2pfd h GLU 488 N 0.23 -0.06 0.00 1.13 4.81 -1.10 -2.46 114.58 117.14 2pfd h GLU 488 Ca 0.06 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.22 2pfd h GLU 488 Cb 0.18 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 2pfd h GLU 488 CO 0.00 0.20 -0.32 1.79 -0.73 0.00 0.00 179.01 179.96 2pfd h THR 489 N -0.32 0.72 -0.07 0.32 1.35 -1.23 -1.36 112.91 112.33 2pfd h THR 489 Ca -0.01 -1.43 0.04 0.00 -0.55 0.00 0.00 66.41 64.46 2pfd h THR 489 Cb 0.29 1.93 -0.06 0.00 -1.73 0.00 0.00 68.15 68.57 2pfd h THR 489 CO 0.01 0.31 -0.40 1.23 -0.25 0.00 0.00 175.52 176.42 2pfd h GLY 490 N 2.29 -0.69 1.59 5.82 0.00 -0.89 0.16 103.07 111.36 2pfd h GLY 490 Ca -0.00 0.49 -0.01 0.00 0.00 0.00 0.00 47.33 47.80 2pfd h GLY 490 CO 0.04 -0.23 0.18 -2.08 0.00 0.00 0.00 176.54 174.45 2pfd h VAL 491 N -0.51 1.14 0.58 4.60 2.07 -0.91 0.51 116.25 123.73 2pfd h VAL 491 Ca 0.07 -0.40 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 2pfd h VAL 491 Cb 0.62 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 31.03 2pfd h VAL 491 CO -0.35 0.16 -0.36 -0.26 0.02 0.00 0.00 177.57 176.78 2pfd h PHE 492 N 0.55 -0.95 -0.44 1.57 -1.00 -0.32 0.60 116.94 116.96 2pfd h PHE 492 Ca 0.14 -0.01 0.08 0.00 2.81 0.00 0.00 57.97 60.99 2pfd h PHE 492 Cb 0.07 0.34 -0.10 0.00 3.61 0.00 0.00 35.95 39.87 2pfd h PHE 492 CO 0.00 -0.54 -0.34 0.78 -1.61 0.00 0.00 178.31 176.60 2pfd h GLY 493 N -0.89 -0.25 0.01 -1.45 0.00 -0.22 0.03 103.07 100.30 2pfd h GLY 493 Ca -0.07 0.43 0.06 0.00 0.00 0.00 0.00 47.33 47.74 2pfd h GLY 493 CO 0.07 -0.20 -0.35 0.00 0.00 0.00 0.00 176.54 176.05 2pfd h ALA 494 N 0.78 -0.38 -0.26 3.60 0.00 -0.56 -1.29 119.26 121.15 2pfd h ALA 494 Ca 0.18 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.16 2pfd h ALA 494 Cb 0.54 0.70 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 2pfd h ALA 494 CO -0.57 -0.81 -0.28 -0.92 0.00 0.00 0.00 179.25 176.66 2pfd h TYR 495 N -0.38 -0.88 -0.43 0.00 5.03 0.18 -2.00 116.97 118.49 2pfd h TYR 495 Ca 0.11 0.05 0.09 0.00 2.58 0.00 0.00 58.73 61.56 2pfd h TYR 495 Cb 0.57 0.42 -0.08 0.00 1.55 0.00 0.00 36.73 39.18 2pfd h TYR 495 CO -0.47 -0.24 -0.11 0.74 -1.32 0.00 0.00 178.16 176.76 2pfd h PHE 496 N -0.16 -0.23 -0.13 -3.82 -1.00 -0.31 -1.35 116.94 109.94 2pfd h PHE 496 Ca 0.05 0.04 -0.03 0.00 2.81 0.00 0.00 57.97 60.84 2pfd h PHE 496 Cb 0.28 0.17 -0.01 0.00 3.61 0.00 0.00 35.95 40.00 2pfd h PHE 496 CO -0.73 -0.19 -0.04 -0.91 -1.61 0.00 0.00 178.31 174.84 2pfd h ASN 497 N -0.00 0.17 0.46 2.17 4.21 -0.87 -1.33 115.58 120.37 2pfd h ASN 497 Ca 0.21 -0.02 -0.02 0.00 1.21 0.00 0.00 56.30 57.67 2pfd h ASN 497 Cb 0.32 -0.04 0.00 0.00 -1.12 0.00 0.00 38.32 37.48 2pfd h ASN 497 CO -0.44 0.24 -0.22 0.58 -1.29 0.00 0.00 177.43 176.29 2pfd h VAL 498 N 0.18 0.00 0.00 2.81 2.07 -0.52 -3.21 116.25 117.58 2pfd h VAL 498 Ca 0.04 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.43 2pfd h VAL 498 Cb 0.19 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 29.96 2pfd h VAL 498 CO 0.01 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.78 2pfd n LEU 499 N -4.01 0.00 -0.51 2.57 4.32 -0.77 -1.10 117.00 117.49 2pfd n LEU 499 Ca -0.08 0.86 0.44 0.00 -0.02 0.00 0.00 56.01 57.22 2pfd n LEU 499 Cb 0.24 -0.41 0.78 0.00 -1.62 0.00 0.00 43.42 42.41 2pfd n LEU 499 CO 0.18 -0.41 1.40 -0.29 -1.22 0.00 0.00 177.39 177.05 2pfd h ILE 500 N 0.00 0.21 0.02 -0.08 2.10 -1.39 0.38 117.51 118.75 2pfd h ILE 500 Ca 0.00 -0.00 -0.04 0.00 1.08 0.00 0.00 64.86 65.90 2pfd h ILE 500 Cb 0.00 0.20 0.00 0.00 -1.09 0.00 0.00 36.82 35.93 2pfd h ILE 500 CO 0.00 0.00 -0.15 0.78 -1.08 0.00 0.00 178.15 177.70 2pfd h ASN 501 N 0.01 0.10 0.00 2.19 4.21 -1.11 -3.22 115.58 117.75 2pfd h ASN 501 Ca 0.76 -0.92 0.00 0.00 1.21 0.00 0.00 56.30 57.35 2pfd h ASN 501 Cb 3.00 -0.03 0.00 0.00 -1.12 0.00 0.00 38.32 40.17 2pfd h ASN 501 CO -0.03 1.01 0.45 -0.07 -1.29 0.00 0.00 177.43 177.50 2pfd h LEU 502 N -0.79 0.00 -0.16 1.61 4.07 0.65 0.35 115.31 121.03 2pfd h LEU 502 Ca -0.02 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.94 2pfd h LEU 502 Cb 1.05 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.78 2pfd h LEU 502 CO 0.03 0.00 0.10 0.11 -1.08 0.00 0.00 178.44 177.60 2pfd h LYS 503 N 0.00 0.20 -5.26 1.13 1.57 -1.40 -3.44 116.57 109.36 2pfd h LYS 503 Ca 0.00 -0.01 -0.70 0.00 -1.87 0.00 0.00 60.65 58.07 2pfd h LYS 503 Cb 0.91 -0.05 -0.14 0.00 0.08 0.00 0.00 32.23 33.03 2pfd h LYS 503 CO 0.00 0.14 1.57 -0.51 -0.57 0.00 0.00 179.45 180.07 2pfd s ASP 504 N -5.33 6.89 -0.28 0.86 1.01 0.11 -5.15 116.67 114.77 2pfd s ASP 504 Ca -0.13 -2.55 -0.24 0.00 0.71 0.00 0.00 52.55 50.33 2pfd s ASP 504 Cb 0.08 -2.47 0.13 0.00 1.01 0.00 0.00 42.92 41.67 2pfd s ASP 504 CO 0.69 -0.99 1.07 0.42 0.21 0.00 0.00 175.17 176.56 2pfd s THR 506 N 2.88 0.00 0.00 -1.27 -4.23 -1.26 -4.97 115.64 106.78 2pfd s THR 506 Ca 0.45 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.96 2pfd s THR 506 Cb -0.01 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.83 2pfd s THR 506 CO 0.00 0.00 0.00 -0.67 -0.54 0.00 0.00 174.62 173.41 2pfd n ASP 507 N 2.29 0.00 -0.10 3.99 2.03 -1.26 -5.01 116.55 118.49 2pfd n ASP 507 Ca -0.13 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.21 2pfd n ASP 507 Cb 0.56 0.00 0.34 0.00 -0.72 0.00 0.00 41.12 41.30 2pfd n ASP 507 CO 0.00 0.00 0.00 0.44 -1.92 0.00 0.00 177.20 175.72 2pfd h ASP 508 N 0.00 0.65 0.00 1.67 5.19 -2.01 -0.94 116.42 120.98 2pfd h ASP 508 Ca 0.00 -0.02 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 2pfd h ASP 508 Cb 0.00 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.35 2pfd h ASP 508 CO 0.00 0.47 0.00 0.52 -3.12 0.00 0.00 179.24 177.11 2pfd n VAL 509 N -4.45 0.00 -0.34 -1.35 0.31 -1.26 0.48 118.33 111.73 2pfd n VAL 509 Ca 0.05 1.27 -0.00 0.00 -0.01 0.00 0.00 64.34 65.65 2pfd n VAL 509 Cb 0.05 -2.02 0.05 0.00 -0.91 0.00 0.00 33.84 31.00 2pfd n VAL 509 CO 0.00 0.00 0.00 0.33 -1.32 0.00 0.00 176.83 175.84 2pfd n PHE 510 N -1.67 0.06 0.00 3.52 -0.00 -1.04 -0.91 117.46 117.41 2pfd n PHE 510 Ca 0.00 1.10 0.00 0.00 -0.00 0.00 0.00 57.45 58.55 2pfd n PHE 510 Cb 0.00 -0.85 0.00 0.00 -0.00 0.00 0.00 39.48 38.63 2pfd n PHE 510 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 2pfd n LYS 511 N -5.33 0.00 -0.11 -4.13 5.02 -0.38 -0.66 118.16 112.56 2pfd n LYS 511 Ca 0.10 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.42 2pfd n LYS 511 Cb 0.37 -0.48 0.07 0.00 -0.02 0.00 0.00 35.03 34.97 2pfd n LYS 511 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 2pfd n GLU 512 N 0.00 -0.03 0.22 1.97 2.13 0.18 0.13 120.64 125.24 2pfd n GLU 512 Ca 0.00 0.47 -0.15 0.00 0.66 0.00 0.00 57.16 58.14 2pfd n GLU 512 Cb 0.00 -0.74 -0.08 0.00 0.27 0.00 0.00 31.44 30.89 2pfd n GLU 512 CO 0.00 0.00 0.00 -0.22 -0.41 0.00 0.00 177.13 176.50 2pfd h LYS 513 N 0.00 -0.49 -0.45 5.31 3.64 -0.95 -2.57 116.57 121.06 2pfd h LYS 513 Ca 0.17 0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.57 2pfd h LYS 513 Cb 0.32 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.23 2pfd h LYS 513 CO -0.30 -0.31 0.21 1.15 -2.27 0.00 0.00 179.45 177.93 2pfd h THR 514 N -0.54 1.19 -0.77 1.00 2.02 0.33 -1.12 112.91 115.02 2pfd h THR 514 Ca -0.05 -0.53 0.17 0.00 0.77 0.00 0.00 66.41 66.76 2pfd h THR 514 Cb 0.41 0.70 -0.14 0.00 -1.74 0.00 0.00 68.15 67.38 2pfd h THR 514 CO 0.09 0.21 -0.07 -0.09 0.37 0.00 0.00 175.52 176.03 2pfd h ARG 515 N 0.59 0.06 0.07 6.66 2.43 -0.64 0.11 114.38 123.66 2pfd h ARG 515 Ca 0.16 -0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.18 2pfd h ARG 515 Cb 0.13 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 29.68 2pfd h ARG 515 CO -0.02 0.04 -0.61 1.25 -1.51 0.00 0.00 179.97 179.12 2pfd h HIS 516 N 0.06 0.48 -0.52 2.20 2.76 -1.04 -2.74 115.15 116.35 2pfd h HIS 516 Ca 0.40 -0.31 0.09 0.00 -2.20 0.00 0.00 60.37 58.35 2pfd h HIS 516 Cb 0.69 -0.03 -0.07 0.00 1.55 0.00 0.00 27.41 29.54 2pfd h HIS 516 CO -0.49 1.19 0.12 -0.09 -1.30 0.00 0.00 177.93 177.36 2pfd h ARG 517 N -0.36 0.25 -0.46 5.26 9.65 -0.99 -2.36 114.38 125.37 2pfd h ARG 517 Ca -0.10 -0.02 0.01 0.00 -1.10 0.00 0.00 59.98 58.78 2pfd h ARG 517 Cb 1.41 -0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 29.91 2pfd h ARG 517 CO 0.12 0.17 0.29 0.97 2.80 0.00 0.00 179.97 184.31 2pfd h ILE 518 N 0.26 1.08 -0.22 1.20 6.09 -0.72 -2.78 117.51 122.43 2pfd h ILE 518 Ca 0.26 -0.20 -0.04 0.00 -1.37 0.00 0.00 64.86 63.51 2pfd h ILE 518 Cb 0.36 0.45 -0.01 0.00 0.47 0.00 0.00 36.82 38.09 2pfd h ILE 518 CO -0.33 0.11 -0.03 0.77 -3.07 0.00 0.00 178.15 175.59 2pfd h SER 519 N 0.58 0.40 -0.57 2.19 4.64 -1.12 -1.36 113.55 118.31 2pfd h SER 519 Ca 0.17 -0.34 0.11 0.00 -0.47 0.00 0.00 61.79 61.27 2pfd h SER 519 Cb -0.03 -0.11 -0.11 0.00 -0.31 0.00 0.00 62.40 61.84 2pfd h SER 519 CO -0.06 0.65 -0.17 0.77 -0.87 0.00 0.00 176.83 177.15 2pfd h SER 520 N 0.14 -0.63 -0.77 4.97 4.64 -1.45 0.73 113.55 121.18 2pfd h SER 520 Ca 0.06 0.18 0.06 0.00 -0.47 0.00 0.00 61.79 61.62 2pfd h SER 520 Cb 0.46 0.39 -0.06 0.00 -0.31 0.00 0.00 62.40 62.88 2pfd h SER 520 CO 0.02 -0.21 0.45 -0.07 -0.87 0.00 0.00 176.83 176.14 2pfd h LEU 521 N -0.03 0.68 -0.03 5.97 3.38 -1.15 0.97 115.31 125.10 2pfd h LEU 521 Ca 0.27 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.27 2pfd h LEU 521 Cb 0.45 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 41.09 2pfd h LEU 521 CO -0.60 0.43 0.02 0.25 0.09 0.00 0.00 178.44 178.62 2pfd h LEU 522 N 0.82 0.04 -0.13 1.67 5.85 0.01 0.15 115.31 123.71 2pfd h LEU 522 Ca 0.34 -0.10 0.04 0.00 0.84 0.00 0.00 57.88 59.01 2pfd h LEU 522 Cb 0.20 -0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.17 2pfd h LEU 522 CO -0.19 0.12 -0.20 -0.61 -0.34 0.00 0.00 178.44 177.23 2pfd h GLN 523 N -0.05 -0.24 -0.67 1.25 5.75 0.14 0.44 115.11 121.72 2pfd h GLN 523 Ca 0.01 0.02 0.08 0.00 -0.15 0.00 0.00 58.65 58.61 2pfd h GLN 523 Cb 0.10 0.06 -0.06 0.00 1.07 0.00 0.00 27.48 28.64 2pfd h GLN 523 CO -0.00 -0.16 0.34 1.49 -2.65 0.00 0.00 178.83 177.85 2pfd h GLU 524 N -0.25 0.58 -0.00 1.69 4.81 0.11 -0.16 114.58 121.36 2pfd h GLU 524 Ca 0.10 -0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.32 2pfd h GLU 524 Cb 0.40 -0.13 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 2pfd h GLU 524 CO -0.28 0.39 -0.17 0.00 -0.73 0.00 0.00 179.01 178.22 2pfd h ALA 525 N 1.39 -0.20 -0.21 2.92 0.00 0.34 0.27 119.26 123.77 2pfd h ALA 525 Ca 0.32 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.29 2pfd h ALA 525 Cb 0.30 0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.32 2pfd h ALA 525 CO -0.24 -0.66 -0.22 0.87 0.00 0.00 0.00 179.25 179.00 2pfd h LYS 526 N -0.28 -0.23 -0.05 0.00 1.57 0.14 -0.22 116.57 117.51 2pfd h LYS 526 Ca 0.06 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 2pfd h LYS 526 Cb 0.35 0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 2pfd h LYS 526 CO -0.16 -0.15 -0.08 1.79 -0.57 0.00 0.00 179.45 180.27 2pfd h THR 527 N -0.23 1.42 0.24 -0.16 1.35 -1.01 -3.20 112.91 111.31 2pfd h THR 527 Ca 0.13 -1.37 0.01 0.00 -0.55 0.00 0.00 66.41 64.63 2pfd h THR 527 Cb 0.43 2.22 -0.03 0.00 -1.73 0.00 0.00 68.15 69.04 2pfd h THR 527 CO -0.35 0.37 -0.30 -0.61 -0.25 0.00 0.00 175.52 174.39 2pfd h GLN 528 N -0.36 -0.57 -1.17 4.72 5.75 -0.27 -0.11 115.11 123.10 2pfd h GLN 528 Ca 0.00 0.04 0.37 0.00 -0.15 0.00 0.00 58.65 58.91 2pfd h GLN 528 Cb 0.65 0.13 -0.13 0.00 1.07 0.00 0.00 27.48 29.20 2pfd h GLN 528 CO 0.02 -0.38 0.73 0.00 -2.65 0.00 0.00 178.83 176.55 2pfd h ALA 529 N 0.02 2.42 -1.34 3.38 0.00 -1.15 -2.39 119.26 120.20 2pfd h ALA 529 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.03 2pfd h ALA 529 Cb 0.56 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2pfd h ALA 529 CO -0.10 -1.00 0.00 0.00 0.00 0.00 0.00 179.25 178.16 2pfd n ALA 530 N -2.45 -0.26 -0.31 0.00 0.00 -0.06 -2.39 120.51 115.04 2pfd n ALA 530 Ca 0.33 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.88 2pfd n ALA 530 Cb 1.19 0.03 0.29 0.00 0.00 0.00 0.00 19.45 20.95 2pfd n ALA 530 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 2pfd h LEU 531 N 0.00 0.43 -0.39 0.00 -0.00 -1.34 0.80 115.31 114.82 2pfd h LEU 531 Ca 0.00 0.13 0.04 0.00 -0.00 0.00 0.00 57.88 58.05 2pfd h LEU 531 Cb 0.00 0.08 -0.05 0.00 -0.00 0.00 0.00 40.66 40.69 2pfd h LEU 531 CO 0.00 0.09 -0.27 0.58 -0.00 0.00 0.00 178.44 178.84 2pfd h VAL 532 N 0.50 0.00 -0.94 0.15 2.07 -1.55 2.10 116.25 118.58 2pfd h VAL 532 Ca 0.54 0.00 0.20 0.00 0.82 0.00 0.00 66.70 68.26 2pfd h VAL 532 Cb 0.94 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 30.59 2pfd h VAL 532 CO -0.47 0.00 0.51 -0.07 0.02 0.00 0.00 177.57 177.56 2pfd h LEU 533 N -0.05 0.57 0.00 2.57 3.38 0.67 0.92 115.31 123.38 2pfd h LEU 533 Ca 0.06 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.16 2pfd h LEU 533 Cb 0.21 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.00 2pfd h LEU 533 CO -0.39 0.14 0.00 0.61 0.09 0.00 0.00 178.44 178.89 2pfd n GLY 534 N -1.32 -3.15 0.23 0.83 0.00 0.18 -1.43 105.19 100.54 2pfd n GLY 534 Ca 0.23 0.27 -0.00 0.00 0.00 0.00 0.00 46.02 46.51 2pfd n GLY 534 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2pfd n SER 535 N -0.89 -0.38 0.11 1.61 7.64 0.68 0.12 113.62 122.52 2pfd n SER 535 Ca 0.00 1.06 -0.13 0.00 1.01 0.00 0.00 58.87 60.81 2pfd n SER 535 Cb 0.00 -0.25 -0.06 0.00 -1.01 0.00 0.00 64.21 62.90 2pfd n SER 535 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2pfd h LEU 536 N 0.00 -0.74 -0.17 -3.43 3.38 -0.81 0.65 115.31 114.18 2pfd h LEU 536 Ca 0.22 0.09 0.05 0.00 0.09 0.00 0.00 57.88 58.32 2pfd h LEU 536 Cb 0.37 0.28 -0.06 0.00 0.09 0.00 0.00 40.66 41.34 2pfd h LEU 536 CO -0.60 -0.35 -0.23 -0.08 0.09 0.00 0.00 178.44 177.27 2pfd h GLU 537 N -0.46 -0.26 0.00 1.13 4.57 0.22 0.20 114.58 119.98 2pfd h GLU 537 Ca 0.03 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 2pfd h GLU 537 Cb 0.49 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 2pfd h GLU 537 CO -0.15 -0.17 0.00 0.00 -1.18 0.00 0.00 179.01 177.51 2pfd n ALA 538 N -2.74 1.50 0.02 2.92 0.00 -0.37 -2.29 120.51 119.56 2pfd n ALA 538 Ca -0.02 0.03 -0.09 0.00 0.00 0.00 0.00 53.44 53.36 2pfd n ALA 538 Cb 0.28 -1.27 -0.07 0.00 0.00 0.00 0.00 19.45 18.39 2pfd n ALA 538 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2pfd h ARG 539 N 0.00 -0.16 0.00 0.00 9.65 0.35 -3.45 114.38 120.76 2pfd h ARG 539 Ca 0.00 0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.89 2pfd h ARG 539 Cb 0.23 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 28.85 2pfd h ARG 539 CO 0.00 0.26 0.00 1.63 2.80 0.00 0.00 179.97 184.66 2pfd n LYS 540 N -4.86 0.00 0.00 0.20 5.02 -0.80 -5.09 118.16 112.62 2pfd n LYS 540 Ca -0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.22 2pfd n LYS 540 Cb 0.25 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.26 2pfd n LYS 540 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03