#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3aaw s LEU 3 N 0.00 1.79 -0.12 0.00 1.98 -1.26 0.79 118.68 121.85 3aaw s LEU 3 Ca 0.00 -0.49 0.03 0.00 -2.89 0.00 0.00 54.13 50.78 3aaw s LEU 3 Cb 0.00 -1.20 0.01 0.00 0.66 0.00 0.00 46.19 45.66 3aaw s LEU 3 CO 0.00 -0.01 -0.22 -0.69 -1.89 0.00 0.00 176.35 173.54 3aaw s VAL 4 N 1.19 2.00 -0.21 1.68 1.01 -0.01 -0.67 120.40 125.39 3aaw s VAL 4 Ca -0.01 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 60.90 3aaw s VAL 4 Cb -0.14 -1.76 -0.05 0.00 0.00 0.00 0.00 36.38 34.43 3aaw s VAL 4 CO -0.06 0.54 0.17 -0.69 0.00 0.00 0.00 175.10 175.06 3aaw s VAL 5 N 0.67 5.38 -0.17 2.92 1.01 -0.92 -1.63 120.40 127.67 3aaw s VAL 5 Ca -0.11 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.14 3aaw s VAL 5 Cb -0.16 -3.51 0.02 0.00 0.00 0.00 0.00 36.38 32.73 3aaw s VAL 5 CO 0.02 0.40 -0.21 -1.10 0.00 0.00 0.00 175.10 174.21 3aaw s GLN 6 N 0.58 2.99 -0.12 2.72 -0.21 0.07 0.52 119.66 126.20 3aaw s GLN 6 Ca 0.09 -0.83 -0.03 0.00 0.02 0.00 0.00 55.36 54.61 3aaw s GLN 6 Cb -0.12 -2.52 -0.03 0.00 1.00 0.00 0.00 33.01 31.34 3aaw s GLN 6 CO 0.01 -0.15 -0.02 0.21 -2.12 0.00 0.00 175.29 173.22 3aaw s LYS 7 N 1.14 3.35 -0.16 2.91 2.36 0.45 -0.84 119.74 128.95 3aaw s LYS 7 Ca 0.01 -0.48 0.02 0.00 -2.55 0.00 0.00 55.97 52.97 3aaw s LYS 7 Cb -0.14 -2.85 0.01 0.00 -1.05 0.00 0.00 37.83 33.81 3aaw s LYS 7 CO -0.09 0.45 -0.21 0.71 1.55 0.00 0.00 175.35 177.76 3aaw s TYR 8 N -0.19 2.68 0.99 4.03 2.02 0.20 -0.21 117.35 126.86 3aaw s TYR 8 Ca 0.04 -1.46 -0.16 0.00 -0.37 0.00 0.00 57.07 55.12 3aaw s TYR 8 Cb -0.13 -1.84 0.20 0.00 -0.40 0.00 0.00 41.96 39.79 3aaw s TYR 8 CO 0.02 -0.70 1.26 0.20 -1.57 0.00 0.00 175.55 174.77 3aaw s GLY 9 N 1.05 1.72 0.20 0.71 0.00 -0.68 -0.67 107.32 109.65 3aaw s GLY 9 Ca -0.01 -1.07 -0.11 0.00 0.00 0.00 0.00 44.72 43.53 3aaw s GLY 9 CO -0.07 -0.32 1.87 -1.33 0.00 0.00 0.00 173.10 173.26 3aaw h GLY 10 N -1.74 1.02 0.84 0.20 0.00 -1.85 -2.37 103.07 99.17 3aaw h GLY 10 Ca -0.45 -0.38 0.04 0.00 0.00 0.00 0.00 47.33 46.54 3aaw h GLY 10 CO 0.41 0.38 0.60 1.48 0.00 0.00 0.00 176.54 179.41 3aaw h SER 11 N 0.98 0.99 0.50 0.19 4.64 -1.93 -0.66 113.55 118.26 3aaw h SER 11 Ca 0.26 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 3aaw h SER 11 Cb -0.11 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 61.76 3aaw h SER 11 CO -0.06 0.67 0.00 0.28 -0.87 0.00 0.00 176.83 176.85 3aaw h SER 12 N 1.15 0.00 -0.54 4.97 0.02 -1.74 -3.22 113.55 114.19 3aaw h SER 12 Ca 0.38 0.00 -0.39 0.00 -0.84 0.00 0.00 61.79 60.94 3aaw h SER 12 Cb 0.05 0.00 -0.37 0.00 0.14 0.00 0.00 62.40 62.22 3aaw h SER 12 CO -0.13 0.00 -0.86 0.18 -1.14 0.00 0.00 176.83 174.87 3aaw n LEU 13 N -2.95 3.62 0.22 5.07 4.77 -0.39 -4.46 117.00 122.89 3aaw n LEU 13 Ca -0.01 -4.08 0.09 0.00 -0.03 0.00 0.00 56.01 51.99 3aaw n LEU 13 Cb 0.18 -0.15 0.49 0.00 -2.33 0.00 0.00 43.42 41.62 3aaw n LEU 13 CO 0.22 1.67 0.81 -0.33 -1.33 0.00 0.00 177.39 178.44 3aaw h GLU 14 N 2.07 0.00 -3.87 3.23 5.08 -1.46 -3.33 114.58 116.30 3aaw h GLU 14 Ca 0.17 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.43 3aaw h GLU 14 Cb 1.43 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.55 3aaw h GLU 14 CO 0.49 0.24 -0.33 -1.54 -1.00 0.00 0.00 179.01 176.87 3aaw s SER 15 N -6.29 0.06 0.24 1.42 1.04 -1.26 -4.75 113.70 104.16 3aaw s SER 15 Ca -0.01 -0.83 -0.05 0.00 0.48 0.00 0.00 55.95 55.55 3aaw s SER 15 Cb 0.11 0.41 0.37 0.00 0.10 0.00 0.00 66.02 67.02 3aaw s SER 15 CO 0.64 -0.86 1.81 0.00 0.98 0.00 0.00 173.24 175.81 3aaw h ALA 16 N 2.59 1.12 -0.51 5.32 0.00 -1.99 -0.05 119.26 125.73 3aaw h ALA 16 Ca -0.32 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3aaw h ALA 16 Cb 1.22 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.86 3aaw h ALA 16 CO 0.50 0.09 0.32 1.49 0.00 0.00 0.00 179.25 181.65 3aaw h GLU 17 N 0.77 0.69 -0.08 0.00 4.81 -1.99 -0.92 114.58 117.86 3aaw h GLU 17 Ca 0.38 -0.05 -0.14 0.00 -0.13 0.00 0.00 59.36 59.42 3aaw h GLU 17 Cb 0.33 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.55 3aaw h GLU 17 CO -0.24 0.48 -0.58 0.00 -0.73 0.00 0.00 179.01 177.95 3aaw h ARG 18 N 0.69 0.24 -0.67 1.92 3.08 -1.80 -0.91 114.38 116.93 3aaw h ARG 18 Ca 0.19 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 60.03 3aaw h ARG 18 Cb -0.04 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 3aaw h ARG 18 CO -0.04 0.75 0.23 0.82 -1.07 0.00 0.00 179.97 180.66 3aaw h ILE 19 N 0.18 1.25 -0.39 2.04 2.04 -0.71 -0.38 117.51 121.55 3aaw h ILE 19 Ca -0.00 -0.84 -0.11 0.00 1.00 0.00 0.00 64.86 64.91 3aaw h ILE 19 Cb 1.06 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 3aaw h ILE 19 CO 0.09 0.33 -0.18 0.03 0.00 0.00 0.00 178.15 178.42 3aaw h ARG 20 N 0.97 0.80 -0.17 2.37 3.08 -0.99 -0.65 114.38 119.79 3aaw h ARG 20 Ca 0.22 -0.35 0.03 0.00 0.07 0.00 0.00 59.98 59.95 3aaw h ARG 20 Cb 0.27 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 3aaw h ARG 20 CO -0.01 0.97 0.00 -0.97 -1.07 0.00 0.00 179.97 178.90 3aaw h ASN 21 N 0.61 -0.06 -0.71 7.04 -1.24 -1.01 -1.72 115.58 118.49 3aaw h ASN 21 Ca 0.09 0.04 0.05 0.00 0.71 0.00 0.00 56.30 57.19 3aaw h ASN 21 Cb 0.73 0.06 -0.05 0.00 0.73 0.00 0.00 38.32 39.79 3aaw h ASN 21 CO 0.05 -0.01 0.42 0.58 -1.29 0.00 0.00 177.43 177.18 3aaw h VAL 22 N 0.06 1.01 -0.80 2.57 2.07 -1.01 -1.84 116.25 118.31 3aaw h VAL 22 Ca 0.08 -0.27 0.06 0.00 0.82 0.00 0.00 66.70 67.39 3aaw h VAL 22 Cb 0.10 0.17 -0.06 0.00 -1.52 0.00 0.00 31.29 29.97 3aaw h VAL 22 CO -0.13 0.14 0.49 0.00 0.02 0.00 0.00 177.57 178.09 3aaw h ALA 23 N 1.35 1.09 -0.05 1.67 0.00 -0.43 0.25 119.26 123.13 3aaw h ALA 23 Ca 0.31 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.12 3aaw h ALA 23 Cb 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3aaw h ALA 23 CO -0.17 0.23 -0.40 1.49 0.00 0.00 0.00 179.25 180.40 3aaw h GLU 24 N 0.91 0.11 -0.37 0.00 4.22 -0.98 -0.48 114.58 117.99 3aaw h GLU 24 Ca 0.35 -0.05 -0.09 0.00 0.08 0.00 0.00 59.36 59.65 3aaw h GLU 24 Cb 0.15 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 3aaw h GLU 24 CO -0.17 0.50 -0.11 -0.09 -2.18 0.00 0.00 179.01 176.97 3aaw h ARG 25 N 0.10 0.72 -0.24 1.92 2.43 -0.32 -0.06 114.38 118.93 3aaw h ARG 25 Ca 0.01 -0.29 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 3aaw h ARG 25 Cb 0.75 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 3aaw h ARG 25 CO 0.06 0.88 0.16 0.82 -1.51 0.00 0.00 179.97 180.38 3aaw h ILE 26 N 0.52 1.07 -0.65 1.20 2.04 -0.29 -2.38 117.51 119.03 3aaw h ILE 26 Ca 0.09 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.74 3aaw h ILE 26 Cb 0.63 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.41 3aaw h ILE 26 CO 0.04 0.07 0.15 0.58 0.00 0.00 0.00 178.15 178.99 3aaw h VAL 27 N 0.32 1.26 -0.95 1.67 2.07 -0.97 -2.20 116.25 117.45 3aaw h VAL 27 Ca 0.09 -0.95 0.09 0.00 0.82 0.00 0.00 66.70 66.75 3aaw h VAL 27 Cb -0.02 0.63 -0.07 0.00 -1.52 0.00 0.00 31.29 30.31 3aaw h VAL 27 CO -0.02 0.36 0.61 0.00 0.02 0.00 0.00 177.57 178.54 3aaw h ALA 28 N 1.06 1.53 -0.46 1.67 0.00 -0.88 0.26 119.26 122.43 3aaw h ALA 28 Ca 0.20 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 3aaw h ALA 28 Cb 0.37 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 3aaw h ALA 28 CO 0.00 0.30 -0.17 1.15 0.00 0.00 0.00 179.25 180.53 3aaw h THR 29 N 1.02 1.27 0.13 0.00 2.02 -0.96 -0.33 112.91 116.05 3aaw h THR 29 Ca 0.43 -1.30 -0.01 0.00 0.77 0.00 0.00 66.41 66.31 3aaw h THR 29 Cb 0.32 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.82 3aaw h THR 29 CO -0.19 0.45 -0.06 0.50 0.37 0.00 0.00 175.52 176.59 3aaw h LYS 30 N 0.79 -0.17 -0.91 6.66 1.63 -0.76 -3.05 116.57 120.76 3aaw h LYS 30 Ca 0.12 0.01 0.12 0.00 -0.85 0.00 0.00 60.65 60.05 3aaw h LYS 30 Cb 0.71 0.04 -0.07 0.00 -0.60 0.00 0.00 32.23 32.30 3aaw h LYS 30 CO 0.05 0.03 0.59 0.87 -3.45 0.00 0.00 179.45 177.54 3aaw h LYS 31 N -0.34 0.81 0.00 1.90 1.57 -0.24 -0.33 116.57 119.93 3aaw h LYS 31 Ca -0.02 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 3aaw h LYS 31 Cb 0.27 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.40 3aaw h LYS 31 CO 0.03 0.53 0.00 0.00 -0.57 0.00 0.00 179.45 179.44 3aaw n ALA 32 N -2.40 1.91 -0.05 3.86 0.00 -0.16 -4.77 120.51 118.90 3aaw n ALA 32 Ca 0.17 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.55 3aaw n ALA 32 Cb 0.38 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.69 3aaw n ALA 32 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3aaw n GLY 33 N -0.25 1.51 3.54 0.00 0.00 -0.15 -5.08 105.19 104.76 3aaw n GLY 33 Ca 0.07 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3aaw n GLY 33 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3aaw s ASN 34 N -2.03 4.35 0.30 1.61 -0.87 -1.13 -4.61 114.94 112.56 3aaw s ASN 34 Ca 0.00 -0.16 -0.28 0.00 -1.57 0.00 0.00 52.86 50.84 3aaw s ASN 34 Cb 0.00 -0.98 -0.09 0.00 -0.02 0.00 0.00 41.25 40.16 3aaw s ASN 34 CO 0.00 0.32 1.09 -1.81 -2.57 0.00 0.00 177.10 174.13 3aaw s ASP 35 N -1.05 7.18 -0.07 -1.22 1.01 0.24 -4.22 116.67 118.53 3aaw s ASP 35 Ca 0.14 2.22 0.01 0.00 0.71 0.00 0.00 52.55 55.63 3aaw s ASP 35 Cb -0.11 -2.62 0.02 0.00 1.01 0.00 0.00 42.92 41.22 3aaw s ASP 35 CO 0.03 -0.20 -0.09 -0.69 0.21 0.00 0.00 175.17 174.44 3aaw s VAL 36 N -1.25 0.93 -0.11 -1.27 1.01 -1.26 -0.83 120.40 117.62 3aaw s VAL 36 Ca 0.47 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 62.14 3aaw s VAL 36 Cb -0.30 -0.90 -0.01 0.00 0.00 0.00 0.00 36.38 35.17 3aaw s VAL 36 CO 0.39 0.32 -0.17 -0.69 0.00 0.00 0.00 175.10 174.95 3aaw s VAL 37 N 0.99 2.71 -0.07 2.92 1.01 -0.64 -2.32 120.40 125.00 3aaw s VAL 37 Ca -0.09 -0.79 0.04 0.00 0.00 0.00 0.00 61.98 61.14 3aaw s VAL 37 Cb -0.15 -2.10 -0.01 0.00 0.00 0.00 0.00 36.38 34.12 3aaw s VAL 37 CO 0.00 0.54 -0.21 -0.69 0.00 0.00 0.00 175.10 174.74 3aaw s VAL 38 N 0.25 2.43 -0.05 2.92 1.01 0.13 -0.76 120.40 126.34 3aaw s VAL 38 Ca -0.12 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 60.98 3aaw s VAL 38 Cb -0.16 -1.93 -0.00 0.00 0.00 0.00 0.00 36.38 34.29 3aaw s VAL 38 CO 0.06 0.57 -0.17 -0.69 0.00 0.00 0.00 175.10 174.87 3aaw s VAL 39 N -0.18 1.45 -0.07 2.92 1.01 -0.02 -0.49 120.40 125.02 3aaw s VAL 39 Ca -0.02 -0.71 0.05 0.00 0.00 0.00 0.00 61.98 61.29 3aaw s VAL 39 Cb -0.14 -1.25 -0.00 0.00 0.00 0.00 0.00 36.38 34.99 3aaw s VAL 39 CO 0.04 0.42 -0.22 0.00 0.00 0.00 0.00 175.10 175.34 3aaw s SER 41 N 0.10 3.18 0.66 0.00 0.01 0.15 -4.84 113.70 112.95 3aaw s SER 41 Ca -0.09 1.31 -0.17 0.00 1.31 0.00 0.00 55.95 58.31 3aaw s SER 41 Cb -0.15 -1.98 -0.00 0.00 0.21 0.00 0.00 66.02 64.10 3aaw s SER 41 CO 0.05 -2.80 1.23 0.00 0.41 0.00 0.00 173.24 172.13 3aaw s ALA 42 N -2.99 2.34 0.24 1.44 0.00 -1.26 -4.68 121.76 116.85 3aaw s ALA 42 Ca 0.64 1.02 -0.31 0.00 0.00 0.00 0.00 51.96 53.31 3aaw s ALA 42 Cb -0.18 -3.49 -0.12 0.00 0.00 0.00 0.00 23.12 19.34 3aaw s ALA 42 CO 0.57 -1.56 1.66 -1.33 0.00 0.00 0.00 175.76 175.10 3aaw n MET 43 N -2.11 2.70 0.00 0.00 0.00 -1.26 -3.86 117.12 112.59 3aaw n MET 43 Ca 0.14 0.97 0.00 0.00 0.00 0.00 0.00 57.70 58.81 3aaw n MET 43 Cb 0.49 -2.78 0.00 0.00 0.00 0.00 0.00 33.22 30.93 3aaw n MET 43 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3aaw n GLY 44 N 3.16 0.00 2.87 3.03 0.00 -0.40 -1.07 105.19 112.78 3aaw n GLY 44 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3aaw n GLY 44 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3aaw n ASP 45 N 0.00 0.00 -0.20 1.61 8.00 -1.26 -4.89 116.55 119.80 3aaw n ASP 45 Ca 0.00 0.00 0.01 0.00 0.71 0.00 0.00 54.79 55.51 3aaw n ASP 45 Cb 0.00 0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.21 3aaw n ASP 45 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 3aaw h THR 46 N 0.00 0.61 -0.22 -3.53 2.02 -1.38 -2.12 112.91 108.28 3aaw h THR 46 Ca 0.00 -0.08 0.05 0.00 0.77 0.00 0.00 66.41 67.15 3aaw h THR 46 Cb 0.00 0.35 -0.04 0.00 -1.74 0.00 0.00 68.15 66.72 3aaw h THR 46 CO 0.00 0.04 -0.07 0.74 0.37 0.00 0.00 175.52 176.61 3aaw h THR 47 N 0.23 0.75 -0.88 3.16 2.02 -1.88 0.15 112.91 116.47 3aaw h THR 47 Ca 0.32 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.52 3aaw h THR 47 Cb 0.49 0.75 -0.05 0.00 -1.74 0.00 0.00 68.15 67.61 3aaw h THR 47 CO -0.43 0.00 0.58 0.44 0.37 0.00 0.00 175.52 176.48 3aaw h ASP 48 N -0.02 1.00 -0.73 4.18 3.32 -1.87 -0.16 116.42 122.14 3aaw h ASP 48 Ca 0.11 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.08 3aaw h ASP 48 Cb 0.18 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.46 3aaw h ASP 48 CO -0.24 0.71 0.23 -0.33 -1.72 0.00 0.00 179.24 177.89 3aaw h GLU 49 N 1.17 1.14 -0.32 3.56 5.08 -0.71 -2.23 114.58 122.27 3aaw h GLU 49 Ca 0.33 -0.24 -0.12 0.00 -1.00 0.00 0.00 59.36 58.33 3aaw h GLU 49 Cb -0.11 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 3aaw h GLU 49 CO -0.08 0.97 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.56 3aaw h LEU 50 N 1.10 0.78 -1.73 1.33 4.07 -0.24 -1.69 115.31 118.93 3aaw h LEU 50 Ca 0.24 -0.45 0.01 0.00 0.08 0.00 0.00 57.88 57.75 3aaw h LEU 50 Cb 0.31 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.81 3aaw h LEU 50 CO -0.01 1.07 0.19 -0.07 -1.08 0.00 0.00 178.44 178.55 3aaw h LEU 51 N 0.50 0.32 -0.10 1.67 3.38 -0.98 -0.24 115.31 119.86 3aaw h LEU 51 Ca 0.06 -0.01 -0.23 0.00 0.09 0.00 0.00 57.88 57.79 3aaw h LEU 51 Cb 0.83 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 3aaw h LEU 51 CO 0.07 0.23 -1.02 -0.08 0.09 0.00 0.00 178.44 177.73 3aaw h GLU 52 N 0.37 0.30 -0.61 1.13 4.81 -1.14 -2.37 114.58 117.07 3aaw h GLU 52 Ca 0.11 -0.38 -0.06 0.00 -0.13 0.00 0.00 59.36 58.90 3aaw h GLU 52 Cb -0.02 0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.45 3aaw h GLU 52 CO -0.02 1.10 0.15 -0.07 -0.73 0.00 0.00 179.01 179.44 3aaw h LEU 53 N 0.14 0.92 0.46 1.64 3.38 -0.89 -2.69 115.31 118.26 3aaw h LEU 53 Ca -0.09 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.64 3aaw h LEU 53 Cb 1.69 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 42.18 3aaw h LEU 53 CO 0.17 0.91 -0.43 0.00 0.09 0.00 0.00 178.44 179.17 3aaw h ALA 54 N 1.04 -0.97 -0.73 1.53 0.00 -0.93 -1.18 119.26 118.03 3aaw h ALA 54 Ca 0.19 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 55.06 3aaw h ALA 54 Cb 0.35 0.61 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 3aaw h ALA 54 CO 0.00 -1.08 0.48 0.00 0.00 0.00 0.00 179.25 178.65 3aaw h ALA 55 N -0.61 1.99 -0.02 0.00 0.00 -1.47 -1.01 119.26 118.14 3aaw h ALA 55 Ca -0.05 -0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.67 3aaw h ALA 55 Cb 0.79 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3aaw h ALA 55 CO -0.05 -0.17 -0.83 0.00 0.00 0.00 0.00 179.25 178.21 3aaw h ALA 56 N 1.65 0.54 0.00 0.00 0.00 -1.08 -3.22 119.26 117.15 3aaw h ALA 56 Ca 0.35 -0.67 -0.04 0.00 0.00 0.00 0.00 54.91 54.55 3aaw h ALA 56 Cb 0.67 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 3aaw h ALA 56 CO -0.12 0.84 -0.69 -0.39 0.00 0.00 0.00 179.25 178.89 3aaw h VAL 57 N 0.18 0.18 -1.58 0.00 -1.51 -0.42 -3.44 116.25 109.65 3aaw h VAL 57 Ca -0.04 -1.30 0.01 0.00 -1.23 0.00 0.00 66.70 64.14 3aaw h VAL 57 Cb 1.43 1.85 -0.23 0.00 -2.13 0.00 0.00 31.29 32.20 3aaw h VAL 57 CO 0.13 0.10 -0.30 0.21 -1.23 0.00 0.00 177.57 176.49 3aaw s ASN 58 N -5.83 -0.86 0.51 4.19 3.84 -0.46 -5.11 114.94 111.23 3aaw s ASN 58 Ca 0.02 0.90 -0.22 0.00 0.21 0.00 0.00 52.86 53.77 3aaw s ASN 58 Cb 0.08 1.88 -0.06 0.00 -0.55 0.00 0.00 41.25 42.60 3aaw s ASN 58 CO 0.75 -0.26 1.27 -2.16 -2.79 0.00 0.00 177.10 173.92 3aaw s PRO 59 N 2.77 3.38 -0.85 0.43 0.04 -1.22 -3.14 135.00 136.42 3aaw s PRO 59 Ca 0.11 2.02 -0.04 0.00 0.04 0.00 0.00 61.00 63.13 3aaw s PRO 59 Cb -0.14 -2.30 -0.00 0.00 0.04 0.00 0.00 34.50 32.10 3aaw s PRO 59 CO -0.18 -0.93 0.68 1.55 0.04 0.00 0.00 177.00 178.15 3aaw n VAL 60 N -0.84 -6.62 -1.71 -0.36 3.14 -1.26 -4.89 118.33 105.79 3aaw n VAL 60 Ca 0.09 -0.29 -0.43 0.00 -2.96 0.00 0.00 64.34 60.75 3aaw n VAL 60 Cb 0.46 -4.84 -0.02 0.00 -1.06 0.00 0.00 33.84 28.38 3aaw n VAL 60 CO 0.00 0.00 0.00 -2.65 -6.46 0.00 0.00 176.83 167.72 3aaw n PRO 61 N -2.58 2.37 -2.22 1.45 -0.02 -1.19 -4.96 135.00 127.86 3aaw n PRO 61 Ca -0.15 0.85 -0.37 0.00 -2.02 0.00 0.00 63.50 61.81 3aaw n PRO 61 Cb 0.60 -2.57 -0.00 0.00 -0.02 0.00 0.00 33.50 31.51 3aaw n PRO 61 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3aaw s PRO 62 N -0.42 3.64 0.29 0.52 0.02 -1.26 -4.89 135.00 132.90 3aaw s PRO 62 Ca 0.66 1.79 -0.03 0.00 0.02 0.00 0.00 61.00 63.45 3aaw s PRO 62 Cb -0.57 -2.33 0.41 0.00 0.02 0.00 0.00 34.50 32.03 3aaw s PRO 62 CO 0.49 -0.66 1.95 0.00 -0.33 0.00 0.00 177.00 178.45 3aaw h ALA 63 N 1.86 1.39 0.36 -1.55 0.00 -1.99 -1.75 119.26 117.58 3aaw h ALA 63 Ca -0.50 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 3aaw h ALA 63 Cb 1.25 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 3aaw h ALA 63 CO 0.59 0.55 -0.24 -0.09 0.00 0.00 0.00 179.25 180.06 3aaw h ARG 64 N 1.17 -0.56 0.00 0.00 2.43 -2.00 -1.28 114.38 114.14 3aaw h ARG 64 Ca 0.33 0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.44 3aaw h ARG 64 Cb -0.09 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3aaw h ARG 64 CO -0.08 -0.38 -0.49 0.93 -1.51 0.00 0.00 179.97 178.44 3aaw h GLU 65 N -0.59 0.00 -0.42 0.20 3.07 -1.93 -1.98 114.58 112.94 3aaw h GLU 65 Ca -0.03 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 58.79 3aaw h GLU 65 Cb 0.50 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.39 3aaw h GLU 65 CO 0.02 0.49 0.14 1.98 -1.40 0.00 0.00 179.01 180.24 3aaw h MET 66 N 0.00 0.66 -0.44 2.33 4.05 -1.03 0.19 114.93 120.69 3aaw h MET 66 Ca -0.00 -0.14 -0.02 0.00 -0.28 0.00 0.00 59.70 59.26 3aaw h MET 66 Cb 0.87 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 31.55 3aaw h MET 66 CO 0.06 0.64 0.20 0.22 0.23 0.00 0.00 176.91 178.27 3aaw h ASP 67 N 0.54 0.58 -0.64 1.39 3.58 -1.09 -0.13 116.42 120.65 3aaw h ASP 67 Ca 0.14 -0.14 0.10 0.00 0.42 0.00 0.00 57.03 57.55 3aaw h ASP 67 Cb 0.25 -0.15 -0.07 0.00 1.72 0.00 0.00 39.33 41.08 3aaw h ASP 67 CO -0.01 0.56 0.25 -0.03 -2.88 0.00 0.00 179.24 177.13 3aaw h MET 68 N 0.57 0.42 0.26 0.28 4.05 -1.08 -0.23 114.93 119.20 3aaw h MET 68 Ca 0.15 -0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.53 3aaw h MET 68 Cb 0.14 -0.10 0.00 0.00 -0.80 0.00 0.00 31.60 30.84 3aaw h MET 68 CO -0.02 0.28 -0.12 1.25 0.23 0.00 0.00 176.91 178.53 3aaw h LEU 69 N 0.44 -0.29 -1.14 3.39 5.85 0.13 -2.41 115.31 121.28 3aaw h LEU 69 Ca 0.32 -0.15 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 3aaw h LEU 69 Cb 0.40 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.50 3aaw h LEU 69 CO -0.31 -0.01 -0.24 -0.07 -0.34 0.00 0.00 178.44 177.47 3aaw h LEU 70 N -0.58 0.31 -0.82 2.25 3.38 -0.93 -2.55 115.31 116.36 3aaw h LEU 70 Ca -0.04 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 3aaw h LEU 70 Cb 0.42 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3aaw h LEU 70 CO 0.06 0.55 -0.12 0.74 0.09 0.00 0.00 178.44 179.76 3aaw h THR 71 N 0.28 1.26 -0.27 0.22 2.02 -1.00 -1.74 112.91 113.68 3aaw h THR 71 Ca 0.05 -1.17 -0.00 0.00 0.77 0.00 0.00 66.41 66.06 3aaw h THR 71 Cb 0.58 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 3aaw h THR 71 CO 0.04 0.40 0.17 0.00 0.37 0.00 0.00 175.52 176.49 3aaw h ALA 72 N 1.19 0.34 -0.57 6.16 0.00 -1.03 0.96 119.26 126.30 3aaw h ALA 72 Ca 0.12 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.07 3aaw h ALA 72 Cb 0.59 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 18.21 3aaw h ALA 72 CO 0.04 -0.16 0.22 0.78 0.00 0.00 0.00 179.25 180.12 3aaw h GLY 73 N 0.35 0.78 1.19 0.00 0.00 -1.22 -2.12 103.07 102.05 3aaw h GLY 73 Ca 0.10 -0.12 -0.09 0.00 0.00 0.00 0.00 47.33 47.21 3aaw h GLY 73 CO -0.02 0.01 -0.02 0.83 0.00 0.00 0.00 176.54 177.34 3aaw h GLU 74 N 0.41 0.97 -0.29 4.80 5.08 -0.93 -2.90 114.58 121.71 3aaw h GLU 74 Ca 0.28 -0.30 -0.04 0.00 -1.00 0.00 0.00 59.36 58.30 3aaw h GLU 74 Cb 0.31 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 3aaw h GLU 74 CO -0.27 0.97 0.01 -0.09 -1.00 0.00 0.00 179.01 178.62 3aaw h ARG 75 N 0.89 0.44 0.22 2.33 9.65 -0.19 -1.93 114.38 125.78 3aaw h ARG 75 Ca 0.16 -0.08 0.01 0.00 -1.10 0.00 0.00 59.98 58.97 3aaw h ARG 75 Cb 0.54 -0.07 -0.04 0.00 -1.39 0.00 0.00 29.97 29.02 3aaw h ARG 75 CO 0.03 0.46 -0.39 0.82 2.80 0.00 0.00 179.97 183.69 3aaw h ILE 76 N 0.42 0.20 -0.64 1.20 2.04 -1.19 0.34 117.51 119.87 3aaw h ILE 76 Ca 0.10 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.02 3aaw h ILE 76 Cb 0.27 0.20 -0.06 0.00 -0.74 0.00 0.00 36.82 36.49 3aaw h ILE 76 CO 0.01 0.00 0.33 0.28 0.00 0.00 0.00 178.15 178.77 3aaw h SER 77 N -0.69 0.47 -0.47 1.72 0.02 -1.53 -2.16 113.55 110.90 3aaw h SER 77 Ca 0.00 0.04 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 3aaw h SER 77 Cb 0.68 -0.05 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 3aaw h SER 77 CO -0.17 0.30 0.09 0.78 -1.14 0.00 0.00 176.83 176.69 3aaw h ASN 78 N 0.61 0.79 -0.28 3.07 4.21 -1.04 0.74 115.58 123.68 3aaw h ASN 78 Ca 0.30 -0.16 -0.05 0.00 1.21 0.00 0.00 56.30 57.60 3aaw h ASN 78 Cb 0.23 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.22 3aaw h ASN 78 CO -0.21 0.80 -0.03 0.00 -1.29 0.00 0.00 177.43 176.70 3aaw h ALA 79 N 1.30 0.38 0.04 -0.83 0.00 -0.59 -1.98 119.26 117.59 3aaw h ALA 79 Ca 0.17 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3aaw h ALA 79 Cb 0.35 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3aaw h ALA 79 CO 0.01 0.16 -0.02 -0.07 0.00 0.00 0.00 179.25 179.33 3aaw h LEU 80 N 0.29 -0.05 -0.85 0.00 4.07 -1.05 -1.18 115.31 116.55 3aaw h LEU 80 Ca 0.08 -0.08 0.03 0.00 0.08 0.00 0.00 57.88 57.99 3aaw h LEU 80 Cb 0.49 0.01 -0.05 0.00 1.08 0.00 0.00 40.66 42.19 3aaw h LEU 80 CO 0.02 0.05 0.55 0.58 -1.08 0.00 0.00 178.44 178.56 3aaw h VAL 81 N -0.14 1.14 -0.09 1.22 2.07 -0.91 -0.94 116.25 118.60 3aaw h VAL 81 Ca -0.01 -0.36 0.03 0.00 0.82 0.00 0.00 66.70 67.18 3aaw h VAL 81 Cb 0.13 -0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 29.84 3aaw h VAL 81 CO 0.01 0.19 -0.12 0.00 0.02 0.00 0.00 177.57 177.67 3aaw h ALA 82 N 1.35 -0.06 -0.55 1.67 0.00 -1.12 -0.80 119.26 119.75 3aaw h ALA 82 Ca 0.34 0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.38 3aaw h ALA 82 Cb 0.01 0.24 -0.08 0.00 0.00 0.00 0.00 17.79 17.96 3aaw h ALA 82 CO -0.12 -0.58 0.13 0.52 0.00 0.00 0.00 179.25 179.20 3aaw h MET 83 N -0.16 0.26 -0.52 0.00 2.07 -0.73 -1.22 114.93 114.63 3aaw h MET 83 Ca 0.07 -0.02 -0.06 0.00 -2.07 0.00 0.00 59.70 57.63 3aaw h MET 83 Cb 0.27 -0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 29.92 3aaw h MET 83 CO -0.19 0.17 0.09 0.00 1.07 0.00 0.00 176.91 178.05 3aaw h ALA 84 N 1.43 0.69 -0.69 6.32 0.00 -0.79 -1.78 119.26 124.43 3aaw h ALA 84 Ca 0.28 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 3aaw h ALA 84 Cb 0.39 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 3aaw h ALA 84 CO -0.35 0.42 0.41 0.82 0.00 0.00 0.00 179.25 180.56 3aaw h ILE 85 N 0.74 1.20 -0.31 0.00 5.03 -0.92 -2.76 117.51 120.48 3aaw h ILE 85 Ca 0.16 -0.45 -0.06 0.00 -0.12 0.00 0.00 64.86 64.39 3aaw h ILE 85 Cb 0.40 0.25 -0.02 0.00 -3.03 0.00 0.00 36.82 34.42 3aaw h ILE 85 CO 0.01 0.21 -0.06 -0.08 -0.68 0.00 0.00 178.15 177.54 3aaw h GLU 86 N 0.94 0.51 0.00 2.37 4.57 -0.90 -2.04 114.58 120.03 3aaw h GLU 86 Ca 0.25 -0.13 -0.08 0.00 -1.18 0.00 0.00 59.36 58.22 3aaw h GLU 86 Cb -0.02 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 3aaw h GLU 86 CO -0.05 0.58 -0.39 0.66 -1.18 0.00 0.00 179.01 178.63 3aaw h SER 87 N 0.48 0.00 -0.37 1.04 4.64 -1.08 -2.38 113.55 115.88 3aaw h SER 87 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3aaw h SER 87 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 3aaw h SER 87 CO 0.02 0.39 0.00 0.18 -0.87 0.00 0.00 176.83 176.55 3aaw n LEU 88 N -3.71 2.67 0.00 5.97 4.77 -0.80 -4.92 117.00 120.98 3aaw n LEU 88 Ca -0.01 -1.35 0.00 0.00 -0.03 0.00 0.00 56.01 54.62 3aaw n LEU 88 Cb 0.48 -0.39 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3aaw n LEU 88 CO 0.37 0.51 0.00 0.61 -1.33 0.00 0.00 177.39 177.56 3aaw n GLY 89 N 0.86 0.73 3.81 -0.72 0.00 -0.89 -5.05 105.19 103.92 3aaw n GLY 89 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 3aaw n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3aaw s ALA 90 N -2.46 3.07 -0.28 4.61 0.00 -1.00 -5.01 121.76 120.69 3aaw s ALA 90 Ca 0.00 0.47 -0.20 0.00 0.00 0.00 0.00 51.96 52.23 3aaw s ALA 90 Cb 0.00 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.93 3aaw s ALA 90 CO 0.00 0.08 0.62 -2.00 0.00 0.00 0.00 175.76 174.45 3aaw s GLU 91 N -2.88 4.00 0.05 0.00 2.12 -1.26 -3.90 118.70 116.83 3aaw s GLU 91 Ca 0.59 0.40 -0.03 0.00 0.36 0.00 0.00 54.97 56.29 3aaw s GLU 91 Cb -0.13 -3.69 -0.04 0.00 0.26 0.00 0.00 34.13 30.53 3aaw s GLU 91 CO 0.17 -0.48 0.25 0.00 -0.54 0.00 0.00 175.26 174.66 3aaw s ALA 92 N 2.53 3.92 -0.07 6.30 0.00 -1.26 -1.48 121.76 131.70 3aaw s ALA 92 Ca 0.25 -0.71 -0.02 0.00 0.00 0.00 0.00 51.96 51.48 3aaw s ALA 92 Cb -0.15 -1.95 0.04 0.00 0.00 0.00 0.00 23.12 21.05 3aaw s ALA 92 CO 0.10 0.74 0.05 -1.14 0.00 0.00 0.00 175.76 175.51 3aaw s GLN 93 N -2.23 0.11 -0.00 0.00 2.00 -0.68 -4.92 119.66 113.93 3aaw s GLN 93 Ca 0.33 0.22 -0.08 0.00 -2.00 0.00 0.00 55.36 53.83 3aaw s GLN 93 Cb -0.13 -0.87 -0.05 0.00 0.80 0.00 0.00 33.01 32.76 3aaw s GLN 93 CO 0.22 -0.39 0.27 -1.12 -0.50 0.00 0.00 175.29 173.78 3aaw s SER 94 N 2.11 6.52 -0.03 6.67 0.01 -1.26 -0.70 113.70 127.03 3aaw s SER 94 Ca 0.04 0.60 0.04 0.00 1.31 0.00 0.00 55.95 57.95 3aaw s SER 94 Cb -0.13 -2.11 -0.00 0.00 0.21 0.00 0.00 66.02 63.99 3aaw s SER 94 CO -0.05 0.28 -0.14 -0.36 0.41 0.00 0.00 173.24 173.38 3aaw s PHE 95 N -1.25 1.36 -0.21 2.43 0.08 -0.06 -4.93 117.98 115.41 3aaw s PHE 95 Ca 0.26 -0.35 0.14 0.00 0.12 0.00 0.00 56.93 57.11 3aaw s PHE 95 Cb -0.13 -0.92 -0.23 0.00 -0.57 0.00 0.00 43.02 41.16 3aaw s PHE 95 CO 0.14 -0.11 0.03 -2.37 -0.10 0.00 0.00 175.22 172.81 3aaw n THR 96 N 3.09 1.42 0.00 0.64 5.66 -1.26 -2.33 114.28 121.50 3aaw n THR 96 Ca -0.17 -0.80 0.00 0.00 -3.05 0.00 0.00 64.05 60.03 3aaw n THR 96 Cb 0.54 -0.68 0.00 0.00 -1.55 0.00 0.00 70.33 68.64 3aaw n THR 96 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35 3aaw n VAL 116 N -2.87 0.00 -4.20 1.08 0.24 -1.26 -3.98 118.33 107.34 3aaw n VAL 116 Ca -0.35 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 61.65 3aaw n VAL 116 Cb 1.12 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 33.40 3aaw n VAL 116 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3aaw s THR 117 N 0.00 3.71 0.36 3.34 2.01 -1.26 -4.98 115.64 118.82 3aaw s THR 117 Ca 0.00 -1.09 0.15 0.00 0.31 0.00 0.00 61.69 61.06 3aaw s THR 117 Cb 0.00 -2.74 0.36 0.00 0.01 0.00 0.00 72.50 70.13 3aaw s THR 117 CO 0.00 0.14 1.75 -0.65 -0.69 0.00 0.00 174.62 175.18 3aaw h PRO 118 N 3.61 0.47 -0.35 4.92 0.11 -1.99 -1.33 132.00 137.43 3aaw h PRO 118 Ca -0.48 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 3aaw h PRO 118 Cb 1.17 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3aaw h PRO 118 CO 0.56 0.31 0.14 0.78 -0.21 0.00 0.00 178.00 179.57 3aaw h GLY 119 N 0.48 0.56 1.12 -0.55 0.00 -1.97 -0.45 103.07 102.27 3aaw h GLY 119 Ca 0.62 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 3aaw h GLY 119 CO -0.37 0.29 0.43 3.21 0.00 0.00 0.00 176.54 180.10 3aaw h ARG 120 N 0.42 1.14 -0.27 4.80 3.08 -1.67 0.32 114.38 122.20 3aaw h ARG 120 Ca 0.12 -0.14 -0.04 0.00 0.07 0.00 0.00 59.98 59.99 3aaw h ARG 120 Cb 0.19 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3aaw h ARG 120 CO -0.01 0.85 0.03 0.28 -1.07 0.00 0.00 179.97 180.05 3aaw h VAL 121 N 1.15 1.24 -0.32 2.04 2.07 -1.29 -2.11 116.25 119.02 3aaw h VAL 121 Ca 0.29 -0.82 0.04 0.00 0.82 0.00 0.00 66.70 67.02 3aaw h VAL 121 Cb 0.05 1.25 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 3aaw h VAL 121 CO -0.04 0.26 0.08 -0.09 0.02 0.00 0.00 177.57 177.80 3aaw h ARG 122 N 0.26 0.20 -0.40 1.57 9.65 -0.45 0.44 114.38 125.66 3aaw h ARG 122 Ca 0.08 -0.01 0.08 0.00 -1.10 0.00 0.00 59.98 59.03 3aaw h ARG 122 Cb 0.36 -0.05 -0.08 0.00 -1.39 0.00 0.00 29.97 28.81 3aaw h ARG 122 CO 0.01 0.13 -0.15 0.93 2.80 0.00 0.00 179.97 183.69 3aaw h GLU 123 N 0.21 -0.07 -0.68 0.20 5.08 -0.31 -0.34 114.58 118.67 3aaw h GLU 123 Ca 0.15 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.44 3aaw h GLU 123 Cb 0.15 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 3aaw h GLU 123 CO -0.18 -0.05 0.12 0.00 -1.00 0.00 0.00 179.01 177.90 3aaw h ALA 124 N 1.26 0.92 -0.95 3.43 0.00 -0.64 -2.49 119.26 120.80 3aaw h ALA 124 Ca 0.20 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3aaw h ALA 124 Cb 0.37 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 3aaw h ALA 124 CO -0.45 0.67 0.60 -0.07 0.00 0.00 0.00 179.25 180.00 3aaw h LEU 125 N 1.04 1.12 -1.58 0.00 3.38 0.39 -1.87 115.31 117.79 3aaw h LEU 125 Ca 0.21 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 3aaw h LEU 125 Cb 0.43 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3aaw h LEU 125 CO 0.01 0.83 -0.18 0.44 0.09 0.00 0.00 178.44 179.63 3aaw h ASP 126 N 1.30 0.00 -0.14 -0.43 3.32 -0.65 -0.34 116.42 119.48 3aaw h ASP 126 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 3aaw h ASP 126 Cb -0.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.44 3aaw h ASP 126 CO -0.07 0.18 0.00 -0.62 -1.72 0.00 0.00 179.24 177.01 3aaw n GLU 127 N -3.57 1.34 -0.76 3.56 1.02 -0.97 -4.91 120.64 116.36 3aaw n GLU 127 Ca -0.01 -0.54 0.00 0.00 -0.02 0.00 0.00 57.16 56.59 3aaw n GLU 127 Cb 0.32 -1.14 0.00 0.00 -0.02 0.00 0.00 31.44 30.61 3aaw n GLU 127 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3aaw n GLY 128 N 0.76 0.80 3.76 0.62 0.00 -0.14 -5.04 105.19 105.95 3aaw n GLY 128 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3aaw n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3aaw s LYS 129 N -0.24 4.74 -0.17 1.61 1.02 -0.74 -4.76 119.74 121.20 3aaw s LYS 129 Ca 0.00 1.57 -0.29 0.00 0.02 0.00 0.00 55.97 57.27 3aaw s LYS 129 Cb 0.00 -3.19 -0.00 0.00 -0.52 0.00 0.00 37.83 34.12 3aaw s LYS 129 CO 0.00 0.38 1.07 0.42 -0.92 0.00 0.00 175.35 176.30 3aaw s ILE 130 N -1.23 4.64 -0.20 2.17 1.09 -0.55 -4.25 121.20 122.87 3aaw s ILE 130 Ca 0.43 1.95 -0.13 0.00 -1.10 0.00 0.00 60.65 61.80 3aaw s ILE 130 Cb -0.27 -4.26 -0.04 0.00 -1.06 0.00 0.00 42.46 36.83 3aaw s ILE 130 CO 0.34 -0.11 0.29 0.00 -0.10 0.00 0.00 174.94 175.36 3aaw s ILE 132 N 1.01 3.95 -0.20 0.00 1.09 0.13 0.20 121.20 127.38 3aaw s ILE 132 Ca 0.14 -0.78 -0.03 0.00 -1.10 0.00 0.00 60.65 58.89 3aaw s ILE 132 Cb -0.14 -3.08 -0.01 0.00 -1.06 0.00 0.00 42.46 38.18 3aaw s ILE 132 CO 0.05 0.02 -0.08 -0.69 -0.10 0.00 0.00 174.94 174.15 3aaw s VAL 133 N 1.48 3.16 -0.09 2.92 1.01 0.35 -0.88 120.40 128.36 3aaw s VAL 133 Ca 0.02 -0.57 -0.27 0.00 0.00 0.00 0.00 61.98 61.15 3aaw s VAL 133 Cb -0.18 -2.41 -0.23 0.00 0.00 0.00 0.00 36.38 33.56 3aaw s VAL 133 CO 0.03 0.46 0.94 0.00 0.00 0.00 0.00 175.10 176.52 3aaw h ALA 134 N 7.82 -0.01 0.00 5.51 0.00 -1.72 -3.40 119.26 127.46 3aaw h ALA 134 Ca -0.39 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.13 3aaw h ALA 134 Cb 1.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.96 3aaw h ALA 134 CO 0.60 -0.10 0.00 0.41 0.00 0.00 0.00 179.25 180.16 3aaw n GLY 135 N 1.08 0.82 0.00 0.00 0.00 -1.26 -4.81 105.19 101.03 3aaw n GLY 135 Ca -0.09 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.14 3aaw n GLY 135 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3aaw n PHE 136 N -0.18 0.00 -0.52 1.61 3.01 -1.26 -4.73 117.46 115.39 3aaw n PHE 136 Ca 0.00 0.00 -0.12 0.00 1.01 0.00 0.00 57.45 58.34 3aaw n PHE 136 Cb 0.00 0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.41 3aaw n PHE 136 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3aaw n VAL 139 N 0.00 0.00 -3.38 -4.37 0.31 -1.26 -5.07 118.33 104.57 3aaw n VAL 139 Ca 0.00 -0.06 -0.43 0.00 -0.01 0.00 0.00 64.34 63.83 3aaw n VAL 139 Cb 0.00 -0.11 -0.09 0.00 -0.91 0.00 0.00 33.84 32.73 3aaw n VAL 139 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3aaw s ASN 140 N 2.00 6.15 -0.07 4.52 0.01 -1.26 -5.06 114.94 121.24 3aaw s ASN 140 Ca 0.47 -0.94 0.02 0.00 -0.71 0.00 0.00 52.86 51.70 3aaw s ASN 140 Cb -0.39 -2.19 -0.03 0.00 0.41 0.00 0.00 41.25 39.05 3aaw s ASN 140 CO 0.18 -0.57 -0.12 -0.54 -1.51 0.00 0.00 177.10 174.54 3aaw s LYS 141 N 1.88 2.75 -0.05 -0.60 1.02 -1.26 -5.04 119.74 118.44 3aaw s LYS 141 Ca 0.08 -0.65 -0.26 0.00 0.02 0.00 0.00 55.97 55.15 3aaw s LYS 141 Cb -0.20 -2.49 -0.22 0.00 -0.52 0.00 0.00 37.83 34.41 3aaw s LYS 141 CO 0.10 0.55 1.14 0.93 -0.92 0.00 0.00 175.35 177.15 3aaw h GLU 142 N 5.59 0.04 -5.79 1.68 3.07 -1.97 -3.46 114.58 113.75 3aaw h GLU 142 Ca -0.43 -0.03 -0.49 0.00 -0.50 0.00 0.00 59.36 57.90 3aaw h GLU 142 Cb 1.17 0.01 -0.17 0.00 -0.84 0.00 0.00 28.75 28.91 3aaw h GLU 142 CO 0.52 0.67 -0.77 0.99 -1.40 0.00 0.00 179.01 179.02 3aaw s THR 143 N -3.68 1.74 0.57 1.13 2.01 -1.26 -5.04 115.64 111.11 3aaw s THR 143 Ca -0.16 -1.96 0.26 0.00 0.31 0.00 0.00 61.69 60.14 3aaw s THR 143 Cb 0.01 -1.85 0.34 0.00 0.01 0.00 0.00 72.50 71.01 3aaw s THR 143 CO 0.69 -0.39 2.19 -0.09 -0.69 0.00 0.00 174.62 176.33 3aaw h ARG 144 N 3.13 0.00 0.07 4.92 9.65 -2.04 -3.19 114.38 126.92 3aaw h ARG 144 Ca -0.41 0.00 -0.31 0.00 -1.10 0.00 0.00 59.98 58.16 3aaw h ARG 144 Cb 1.21 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 29.76 3aaw h ARG 144 CO 0.53 0.00 -1.66 0.38 2.80 0.00 0.00 179.97 182.02 3aaw h ASP 145 N 0.00 0.24 -3.17 -3.80 3.04 -2.00 -3.48 116.42 107.25 3aaw h ASP 145 Ca 0.03 -0.42 -0.57 0.00 -3.24 0.00 0.00 57.03 52.83 3aaw h ASP 145 Cb 0.14 -0.08 0.18 0.00 -1.04 0.00 0.00 39.33 38.53 3aaw h ASP 145 CO -0.00 1.36 -0.36 1.33 -2.04 0.00 0.00 179.24 179.53 3aaw n VAL 146 N -3.31 2.06 -4.65 4.15 0.24 -1.21 -4.98 118.33 110.63 3aaw n VAL 146 Ca -0.19 -0.43 -0.33 0.00 -2.04 0.00 0.00 64.34 61.35 3aaw n VAL 146 Cb 1.04 -0.75 -0.14 0.00 -1.47 0.00 0.00 33.84 32.52 3aaw n VAL 146 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 3aaw s THR 147 N -1.83 3.29 -0.06 3.34 2.01 -1.26 -4.98 115.64 116.15 3aaw s THR 147 Ca 0.67 -0.57 0.02 0.00 0.31 0.00 0.00 61.69 62.11 3aaw s THR 147 Cb -0.38 -2.40 -0.03 0.00 0.01 0.00 0.00 72.50 69.70 3aaw s THR 147 CO 0.56 0.51 -0.09 -0.89 -0.69 0.00 0.00 174.62 174.02 3aaw s THR 148 N 0.38 3.52 -0.02 -0.82 2.01 -1.26 -5.12 115.64 114.33 3aaw s THR 148 Ca -0.09 -0.55 0.02 0.00 0.31 0.00 0.00 61.69 61.38 3aaw s THR 148 Cb -0.15 -2.42 0.00 0.00 0.01 0.00 0.00 72.50 69.94 3aaw s THR 148 CO 0.05 0.60 -0.07 -0.76 -0.69 0.00 0.00 174.62 173.74 3aaw s LEU 149 N -0.79 1.85 0.00 4.42 1.43 -1.26 -5.10 118.68 119.23 3aaw s LEU 149 Ca 0.12 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 3aaw s LEU 149 Cb -0.11 -0.43 0.00 0.00 0.03 0.00 0.00 46.19 45.69 3aaw s LEU 149 CO 0.01 0.06 0.00 0.61 0.23 0.00 0.00 176.35 177.26 3aaw n GLY 150 N 3.17 -1.90 3.67 -3.19 0.00 -1.26 -4.90 105.19 100.78 3aaw n GLY 150 Ca -0.16 -1.68 -0.35 0.00 0.00 0.00 0.00 46.02 43.82 3aaw n GLY 150 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3aaw s ARG 151 N 0.00 4.07 0.07 1.61 3.52 -1.26 -5.05 118.95 121.91 3aaw s ARG 151 Ca 0.00 -0.28 -0.34 0.00 -0.13 0.00 0.00 55.73 54.98 3aaw s ARG 151 Cb 0.00 -3.39 -0.13 0.00 -1.56 0.00 0.00 34.95 29.88 3aaw s ARG 151 CO 0.00 0.20 1.71 0.41 -0.81 0.00 0.00 175.30 176.81 3aaw n GLY 152 N 3.81 1.31 0.00 8.12 0.00 -1.26 -4.99 105.19 112.18 3aaw n GLY 152 Ca -0.16 0.73 0.00 0.00 0.00 0.00 0.00 46.02 46.59 3aaw n GLY 152 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3aaw n GLY 153 N 3.85 2.27 0.17 -0.02 0.00 -1.26 -4.95 105.19 105.25 3aaw n GLY 153 Ca 0.19 -2.14 -0.12 0.00 0.00 0.00 0.00 46.02 43.95 3aaw n GLY 153 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3aaw h SER 154 N 0.00 0.50 -0.40 1.61 0.02 -1.92 -2.23 113.55 111.13 3aaw h SER 154 Ca 0.00 -0.39 0.07 0.00 -0.84 0.00 0.00 61.79 60.64 3aaw h SER 154 Cb 0.00 -0.14 -0.06 0.00 0.14 0.00 0.00 62.40 62.34 3aaw h SER 154 CO 0.00 0.78 0.00 0.44 -1.14 0.00 0.00 176.83 176.91 3aaw h ASP 155 N 0.23 -0.16 0.80 3.07 3.45 -1.97 -1.05 116.42 120.78 3aaw h ASP 155 Ca 0.06 0.09 -0.19 0.00 0.43 0.00 0.00 57.03 57.42 3aaw h ASP 155 Cb 0.57 0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 39.48 3aaw h ASP 155 CO 0.03 -0.04 -0.88 0.71 -1.57 0.00 0.00 179.24 177.49 3aaw h THR 156 N 0.11 1.59 -0.14 0.35 1.35 -1.90 -1.77 112.91 112.49 3aaw h THR 156 Ca 0.20 -2.89 -0.09 0.00 -0.55 0.00 0.00 66.41 63.08 3aaw h THR 156 Cb 0.28 2.58 -0.01 0.00 -1.73 0.00 0.00 68.15 69.27 3aaw h THR 156 CO -0.33 0.83 -0.31 0.71 -0.25 0.00 0.00 175.52 176.18 3aaw h THR 157 N 0.02 1.27 0.02 6.82 1.35 -1.20 0.10 112.91 121.29 3aaw h THR 157 Ca -0.02 -1.27 -0.00 0.00 -0.55 0.00 0.00 66.41 64.56 3aaw h THR 157 Cb 1.54 1.50 0.00 0.00 -1.73 0.00 0.00 68.15 69.46 3aaw h THR 157 CO 0.12 0.39 -0.01 0.00 -0.25 0.00 0.00 175.52 175.77 3aaw h ALA 158 N 1.44 -0.02 -0.19 6.62 0.00 -0.68 -0.11 119.26 126.32 3aaw h ALA 158 Ca 0.03 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 3aaw h ALA 158 Cb 0.67 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 3aaw h ALA 158 CO 0.05 -0.38 -0.56 -0.39 0.00 0.00 0.00 179.25 177.97 3aaw h VAL 159 N -0.28 1.32 -0.28 0.00 -1.51 -1.26 -0.54 116.25 113.70 3aaw h VAL 159 Ca -0.00 -1.81 0.05 0.00 -1.23 0.00 0.00 66.70 63.71 3aaw h VAL 159 Cb 0.27 1.77 -0.05 0.00 -2.13 0.00 0.00 31.29 31.16 3aaw h VAL 159 CO 0.00 0.56 -0.02 0.00 -1.23 0.00 0.00 177.57 176.88 3aaw h ALA 160 N 0.94 0.23 -0.38 5.19 0.00 -0.76 0.55 119.26 125.03 3aaw h ALA 160 Ca 0.01 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.04 3aaw h ALA 160 Cb 1.11 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 19.03 3aaw h ALA 160 CO 0.11 -0.43 0.17 -0.07 0.00 0.00 0.00 179.25 179.02 3aaw h LEU 161 N 0.05 0.22 -0.87 0.00 3.38 -0.86 0.18 115.31 117.41 3aaw h LEU 161 Ca 0.14 0.03 0.05 0.00 0.09 0.00 0.00 57.88 58.18 3aaw h LEU 161 Cb 0.19 -0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.87 3aaw h LEU 161 CO -0.25 0.17 0.55 0.00 0.09 0.00 0.00 178.44 179.00 3aaw h ALA 162 N 1.22 1.18 0.48 1.53 0.00 -0.27 0.13 119.26 123.53 3aaw h ALA 162 Ca 0.17 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3aaw h ALA 162 Cb 0.10 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.63 3aaw h ALA 162 CO -0.14 0.34 -0.23 0.00 0.00 0.00 0.00 179.25 179.22 3aaw h ALA 163 N 1.39 -0.65 -0.71 0.00 0.00 0.58 0.23 119.26 120.11 3aaw h ALA 163 Ca 0.37 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3aaw h ALA 163 Cb 0.11 0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 3aaw h ALA 163 CO -0.15 -0.75 0.39 0.00 0.00 0.00 0.00 179.25 178.74 3aaw h ALA 164 N -0.47 1.36 -0.01 0.00 0.00 -0.34 -1.49 119.26 118.30 3aaw h ALA 164 Ca -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.74 3aaw h ALA 164 Cb 0.58 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3aaw h ALA 164 CO 0.11 0.53 -0.14 1.28 0.00 0.00 0.00 179.25 181.03 3aaw n LEU 165 N -4.37 1.62 -3.40 0.00 4.77 0.01 -4.98 117.00 110.65 3aaw n LEU 165 Ca 0.07 -0.52 -0.17 0.00 -0.03 0.00 0.00 56.01 55.36 3aaw n LEU 165 Cb 0.09 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.22 3aaw n LEU 165 CO 0.38 0.28 0.06 -3.20 -1.33 0.00 0.00 177.39 173.58 3aaw n ASN 166 N 0.05 -3.70 -4.76 -1.43 4.05 0.18 -4.96 115.26 104.69 3aaw n ASN 166 Ca 0.15 -0.68 -0.33 0.00 0.45 0.00 0.00 54.58 54.17 3aaw n ASN 166 Cb 0.40 -5.00 0.07 0.00 1.23 0.00 0.00 39.78 36.48 3aaw n ASN 166 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 3aaw s ALA 167 N -3.40 2.36 0.14 5.20 0.00 0.58 -4.90 121.76 121.73 3aaw s ALA 167 Ca 0.18 0.50 0.02 0.00 0.00 0.00 0.00 51.96 52.65 3aaw s ALA 167 Cb -0.03 -3.32 -0.11 0.00 0.00 0.00 0.00 23.12 19.67 3aaw s ALA 167 CO 0.75 -1.49 1.31 -0.44 0.00 0.00 0.00 175.76 175.88 3aaw h ASP 168 N -0.36 0.24 -4.93 0.00 5.19 -1.24 -3.46 116.42 111.86 3aaw h ASP 168 Ca -0.46 -0.22 -0.11 0.00 -0.62 0.00 0.00 57.03 55.62 3aaw h ASP 168 Cb 1.25 -0.08 -0.20 0.00 0.18 0.00 0.00 39.33 40.48 3aaw h ASP 168 CO 0.53 1.08 -0.21 0.54 -3.12 0.00 0.00 179.24 178.06 3aaw s VAL 169 N -2.99 0.05 -0.32 -1.35 0.11 -1.25 -4.60 120.40 110.05 3aaw s VAL 169 Ca -0.02 -0.39 -0.01 0.00 -2.93 0.00 0.00 61.98 58.63 3aaw s VAL 169 Cb 0.09 -0.66 0.07 0.00 -1.53 0.00 0.00 36.38 34.35 3aaw s VAL 169 CO 0.84 -0.21 0.04 0.00 -3.33 0.00 0.00 175.10 172.43 3aaw s GLU 171 N 1.18 4.33 -0.41 0.00 2.02 0.18 -1.40 118.70 124.61 3aaw s GLU 171 Ca -0.01 0.64 -0.07 0.00 0.02 0.00 0.00 54.97 55.55 3aaw s GLU 171 Cb -0.20 -3.48 0.09 0.00 0.10 0.00 0.00 34.13 30.63 3aaw s GLU 171 CO -0.03 0.00 0.23 0.42 0.02 0.00 0.00 175.26 175.91 3aaw s ILE 172 N 1.08 3.87 -0.07 -1.63 -1.09 0.15 -0.41 121.20 123.10 3aaw s ILE 172 Ca 0.31 -1.62 -0.13 0.00 -2.23 0.00 0.00 60.65 56.98 3aaw s ILE 172 Cb -0.16 -3.45 -0.05 0.00 -1.58 0.00 0.00 42.46 37.22 3aaw s ILE 172 CO 0.13 -0.56 0.32 -0.31 -1.23 0.00 0.00 174.94 173.29 3aaw s TYR 173 N 1.33 3.63 0.00 3.97 2.02 0.71 -2.29 117.35 126.71 3aaw s TYR 173 Ca 0.04 0.79 0.00 0.00 -0.37 0.00 0.00 57.07 57.53 3aaw s TYR 173 Cb -0.23 -2.23 0.00 0.00 -0.40 0.00 0.00 41.96 39.10 3aaw s TYR 173 CO -0.00 0.56 0.00 -1.13 -1.57 0.00 0.00 175.55 173.41 3aaw n SER 174 N 2.30 0.00 -0.32 2.29 3.41 -1.05 -1.69 113.62 118.57 3aaw n SER 174 Ca -0.15 -0.03 0.14 0.00 -0.26 0.00 0.00 58.87 58.57 3aaw n SER 174 Cb 0.53 0.00 0.55 0.00 -0.26 0.00 0.00 64.21 65.03 3aaw n SER 174 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3aaw n ASP 175 N -0.03 1.08 -4.70 4.04 5.68 -1.26 -1.18 116.55 120.18 3aaw n ASP 175 Ca 0.00 -1.17 -0.39 0.00 -0.50 0.00 0.00 54.79 52.73 3aaw n ASP 175 Cb 0.00 0.02 -0.06 0.00 -1.14 0.00 0.00 41.12 39.94 3aaw n ASP 175 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 3aaw s VAL 176 N -2.18 5.10 -2.04 2.12 1.01 -1.26 -4.91 120.40 118.23 3aaw s VAL 176 Ca 0.35 1.13 0.20 0.00 0.00 0.00 0.00 61.98 63.65 3aaw s VAL 176 Cb 0.21 -3.90 0.42 0.00 0.00 0.00 0.00 36.38 33.10 3aaw s VAL 176 CO 0.40 0.23 1.36 -0.90 0.00 0.00 0.00 175.10 176.19 3aaw n ASP 177 N 4.22 3.35 0.00 3.32 5.75 -1.26 -3.16 116.55 128.77 3aaw n ASP 177 Ca -0.04 -1.95 0.00 0.00 -0.01 0.00 0.00 54.79 52.79 3aaw n ASP 177 Cb 0.51 -0.27 0.00 0.00 -1.03 0.00 0.00 41.12 40.33 3aaw n ASP 177 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3aaw n GLY 178 N 1.30 -0.88 3.58 6.12 0.00 -1.26 -4.11 105.19 109.94 3aaw n GLY 178 Ca 0.18 -1.22 -0.34 0.00 0.00 0.00 0.00 46.02 44.64 3aaw n GLY 178 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3aaw s VAL 179 N -2.00 4.36 0.25 1.61 1.01 -1.26 -4.95 120.40 119.41 3aaw s VAL 179 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 61.98 61.86 3aaw s VAL 179 Cb 0.00 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 33.41 3aaw s VAL 179 CO 0.00 0.48 0.12 -0.31 0.00 0.00 0.00 175.10 175.40 3aaw s TYR 180 N 0.30 2.98 -0.53 5.22 2.02 -1.26 0.58 117.35 126.65 3aaw s TYR 180 Ca 0.00 -0.14 0.25 0.00 -0.37 0.00 0.00 57.07 56.81 3aaw s TYR 180 Cb -0.13 -1.35 0.93 0.00 -0.40 0.00 0.00 41.96 41.01 3aaw s TYR 180 CO 0.02 0.55 1.75 1.79 -1.57 0.00 0.00 175.55 178.08 3aaw h THR 181 N 1.69 0.00 -2.42 -0.71 1.35 -1.40 -3.45 112.91 107.97 3aaw h THR 181 Ca -0.47 -0.35 0.19 0.00 -0.55 0.00 0.00 66.41 65.23 3aaw h THR 181 Cb 1.24 1.20 -0.05 0.00 -1.73 0.00 0.00 68.15 68.81 3aaw h THR 181 CO 0.61 0.00 0.63 0.00 -0.25 0.00 0.00 175.52 176.50 3aaw s ALA 182 N -3.26 -1.74 -0.24 6.62 0.00 -1.26 -0.15 121.76 121.73 3aaw s ALA 182 Ca 0.06 -0.21 -0.29 0.00 0.00 0.00 0.00 51.96 51.53 3aaw s ALA 182 Cb 0.10 0.75 -0.02 0.00 0.00 0.00 0.00 23.12 23.96 3aaw s ALA 182 CO 0.48 -1.07 1.48 0.34 0.00 0.00 0.00 175.76 176.98 3aaw s ASP 183 N -3.40 6.53 0.46 0.00 2.15 -1.26 -4.75 116.67 116.40 3aaw s ASP 183 Ca 0.22 1.48 0.17 0.00 0.43 0.00 0.00 52.55 54.85 3aaw s ASP 183 Cb -0.02 -2.54 1.10 0.00 -0.30 0.00 0.00 42.92 41.17 3aaw s ASP 183 CO 0.04 -1.16 2.01 -0.65 -0.17 0.00 0.00 175.17 175.24 3aaw h PRO 184 N 10.01 0.00 0.00 4.34 0.11 -1.93 0.17 132.00 144.71 3aaw h PRO 184 Ca -0.31 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.77 3aaw h PRO 184 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3aaw h PRO 184 CO 1.01 0.18 -0.18 0.07 -0.21 0.00 0.00 178.00 178.87 3aaw h ARG 185 N 0.00 0.00 0.02 1.05 0.11 -1.97 -3.26 114.38 110.33 3aaw h ARG 185 Ca -0.00 0.00 -0.38 0.00 0.10 0.00 0.00 59.98 59.70 3aaw h ARG 185 Cb 0.33 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.36 3aaw h ARG 185 CO 0.02 0.18 -2.16 -0.89 0.10 0.00 0.00 179.97 177.22 3aaw n ILE 186 N -3.82 1.57 -3.54 0.08 2.08 -0.60 -4.82 119.36 110.29 3aaw n ILE 186 Ca -0.02 -0.41 -0.41 0.00 0.56 0.00 0.00 62.75 62.47 3aaw n ILE 186 Cb 0.28 -1.76 -0.08 0.00 -0.75 0.00 0.00 39.64 37.32 3aaw n ILE 186 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 3aaw s VAL 187 N -2.49 4.24 0.62 1.39 1.01 0.51 -4.94 120.40 120.76 3aaw s VAL 187 Ca -0.33 -1.79 0.37 0.00 0.00 0.00 0.00 61.98 60.23 3aaw s VAL 187 Cb 0.10 -3.80 0.40 0.00 0.00 0.00 0.00 36.38 33.08 3aaw s VAL 187 CO 0.59 -0.78 2.31 1.55 0.00 0.00 0.00 175.10 178.77 3aaw h PRO 188 N 8.45 0.00 -0.38 2.72 0.13 -1.85 -0.30 132.00 140.77 3aaw h PRO 188 Ca -0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.92 3aaw h PRO 188 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 3aaw h PRO 188 CO 0.87 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.73 3aaw n ASN 189 N -3.48 1.95 -4.73 1.44 4.13 -1.26 -4.95 115.26 108.36 3aaw n ASN 189 Ca -0.03 -2.04 -0.40 0.00 1.68 0.00 0.00 54.58 53.80 3aaw n ASN 189 Cb 0.08 -0.26 0.02 0.00 -1.54 0.00 0.00 39.78 38.08 3aaw n ASN 189 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3aaw n ALA 190 N 0.49 1.58 -2.71 5.41 0.00 -0.12 -4.32 120.51 120.83 3aaw n ALA 190 Ca 0.12 0.21 -0.17 0.00 0.00 0.00 0.00 53.44 53.59 3aaw n ALA 190 Cb 0.32 -2.33 -0.14 0.00 0.00 0.00 0.00 19.45 17.30 3aaw n ALA 190 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3aaw s GLN 191 N -2.50 0.62 0.16 0.00 0.74 -1.26 -4.92 119.66 112.49 3aaw s GLN 191 Ca 0.65 -0.31 -0.32 0.00 0.05 0.00 0.00 55.36 55.43 3aaw s GLN 191 Cb -0.46 -0.59 -0.10 0.00 1.10 0.00 0.00 33.01 32.96 3aaw s GLN 191 CO 0.55 0.16 1.60 0.21 -0.55 0.00 0.00 175.29 177.26 3aaw s LYS 192 N -0.29 4.20 0.28 1.67 2.20 -1.26 -1.20 119.74 125.35 3aaw s LYS 192 Ca 0.02 2.39 -0.29 0.00 -0.36 0.00 0.00 55.97 57.73 3aaw s LYS 192 Cb -0.03 -3.20 -0.09 0.00 -1.51 0.00 0.00 37.83 32.99 3aaw s LYS 192 CO -0.00 -0.64 1.16 -0.51 -0.36 0.00 0.00 175.35 175.00 3aaw s LEU 193 N 1.32 4.51 0.01 5.43 2.01 0.20 -4.93 118.68 127.23 3aaw s LEU 193 Ca 0.71 2.36 -0.23 0.00 0.01 0.00 0.00 54.13 56.98 3aaw s LEU 193 Cb -0.44 -3.63 -0.17 0.00 0.01 0.00 0.00 46.19 41.96 3aaw s LEU 193 CO 0.31 -0.27 1.33 -0.08 1.01 0.00 0.00 176.35 178.65 3aaw h GLU 194 N 3.95 0.17 -2.57 1.70 4.81 -1.88 -3.39 114.58 117.38 3aaw h GLU 194 Ca -0.47 -0.09 -0.05 0.00 -0.13 0.00 0.00 59.36 58.62 3aaw h GLU 194 Cb 1.22 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.43 3aaw h GLU 194 CO 0.68 0.59 0.12 0.21 -0.73 0.00 0.00 179.01 179.88 3aaw s LYS 195 N -4.38 1.09 0.24 1.92 2.20 -1.26 -1.90 119.74 117.65 3aaw s LYS 195 Ca -0.15 -0.12 -0.18 0.00 -0.36 0.00 0.00 55.97 55.15 3aaw s LYS 195 Cb 0.04 0.51 0.02 0.00 -1.51 0.00 0.00 37.83 36.88 3aaw s LYS 195 CO 0.71 -0.40 0.60 -0.48 -0.36 0.00 0.00 175.35 175.42 3aaw s LEU 196 N -1.88 -0.06 0.61 5.43 2.34 -0.50 -4.95 118.68 119.67 3aaw s LEU 196 Ca -0.06 -0.59 -0.07 0.00 0.06 0.00 0.00 54.13 53.48 3aaw s LEU 196 Cb -0.01 2.33 0.01 0.00 -0.56 0.00 0.00 46.19 47.96 3aaw s LEU 196 CO -0.00 -1.18 0.94 -0.94 -1.06 0.00 0.00 176.35 174.10 3aaw s SER 197 N -2.91 5.59 0.13 1.48 1.04 -1.26 -1.61 113.70 116.16 3aaw s SER 197 Ca 0.12 0.81 -0.21 0.00 0.48 0.00 0.00 55.95 57.15 3aaw s SER 197 Cb -0.03 -1.77 -0.01 0.00 0.10 0.00 0.00 66.02 64.31 3aaw s SER 197 CO 0.03 -1.10 1.68 -0.26 0.98 0.00 0.00 173.24 174.57 3aaw h PHE 198 N -0.25 -0.28 -0.60 5.02 -1.00 -1.69 -1.69 116.94 116.45 3aaw h PHE 198 Ca -0.45 0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.37 3aaw h PHE 198 Cb 1.25 0.15 -0.04 0.00 3.61 0.00 0.00 35.95 40.93 3aaw h PHE 198 CO 0.48 -0.17 0.37 0.93 -1.61 0.00 0.00 178.31 178.31 3aaw h GLU 199 N -0.11 0.72 -0.75 1.51 3.07 -1.94 0.46 114.58 117.54 3aaw h GLU 199 Ca 0.11 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 58.88 3aaw h GLU 199 Cb 0.27 -0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 27.98 3aaw h GLU 199 CO -0.25 0.48 0.29 0.93 -1.40 0.00 0.00 179.01 179.06 3aaw h GLU 200 N 0.74 1.12 -0.39 2.33 5.08 -1.89 -0.32 114.58 121.25 3aaw h GLU 200 Ca 0.24 -0.20 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 3aaw h GLU 200 Cb 0.00 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 3aaw h GLU 200 CO -0.09 0.91 -0.28 1.98 -1.00 0.00 0.00 179.01 180.53 3aaw h MET 201 N 1.09 0.88 -0.87 2.33 4.05 -0.61 -2.02 114.93 119.78 3aaw h MET 201 Ca 0.25 -0.42 0.08 0.00 -0.28 0.00 0.00 59.70 59.33 3aaw h MET 201 Cb 0.21 -0.01 -0.07 0.00 -0.80 0.00 0.00 31.60 30.94 3aaw h MET 201 CO -0.02 1.07 0.52 -0.07 0.23 0.00 0.00 176.91 178.64 3aaw h LEU 202 N 0.69 0.80 -0.08 3.39 4.07 0.47 -1.41 115.31 123.24 3aaw h LEU 202 Ca 0.08 0.03 -0.12 0.00 0.08 0.00 0.00 57.88 57.95 3aaw h LEU 202 Cb 0.85 -0.13 0.01 0.00 1.08 0.00 0.00 40.66 42.47 3aaw h LEU 202 CO 0.07 0.48 -0.40 -0.33 -1.08 0.00 0.00 178.44 177.19 3aaw h GLU 203 N 0.92 0.41 -0.51 1.13 4.39 -0.93 -1.44 114.58 118.54 3aaw h GLU 203 Ca 0.40 -0.34 0.05 0.00 0.34 0.00 0.00 59.36 59.81 3aaw h GLU 203 Cb 0.27 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.94 3aaw h GLU 203 CO -0.21 0.98 0.24 -0.07 -1.16 0.00 0.00 179.01 178.79 3aaw h LEU 204 N -0.06 0.33 -1.30 1.33 3.38 -1.28 -1.79 115.31 115.93 3aaw h LEU 204 Ca -0.03 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3aaw h LEU 204 Cb 1.06 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 3aaw h LEU 204 CO 0.08 0.23 -0.05 0.00 0.09 0.00 0.00 178.44 178.79 3aaw h ALA 205 N 1.29 1.01 0.00 1.53 0.00 -1.24 -2.86 119.26 118.99 3aaw h ALA 205 Ca 0.23 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 3aaw h ALA 205 Cb 0.16 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3aaw h ALA 205 CO -0.18 0.07 -0.49 0.00 0.00 0.00 0.00 179.25 178.65 3aaw h ALA 206 N 1.95 1.15 0.00 0.00 0.00 -0.36 -3.33 119.26 118.67 3aaw h ALA 206 Ca -0.00 -0.45 -0.04 0.00 0.00 0.00 0.00 54.91 54.42 3aaw h ALA 206 Cb 0.59 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 3aaw h ALA 206 CO 0.01 0.61 -0.55 1.33 0.00 0.00 0.00 179.25 180.65 3aaw n VAL 207 N -3.89 1.54 -2.82 0.00 0.24 -1.10 -5.06 118.33 107.24 3aaw n VAL 207 Ca -0.01 -2.42 0.00 0.00 -2.04 0.00 0.00 64.34 59.86 3aaw n VAL 207 Cb 0.52 0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 3aaw n VAL 207 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3aaw n GLY 208 N -0.74 1.76 3.77 7.63 0.00 -1.10 -4.49 105.19 112.02 3aaw n GLY 208 Ca 0.15 -0.78 -0.35 0.00 0.00 0.00 0.00 46.02 45.03 3aaw n GLY 208 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3aaw s SER 209 N 0.78 5.63 -0.42 1.61 1.04 -1.26 -4.83 113.70 116.24 3aaw s SER 209 Ca 0.00 2.24 -0.14 0.00 0.48 0.00 0.00 55.95 58.54 3aaw s SER 209 Cb 0.00 -2.59 0.05 0.00 0.10 0.00 0.00 66.02 63.58 3aaw s SER 209 CO 0.00 -1.29 0.31 -0.54 0.98 0.00 0.00 173.24 172.70 3aaw s LYS 210 N -3.25 2.89 0.10 4.02 3.01 -1.26 -4.58 119.74 120.68 3aaw s LYS 210 Ca 0.73 -1.19 -0.14 0.00 -1.01 0.00 0.00 55.97 54.36 3aaw s LYS 210 Cb -0.26 -3.95 -0.10 0.00 -1.01 0.00 0.00 37.83 32.50 3aaw s LYS 210 CO 0.29 -0.85 1.38 0.82 0.51 0.00 0.00 175.35 177.50 3aaw h ILE 211 N 5.78 1.30 -2.45 2.17 1.08 -1.95 -3.46 117.51 119.98 3aaw h ILE 211 Ca -0.27 -1.66 -0.54 0.00 -0.39 0.00 0.00 64.86 62.00 3aaw h ILE 211 Cb 1.11 1.71 -0.14 0.00 -3.07 0.00 0.00 36.82 36.43 3aaw h ILE 211 CO 0.77 0.53 -0.71 -0.76 -0.69 0.00 0.00 178.15 177.29 3aaw s LEU 212 N -8.76 2.58 0.14 1.44 1.02 -1.26 -5.11 118.68 108.72 3aaw s LEU 212 Ca -0.12 -1.12 -0.31 0.00 0.02 0.00 0.00 54.13 52.60 3aaw s LEU 212 Cb 0.09 -0.82 -0.08 0.00 0.02 0.00 0.00 46.19 45.39 3aaw s LEU 212 CO 0.86 -0.19 1.42 -0.69 0.02 0.00 0.00 176.35 177.77 3aaw s VAL 213 N -2.81 3.15 0.19 -1.59 1.01 -1.26 -4.93 120.40 114.16 3aaw s VAL 213 Ca 0.29 0.84 -0.14 0.00 0.00 0.00 0.00 61.98 62.97 3aaw s VAL 213 Cb 0.01 -3.54 0.16 0.00 0.00 0.00 0.00 36.38 33.01 3aaw s VAL 213 CO 0.12 0.07 1.66 -0.07 0.00 0.00 0.00 175.10 176.89 3aaw h LEU 214 N 6.59 -0.34 -1.00 3.92 4.07 -1.99 -1.94 115.31 124.63 3aaw h LEU 214 Ca -0.43 0.14 0.14 0.00 0.08 0.00 0.00 57.88 57.82 3aaw h LEU 214 Cb 1.21 0.27 -0.09 0.00 1.08 0.00 0.00 40.66 43.13 3aaw h LEU 214 CO 0.86 -0.13 0.62 -0.09 -1.08 0.00 0.00 178.44 178.62 3aaw h ARG 215 N 0.06 0.88 -0.22 1.13 1.12 -1.99 -1.45 114.38 113.91 3aaw h ARG 215 Ca 0.26 -0.05 -0.18 0.00 -1.11 0.00 0.00 59.98 58.90 3aaw h ARG 215 Cb 0.41 -0.20 -0.00 0.00 -0.01 0.00 0.00 29.97 30.17 3aaw h ARG 215 CO -0.49 0.58 -0.58 0.66 -3.11 0.00 0.00 179.97 177.03 3aaw h SER 216 N 0.91 0.80 -0.77 -3.80 4.64 -1.73 -1.63 113.55 111.97 3aaw h SER 216 Ca 0.52 -0.44 -0.06 0.00 -0.47 0.00 0.00 61.79 61.34 3aaw h SER 216 Cb 0.63 -0.23 -0.03 0.00 -0.31 0.00 0.00 62.40 62.45 3aaw h SER 216 CO -0.31 1.21 0.26 0.58 -0.87 0.00 0.00 176.83 177.70 3aaw h VAL 217 N 0.54 1.26 -0.69 0.95 2.07 -1.06 -1.48 116.25 117.83 3aaw h VAL 217 Ca 0.00 -0.88 -0.06 0.00 0.82 0.00 0.00 66.70 66.58 3aaw h VAL 217 Cb 1.17 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 3aaw h VAL 217 CO 0.12 0.35 0.21 -0.08 0.02 0.00 0.00 177.57 178.20 3aaw h GLU 218 N 1.13 1.07 -0.55 1.57 4.57 -1.10 0.87 114.58 122.14 3aaw h GLU 218 Ca 0.25 -0.22 0.01 0.00 -1.18 0.00 0.00 59.36 58.22 3aaw h GLU 218 Cb 0.28 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.68 3aaw h GLU 218 CO -0.01 0.91 0.35 -0.92 -1.18 0.00 0.00 179.01 178.16 3aaw h TYR 219 N 1.03 0.67 -0.32 0.92 5.03 -1.03 -1.26 116.97 122.01 3aaw h TYR 219 Ca 0.23 0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.57 3aaw h TYR 219 Cb 0.29 -0.22 -0.02 0.00 1.55 0.00 0.00 36.73 38.32 3aaw h TYR 219 CO 0.02 0.41 0.17 0.00 -1.32 0.00 0.00 178.16 177.44 3aaw h ALA 220 N 1.22 0.39 -0.51 1.82 0.00 -0.34 -2.29 119.26 119.55 3aaw h ALA 220 Ca 0.21 0.00 0.05 0.00 0.00 0.00 0.00 54.91 55.17 3aaw h ALA 220 Cb -0.05 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 3aaw h ALA 220 CO -0.06 -0.20 0.25 -0.09 0.00 0.00 0.00 179.25 179.15 3aaw h ARG 221 N 0.35 0.48 -0.41 0.00 2.43 -0.62 0.37 114.38 116.98 3aaw h ARG 221 Ca 0.13 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3aaw h ARG 221 Cb 0.02 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3aaw h ARG 221 CO -0.08 0.31 0.12 0.00 -1.51 0.00 0.00 179.97 178.82 3aaw h ALA 222 N 1.28 1.44 -0.03 2.80 0.00 -0.78 -2.88 119.26 121.09 3aaw h ALA 222 Ca 0.23 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3aaw h ALA 222 Cb 0.14 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.76 3aaw h ALA 222 CO -0.16 0.41 0.00 1.19 0.00 0.00 0.00 179.25 180.69 3aaw n PHE 223 N -4.34 0.01 -3.58 0.00 3.72 -0.90 -4.99 117.46 107.38 3aaw n PHE 223 Ca 0.03 -0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.22 3aaw n PHE 223 Cb 0.18 -0.00 0.05 0.00 -0.94 0.00 0.00 39.48 38.77 3aaw n PHE 223 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3aaw n ASN 224 N 1.10 -2.40 -4.59 4.37 4.13 0.12 -4.98 115.26 113.02 3aaw n ASN 224 Ca 0.12 -0.77 -0.39 0.00 1.68 0.00 0.00 54.58 55.21 3aaw n ASN 224 Cb 0.49 -4.41 -0.10 0.00 -1.54 0.00 0.00 39.78 34.23 3aaw n ASN 224 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 3aaw s VAL 225 N -3.54 5.20 0.29 2.41 0.11 -0.42 -5.01 120.40 119.45 3aaw s VAL 225 Ca 0.10 0.36 -0.29 0.00 -2.93 0.00 0.00 61.98 59.22 3aaw s VAL 225 Cb -0.02 -3.69 -0.10 0.00 -1.53 0.00 0.00 36.38 31.04 3aaw s VAL 225 CO 0.79 0.12 1.37 -2.84 -3.33 0.00 0.00 175.10 171.21 3aaw s PRO 226 N 1.99 4.30 0.06 1.54 0.02 -1.26 -4.73 135.00 136.92 3aaw s PRO 226 Ca 0.12 2.27 0.07 0.00 0.02 0.00 0.00 61.00 63.48 3aaw s PRO 226 Cb -0.16 -3.09 -0.04 0.00 0.02 0.00 0.00 34.50 31.24 3aaw s PRO 226 CO 0.11 -0.31 -0.14 -0.51 -0.33 0.00 0.00 177.00 175.81 3aaw s LEU 227 N -1.14 2.81 -0.17 -5.54 1.43 -0.11 -0.85 118.68 115.12 3aaw s LEU 227 Ca 0.54 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 53.24 3aaw s LEU 227 Cb -0.41 -1.64 0.04 0.00 0.03 0.00 0.00 46.19 44.21 3aaw s LEU 227 CO 0.49 0.23 -0.04 -0.60 0.23 0.00 0.00 176.35 176.66 3aaw s ARG 228 N -1.71 1.33 -0.29 1.70 3.52 -0.49 -0.29 118.95 122.72 3aaw s ARG 228 Ca 0.17 -0.49 -0.23 0.00 -0.13 0.00 0.00 55.73 55.05 3aaw s ARG 228 Cb -0.11 -1.98 -0.00 0.00 -1.56 0.00 0.00 34.95 31.30 3aaw s ARG 228 CO 0.08 -0.45 0.77 0.08 -0.81 0.00 0.00 175.30 174.98 3aaw s VAL 229 N 1.66 4.82 0.13 7.11 1.01 -0.10 0.29 120.40 135.33 3aaw s VAL 229 Ca 0.01 1.23 -0.15 0.00 0.00 0.00 0.00 61.98 63.06 3aaw s VAL 229 Cb -0.15 -4.12 0.03 0.00 0.00 0.00 0.00 36.38 32.14 3aaw s VAL 229 CO -0.08 -0.19 0.39 0.00 0.00 0.00 0.00 175.10 175.23 3aaw s ARG 230 N 2.88 1.09 0.24 2.72 1.70 -0.97 -0.98 118.95 125.64 3aaw s ARG 230 Ca 0.32 -0.77 -0.24 0.00 -0.47 0.00 0.00 55.73 54.57 3aaw s ARG 230 Cb -0.14 0.46 -0.09 0.00 -0.57 0.00 0.00 34.95 34.61 3aaw s ARG 230 CO 0.11 -0.43 0.83 0.45 -1.08 0.00 0.00 175.30 175.19 3aaw s SER 231 N -2.83 7.29 0.00 -2.89 0.15 -1.19 -2.52 113.70 111.72 3aaw s SER 231 Ca 0.05 1.67 0.21 0.00 0.70 0.00 0.00 55.95 58.57 3aaw s SER 231 Cb 0.02 -2.51 0.72 0.00 -1.71 0.00 0.00 66.02 62.54 3aaw s SER 231 CO -0.10 0.06 1.53 -1.54 1.20 0.00 0.00 173.24 174.39 3aaw n SER 232 N 0.96 1.77 -0.01 5.45 3.41 -0.32 -4.04 113.62 120.84 3aaw n SER 232 Ca -0.02 -1.73 0.09 0.00 -0.26 0.00 0.00 58.87 56.96 3aaw n SER 232 Cb 0.50 -0.11 -0.14 0.00 -0.26 0.00 0.00 64.21 64.19 3aaw n SER 232 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 3aaw n TYR 233 N 0.39 0.00 -4.04 7.33 4.01 -1.26 -4.91 117.16 118.68 3aaw n TYR 233 Ca 0.16 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.88 3aaw n TYR 233 Cb 0.35 -0.39 -0.00 0.00 -0.31 0.00 0.00 39.34 38.98 3aaw n TYR 233 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3aaw n SER 234 N -2.08 1.31 -0.34 7.72 3.41 -1.26 -5.06 113.62 117.32 3aaw n SER 234 Ca -0.03 -1.15 0.09 0.00 -0.26 0.00 0.00 58.87 57.52 3aaw n SER 234 Cb 0.46 0.06 0.17 0.00 -0.26 0.00 0.00 64.21 64.64 3aaw n SER 234 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3aaw n ASN 235 N -1.71 2.82 -4.69 4.04 4.13 -1.26 -4.84 115.26 113.75 3aaw n ASN 235 Ca -0.01 -2.94 -0.44 0.00 1.68 0.00 0.00 54.58 52.87 3aaw n ASN 235 Cb 0.04 -0.42 -0.04 0.00 -1.54 0.00 0.00 39.78 37.82 3aaw n ASN 235 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 3aaw n ASP 236 N -1.00 3.55 0.00 6.41 -0.08 -1.26 -4.88 116.55 119.30 3aaw n ASP 236 Ca 0.16 1.07 0.08 0.00 -1.51 0.00 0.00 54.79 54.59 3aaw n ASP 236 Cb 0.68 -1.50 0.41 0.00 2.34 0.00 0.00 41.12 43.05 3aaw n ASP 236 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 3aaw n PRO 237 N 3.81 0.17 0.00 -0.67 -0.04 -1.26 -4.51 135.00 132.50 3aaw n PRO 237 Ca 0.17 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.78 3aaw n PRO 237 Cb 0.32 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 3aaw n PRO 237 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3aaw n GLY 238 N 0.18 -0.82 3.46 0.55 0.00 -1.26 -4.82 105.19 102.49 3aaw n GLY 238 Ca 0.07 -1.17 -0.33 0.00 0.00 0.00 0.00 46.02 44.59 3aaw n GLY 238 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3aaw s THR 239 N 0.00 3.23 -0.13 2.61 2.01 -0.15 -4.81 115.64 118.40 3aaw s THR 239 Ca 0.00 -0.64 -0.14 0.00 0.31 0.00 0.00 61.69 61.23 3aaw s THR 239 Cb 0.00 -2.31 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 3aaw s THR 239 CO 0.00 0.57 0.31 -0.22 -0.69 0.00 0.00 174.62 174.58 3aaw s LEU 240 N -0.35 4.30 -0.32 4.42 2.96 -0.80 -0.92 118.68 127.97 3aaw s LEU 240 Ca 0.04 0.60 -0.02 0.00 -0.22 0.00 0.00 54.13 54.53 3aaw s LEU 240 Cb -0.13 -2.40 0.06 0.00 0.50 0.00 0.00 46.19 44.23 3aaw s LEU 240 CO 0.02 0.16 0.04 -0.63 -1.32 0.00 0.00 176.35 174.63 3aaw s ILE 241 N 0.06 3.00 0.03 6.68 1.01 0.60 -1.41 121.20 131.17 3aaw s ILE 241 Ca 0.18 -1.56 -0.25 0.00 0.00 0.00 0.00 60.65 59.02 3aaw s ILE 241 Cb -0.14 -2.81 0.06 0.00 0.01 0.00 0.00 42.46 39.58 3aaw s ILE 241 CO 0.06 -0.24 0.57 0.00 0.00 0.00 0.00 174.94 175.33 3aaw s ALA 242 N 1.21 -1.48 0.03 9.38 0.00 -0.64 -0.93 121.76 129.34 3aaw s ALA 242 Ca -0.02 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.75 3aaw s ALA 242 Cb -0.20 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.22 3aaw s ALA 242 CO -0.02 -0.48 0.00 0.41 0.00 0.00 0.00 175.76 175.67 3aaw n GLY 243 N 0.52 -2.98 3.85 0.00 0.00 -1.26 -4.06 105.19 101.26 3aaw n GLY 243 Ca -0.19 -1.20 -0.32 0.00 0.00 0.00 0.00 46.02 44.32 3aaw n GLY 243 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3aaw s SER 244 N -2.57 6.62 0.35 1.61 0.15 -1.26 -2.50 113.70 116.11 3aaw s SER 244 Ca 0.00 1.42 0.09 0.00 0.70 0.00 0.00 55.95 58.16 3aaw s SER 244 Cb 0.00 -2.44 0.65 0.00 -1.71 0.00 0.00 66.02 62.52 3aaw s SER 244 CO 0.00 -0.49 1.82 -0.03 1.20 0.00 0.00 173.24 175.74 3aaw h MET 245 N 1.17 0.22 -0.98 5.44 -1.53 -1.94 -2.98 114.93 114.33 3aaw h MET 245 Ca -0.47 -0.07 0.06 0.00 -3.44 0.00 0.00 59.70 55.78 3aaw h MET 245 Cb 1.18 -0.02 -0.06 0.00 -0.55 0.00 0.00 31.60 32.15 3aaw h MET 245 CO 0.62 0.47 0.63 0.93 0.14 0.00 0.00 176.91 179.70 3aaw h GLU 246 N 0.20 1.13 -0.09 0.39 4.39 -2.02 -2.63 114.58 115.95 3aaw h GLU 246 Ca 0.03 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.66 3aaw h GLU 246 Cb 0.57 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 3aaw h GLU 246 CO 0.04 0.75 0.00 -0.25 -1.16 0.00 0.00 179.01 178.39 3aaw n ASP 247 N -4.51 1.02 -4.66 1.42 10.43 -1.13 -4.74 116.55 114.39 3aaw n ASP 247 Ca 0.15 -1.57 -0.39 0.00 2.57 0.00 0.00 54.79 55.55 3aaw n ASP 247 Cb 0.16 -0.06 -0.07 0.00 1.84 0.00 0.00 41.12 42.99 3aaw n ASP 247 CO 0.00 0.00 0.00 -0.51 -1.07 0.00 0.00 177.20 175.62 3aaw s ILE 248 N -1.88 5.13 0.49 0.53 2.07 -0.99 -5.02 121.20 121.53 3aaw s ILE 248 Ca 0.32 0.85 -0.23 0.00 -1.41 0.00 0.00 60.65 60.18 3aaw s ILE 248 Cb 0.16 -3.80 -0.07 0.00 0.13 0.00 0.00 42.46 38.89 3aaw s ILE 248 CO 0.25 0.19 1.30 -2.16 -1.91 0.00 0.00 174.94 172.61 3aaw s PRO 249 N 1.65 3.51 0.35 3.50 0.04 -1.26 -4.81 135.00 137.98 3aaw s PRO 249 Ca 0.22 2.11 0.09 0.00 0.04 0.00 0.00 61.00 63.45 3aaw s PRO 249 Cb -0.15 -2.43 0.80 0.00 0.04 0.00 0.00 34.50 32.77 3aaw s PRO 249 CO 0.09 -0.85 1.85 -0.24 0.04 0.00 0.00 177.00 177.89 3aaw h VAL 250 N 1.83 0.81 0.00 -0.36 3.04 -1.96 0.09 116.25 119.70 3aaw h VAL 250 Ca -0.50 -0.24 -0.04 0.00 -1.01 0.00 0.00 66.70 64.90 3aaw h VAL 250 Cb 1.27 0.04 -0.01 0.00 -2.01 0.00 0.00 31.29 30.59 3aaw h VAL 250 CO 0.59 0.13 -0.21 1.05 -1.01 0.00 0.00 177.57 178.13 3aaw h GLU 251 N 0.71 0.00 0.00 4.17 9.09 -2.02 -2.78 114.58 123.75 3aaw h GLU 251 Ca 0.47 0.00 -0.24 0.00 0.05 0.00 0.00 59.36 59.64 3aaw h GLU 251 Cb 0.76 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 27.82 3aaw h GLU 251 CO -0.23 0.21 -1.23 0.93 0.05 0.00 0.00 179.01 178.73 3aaw h GLU 252 N 0.00 0.01 -6.33 1.06 3.07 -1.34 -3.47 114.58 107.57 3aaw h GLU 252 Ca -0.00 -0.01 -0.64 0.00 -0.50 0.00 0.00 59.36 58.20 3aaw h GLU 252 Cb 0.51 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.47 3aaw h GLU 252 CO 0.03 0.84 0.77 0.00 -1.40 0.00 0.00 179.01 179.25 3aaw n ALA 253 N -2.42 0.30 -2.54 3.43 0.00 -0.98 -4.97 120.51 113.33 3aaw n ALA 253 Ca -0.06 0.43 -0.25 0.00 0.00 0.00 0.00 53.44 53.56 3aaw n ALA 253 Cb 0.98 -2.27 -0.10 0.00 0.00 0.00 0.00 19.45 18.05 3aaw n ALA 253 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3aaw s VAL 254 N 1.80 1.27 -0.09 0.00 -7.23 -1.26 -4.25 120.40 110.64 3aaw s VAL 254 Ca 0.86 -2.00 -0.19 0.00 -1.81 0.00 0.00 61.98 58.85 3aaw s VAL 254 Cb -0.83 -2.69 -0.04 0.00 0.56 0.00 0.00 36.38 33.38 3aaw s VAL 254 CO 0.48 0.00 0.51 -0.76 -0.31 0.00 0.00 175.10 175.01 3aaw s LEU 255 N -3.61 4.31 -0.19 1.32 2.01 -1.26 -1.00 118.68 120.27 3aaw s LEU 255 Ca 0.30 0.91 -0.20 0.00 0.01 0.00 0.00 54.13 55.15 3aaw s LEU 255 Cb 0.07 -2.75 -0.17 0.00 0.01 0.00 0.00 46.19 43.35 3aaw s LEU 255 CO 0.14 0.03 0.18 0.74 1.01 0.00 0.00 176.35 178.45 3aaw h THR 256 N 4.57 0.80 -1.93 5.49 2.02 -1.29 -3.48 112.91 119.09 3aaw h THR 256 Ca -0.42 -1.99 0.31 0.00 0.77 0.00 0.00 66.41 65.08 3aaw h THR 256 Cb 1.19 1.91 -0.08 0.00 -1.74 0.00 0.00 68.15 69.42 3aaw h THR 256 CO 0.74 0.27 0.82 -0.83 0.37 0.00 0.00 175.52 176.89 3aaw s GLY 257 N -4.71 -0.20 -0.04 2.16 0.00 -1.07 -4.59 107.32 98.87 3aaw s GLY 257 Ca -0.26 0.23 0.07 0.00 0.00 0.00 0.00 44.72 44.76 3aaw s GLY 257 CO 0.53 3.05 -0.24 0.14 0.00 0.00 0.00 173.10 176.58 3aaw s VAL 258 N -2.22 2.19 0.02 1.40 1.01 0.79 -1.62 120.40 121.97 3aaw s VAL 258 Ca 0.22 -1.04 0.05 0.00 0.00 0.00 0.00 61.98 61.22 3aaw s VAL 258 Cb 0.01 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.59 3aaw s VAL 258 CO -0.01 0.58 -0.15 0.00 0.00 0.00 0.00 175.10 175.51 3aaw s ALA 259 N -0.44 1.29 0.21 5.51 0.00 -0.73 -4.16 121.76 123.43 3aaw s ALA 259 Ca 0.05 -0.81 0.06 0.00 0.00 0.00 0.00 51.96 51.26 3aaw s ALA 259 Cb -0.12 -0.25 -0.05 0.00 0.00 0.00 0.00 23.12 22.71 3aaw s ALA 259 CO 0.01 0.27 -0.10 0.95 0.00 0.00 0.00 175.76 176.89 3aaw s THR 260 N -0.69 1.51 -0.26 0.00 -4.23 -1.26 -0.86 115.64 109.85 3aaw s THR 260 Ca 0.04 -2.14 -0.14 0.00 -1.18 0.00 0.00 61.69 58.26 3aaw s THR 260 Cb -0.07 -2.12 0.08 0.00 1.34 0.00 0.00 72.50 71.73 3aaw s THR 260 CO 0.01 -0.54 0.64 -0.62 -0.54 0.00 0.00 174.62 173.57 3aaw s ASP 261 N -3.31 -0.88 -0.14 3.99 3.68 -0.78 -4.60 116.67 114.64 3aaw s ASP 261 Ca 0.23 1.41 0.15 0.00 2.13 0.00 0.00 52.55 56.48 3aaw s ASP 261 Cb 0.02 1.35 0.39 0.00 -1.45 0.00 0.00 42.92 43.22 3aaw s ASP 261 CO 0.07 -0.23 1.19 2.29 0.13 0.00 0.00 175.17 178.62 3aaw n LYS 262 N 4.40 1.07 0.00 4.34 2.85 -1.26 -1.50 118.16 128.06 3aaw n LYS 262 Ca -0.20 -2.80 0.13 0.00 -1.05 0.00 0.00 58.31 54.39 3aaw n LYS 262 Cb 0.58 -1.13 0.26 0.00 -0.65 0.00 0.00 35.03 34.08 3aaw n LYS 262 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 3aaw n SER 263 N -0.68 2.23 -4.53 -5.58 3.41 -1.26 -4.98 113.62 102.24 3aaw n SER 263 Ca 0.14 -1.69 -0.27 0.00 -0.26 0.00 0.00 58.87 56.79 3aaw n SER 263 Cb 0.81 0.06 -0.10 0.00 -0.26 0.00 0.00 64.21 64.71 3aaw n SER 263 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3aaw s GLU 264 N -2.08 1.90 0.25 4.33 2.02 -1.26 -2.10 118.70 121.76 3aaw s GLU 264 Ca 0.30 -1.32 0.06 0.00 0.02 0.00 0.00 54.97 54.03 3aaw s GLU 264 Cb 0.20 -2.08 -0.03 0.00 0.10 0.00 0.00 34.13 32.32 3aaw s GLU 264 CO 0.36 0.43 0.26 0.00 0.02 0.00 0.00 175.26 176.32 3aaw s ALA 265 N -1.65 3.72 -0.04 5.21 0.00 0.11 -4.44 121.76 124.66 3aaw s ALA 265 Ca 0.23 -1.35 0.06 0.00 0.00 0.00 0.00 51.96 50.90 3aaw s ALA 265 Cb -0.09 -1.46 -0.01 0.00 0.00 0.00 0.00 23.12 21.56 3aaw s ALA 265 CO 0.13 0.24 -0.23 -1.59 0.00 0.00 0.00 175.76 174.32 3aaw s LYS 266 N -3.90 2.23 -0.07 0.00 -2.85 0.21 -1.69 119.74 113.68 3aaw s LYS 266 Ca 0.33 -0.83 0.05 0.00 -1.00 0.00 0.00 55.97 54.53 3aaw s LYS 266 Cb -0.08 -1.96 -0.01 0.00 -2.06 0.00 0.00 37.83 33.72 3aaw s LYS 266 CO 0.26 0.38 -0.25 0.08 0.10 0.00 0.00 175.35 175.93 3aaw s VAL 267 N -0.22 2.06 -0.12 1.79 1.01 -0.13 -1.77 120.40 123.02 3aaw s VAL 267 Ca -0.01 -1.05 0.02 0.00 0.00 0.00 0.00 61.98 60.94 3aaw s VAL 267 Cb -0.12 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.52 3aaw s VAL 267 CO 0.02 0.57 -0.19 -0.89 0.00 0.00 0.00 175.10 174.61 3aaw s THR 268 N -0.01 1.77 -0.34 3.92 2.01 -0.94 -1.33 115.64 120.73 3aaw s THR 268 Ca -0.08 -0.81 -0.19 0.00 0.31 0.00 0.00 61.69 60.92 3aaw s THR 268 Cb -0.15 -1.59 -0.00 0.00 0.01 0.00 0.00 72.50 70.77 3aaw s THR 268 CO 0.05 0.49 0.58 -0.69 -0.69 0.00 0.00 174.62 174.37 3aaw s VAL 269 N 0.90 4.95 -0.11 3.82 1.01 0.37 -0.68 120.40 130.66 3aaw s VAL 269 Ca -0.07 0.58 -0.12 0.00 0.00 0.00 0.00 61.98 62.37 3aaw s VAL 269 Cb -0.15 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.18 3aaw s VAL 269 CO -0.02 -0.22 0.26 -0.76 0.00 0.00 0.00 175.10 174.37 3aaw s LEU 270 N 2.55 4.35 -0.09 3.92 1.43 0.50 -1.81 118.68 129.53 3aaw s LEU 270 Ca 0.22 0.59 -0.01 0.00 -1.03 0.00 0.00 54.13 53.91 3aaw s LEU 270 Cb -0.15 -2.31 0.00 0.00 0.03 0.00 0.00 46.19 43.76 3aaw s LEU 270 CO 0.13 0.26 0.07 0.61 0.23 0.00 0.00 176.35 177.66 3aaw n GLY 271 N 2.56 0.86 3.72 -3.19 0.00 -1.02 0.36 105.19 108.49 3aaw n GLY 271 Ca -0.15 -0.62 -0.40 0.00 0.00 0.00 0.00 46.02 44.84 3aaw n GLY 271 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3aaw s ILE 272 N -3.01 4.87 0.17 -0.61 1.01 -0.18 -3.73 121.20 119.73 3aaw s ILE 272 Ca 0.04 1.68 -0.30 0.00 0.00 0.00 0.00 60.65 62.07 3aaw s ILE 272 Cb -0.02 -4.15 -0.08 0.00 0.01 0.00 0.00 42.46 38.23 3aaw s ILE 272 CO 0.05 0.27 1.14 -0.94 0.00 0.00 0.00 174.94 175.46 3aaw s SER 273 N 0.52 7.18 -1.34 3.58 1.04 -1.26 -0.62 113.70 122.80 3aaw s SER 273 Ca 0.42 2.13 -0.17 0.00 0.48 0.00 0.00 55.95 58.81 3aaw s SER 273 Cb -0.20 -2.60 0.07 0.00 0.10 0.00 0.00 66.02 63.39 3aaw s SER 273 CO 0.23 -0.30 1.88 -0.67 0.98 0.00 0.00 173.24 175.35 3aaw n ASP 274 N 2.57 4.64 -3.94 7.02 4.64 0.26 -4.81 116.55 126.93 3aaw n ASP 274 Ca 0.04 -2.90 -0.09 0.00 -1.38 0.00 0.00 54.79 50.46 3aaw n ASP 274 Cb 0.46 -1.72 -0.09 0.00 -1.04 0.00 0.00 41.12 38.73 3aaw n ASP 274 CO 0.00 0.00 0.00 -1.59 -0.82 0.00 0.00 177.20 174.79 3aaw s LYS 275 N 3.82 0.66 0.24 -0.67 -2.85 -1.26 -4.99 119.74 114.68 3aaw s LYS 275 Ca 0.52 -0.91 -0.30 0.00 -1.00 0.00 0.00 55.97 54.28 3aaw s LYS 275 Cb 0.07 0.26 -0.15 0.00 -2.06 0.00 0.00 37.83 35.95 3aaw s LYS 275 CO 0.03 -0.17 1.04 -2.30 0.10 0.00 0.00 175.35 174.05 3aaw n PRO 276 N 0.41 1.21 0.00 1.78 -0.02 -1.26 -3.17 135.00 133.95 3aaw n PRO 276 Ca -0.17 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 3aaw n PRO 276 Cb 0.60 -1.83 0.00 0.00 -0.02 0.00 0.00 33.50 32.25 3aaw n PRO 276 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3aaw n GLY 277 N 1.59 0.93 0.17 -1.23 0.00 -1.26 -4.93 105.19 100.45 3aaw n GLY 277 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.97 3aaw n GLY 277 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3aaw h GLU 278 N 3.50 0.53 -0.82 1.61 4.39 -1.86 -2.77 114.58 119.16 3aaw h GLU 278 Ca 0.00 -0.51 0.05 0.00 0.34 0.00 0.00 59.36 59.23 3aaw h GLU 278 Cb 0.00 0.13 -0.05 0.00 -0.10 0.00 0.00 28.75 28.73 3aaw h GLU 278 CO 0.00 1.15 0.54 0.00 -1.16 0.00 0.00 179.01 179.53 3aaw h ALA 279 N 0.39 1.55 -0.71 3.43 0.00 -1.91 -2.31 119.26 119.69 3aaw h ALA 279 Ca -0.07 -0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.86 3aaw h ALA 279 Cb 1.35 -0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 3aaw h ALA 279 CO 0.14 0.35 0.42 0.00 0.00 0.00 0.00 179.25 180.15 3aaw h ALA 280 N 1.54 0.96 -0.61 0.00 0.00 -1.94 -1.12 119.26 118.08 3aaw h ALA 280 Ca 0.34 0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.30 3aaw h ALA 280 Cb 0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 3aaw h ALA 280 CO -0.11 0.12 0.35 0.87 0.00 0.00 0.00 179.25 180.48 3aaw h LYS 281 N 0.77 0.66 0.04 0.00 1.57 -1.14 0.11 116.57 118.58 3aaw h LYS 281 Ca 0.31 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3aaw h LYS 281 Cb 0.16 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.32 3aaw h LYS 281 CO -0.17 0.43 -0.02 0.28 -0.57 0.00 0.00 179.45 179.41 3aaw h VAL 282 N 0.68 1.07 0.00 0.50 2.07 -1.23 -2.97 116.25 116.36 3aaw h VAL 282 Ca 0.26 -0.35 -0.07 0.00 0.82 0.00 0.00 66.70 67.35 3aaw h VAL 282 Cb 0.09 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 3aaw h VAL 282 CO -0.14 0.09 -0.78 -0.26 0.02 0.00 0.00 177.57 176.50 3aaw h PHE 283 N -0.21 0.00 -0.50 1.57 -1.00 -0.98 -2.89 116.94 112.93 3aaw h PHE 283 Ca -0.01 0.00 -0.05 0.00 2.81 0.00 0.00 57.97 60.72 3aaw h PHE 283 Cb 0.19 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.73 3aaw h PHE 283 CO -0.02 0.29 0.11 -0.09 -1.61 0.00 0.00 178.31 176.99 3aaw h ARG 284 N 0.00 0.81 -0.76 1.51 9.65 -0.88 0.16 114.38 124.87 3aaw h ARG 284 Ca -0.05 -0.20 -0.01 0.00 -1.10 0.00 0.00 59.98 58.62 3aaw h ARG 284 Cb 1.26 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 29.70 3aaw h ARG 284 CO 0.03 0.79 0.44 0.00 2.80 0.00 0.00 179.97 184.02 3aaw h ALA 285 N 0.99 1.33 0.02 2.80 0.00 -1.46 -0.96 119.26 121.97 3aaw h ALA 285 Ca 0.16 -0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.77 3aaw h ALA 285 Cb 0.35 -0.31 0.02 0.00 0.00 0.00 0.00 17.79 17.85 3aaw h ALA 285 CO 0.00 0.56 -0.78 -0.07 0.00 0.00 0.00 179.25 178.96 3aaw h LEU 286 N 1.06 0.66 -0.72 0.00 3.38 -1.41 -3.04 115.31 115.23 3aaw h LEU 286 Ca 0.27 -0.77 0.00 0.00 0.09 0.00 0.00 57.88 57.47 3aaw h LEU 286 Cb -0.00 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 3aaw h LEU 286 CO -0.05 1.35 0.46 0.00 0.09 0.00 0.00 178.44 180.29 3aaw h ALA 287 N 0.33 0.92 -0.20 1.53 0.00 -0.80 -0.47 119.26 120.56 3aaw h ALA 287 Ca -0.10 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 3aaw h ALA 287 Cb 1.48 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3aaw h ALA 287 CO 0.15 0.36 -0.07 -0.44 0.00 0.00 0.00 179.25 179.25 3aaw h ASP 288 N 0.98 0.28 0.39 0.00 3.32 -1.23 -0.10 116.42 120.06 3aaw h ASP 288 Ca 0.26 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.26 3aaw h ASP 288 Cb -0.07 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.40 3aaw h ASP 288 CO -0.05 0.40 -0.08 0.00 -1.72 0.00 0.00 179.24 177.79 3aaw n ALA 289 N -2.49 2.69 -2.07 3.45 0.00 -0.99 -4.94 120.51 116.16 3aaw n ALA 289 Ca -0.00 -0.23 -0.09 0.00 0.00 0.00 0.00 53.44 53.11 3aaw n ALA 289 Cb 0.24 -1.38 -0.01 0.00 0.00 0.00 0.00 19.45 18.30 3aaw n ALA 289 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 3aaw n GLU 290 N -1.03 -0.73 -2.25 0.00 4.07 -0.05 -4.97 120.64 115.68 3aaw n GLU 290 Ca 0.15 0.50 -0.43 0.00 -0.06 0.00 0.00 57.16 57.32 3aaw n GLU 290 Cb 0.26 -4.50 -0.02 0.00 -0.06 0.00 0.00 31.44 27.11 3aaw n GLU 290 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 3aaw s ILE 291 N -2.45 3.98 -1.24 6.31 -1.09 -0.63 -4.91 121.20 121.17 3aaw s ILE 291 Ca 0.00 1.19 -0.17 0.00 -2.23 0.00 0.00 60.65 59.44 3aaw s ILE 291 Cb 0.00 -3.77 -0.02 0.00 -1.58 0.00 0.00 42.46 37.09 3aaw s ILE 291 CO 0.00 -0.11 2.13 0.59 -1.23 0.00 0.00 174.94 176.32 3aaw n ASN 292 N 6.84 3.44 -4.76 3.58 5.03 -1.26 -4.67 115.26 123.46 3aaw n ASN 292 Ca 0.15 -2.79 -0.33 0.00 0.87 0.00 0.00 54.58 52.49 3aaw n ASN 292 Cb 0.44 -1.49 0.07 0.00 -1.02 0.00 0.00 39.78 37.78 3aaw n ASN 292 CO 0.00 0.00 0.00 0.27 -1.83 0.00 0.00 177.26 175.70 3aaw s ILE 293 N 3.79 3.06 0.29 2.41 -5.25 -1.26 -4.34 121.20 119.90 3aaw s ILE 293 Ca 0.50 0.47 -0.17 0.00 -0.99 0.00 0.00 60.65 60.46 3aaw s ILE 293 Cb 0.14 -2.97 0.02 0.00 2.95 0.00 0.00 42.46 42.60 3aaw s ILE 293 CO -0.02 -0.33 0.65 -0.62 -1.79 0.00 0.00 174.94 172.83 3aaw s ASP 294 N -2.62 -0.10 -1.48 4.36 2.15 0.19 -4.96 116.67 114.21 3aaw s ASP 294 Ca 0.67 -0.84 -0.03 0.00 0.43 0.00 0.00 52.55 52.78 3aaw s ASP 294 Cb -0.21 0.71 0.03 0.00 -0.30 0.00 0.00 42.92 43.14 3aaw s ASP 294 CO 0.45 -1.34 0.40 0.80 -0.17 0.00 0.00 175.17 175.30 3aaw n MET 295 N -0.46 -2.82 -1.95 4.34 1.56 -1.26 -0.60 117.12 115.92 3aaw n MET 295 Ca -0.04 0.34 -0.42 0.00 -0.27 0.00 0.00 57.70 57.32 3aaw n MET 295 Cb 0.60 -4.44 -0.02 0.00 2.15 0.00 0.00 33.22 31.50 3aaw n MET 295 CO 0.00 0.00 0.00 0.08 -0.73 0.00 0.00 175.97 175.32 3aaw s VAL 296 N -3.93 2.56 -0.02 1.12 1.01 -1.26 -4.28 120.40 115.59 3aaw s VAL 296 Ca 0.12 0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.54 3aaw s VAL 296 Cb -0.07 -3.28 0.03 0.00 0.00 0.00 0.00 36.38 33.06 3aaw s VAL 296 CO 0.92 0.06 0.02 -0.22 0.00 0.00 0.00 175.10 175.87 3aaw s LEU 297 N 0.18 1.14 -0.07 3.92 2.96 0.85 -4.99 118.68 122.67 3aaw s LEU 297 Ca 0.64 0.02 -0.03 0.00 -0.22 0.00 0.00 54.13 54.54 3aaw s LEU 297 Cb -0.43 -0.12 0.04 0.00 0.50 0.00 0.00 46.19 46.18 3aaw s LEU 297 CO 0.39 -0.11 0.14 -1.58 -1.32 0.00 0.00 176.35 173.87 3aaw s GLN 298 N 1.01 0.05 0.57 1.98 0.74 -1.26 -0.80 119.66 121.95 3aaw s GLN 298 Ca -0.09 0.44 0.09 0.00 0.05 0.00 0.00 55.36 55.85 3aaw s GLN 298 Cb -0.13 -0.24 0.08 0.00 1.10 0.00 0.00 33.01 33.82 3aaw s GLN 298 CO -0.02 -0.23 0.72 1.21 -0.55 0.00 0.00 175.29 176.41 3aaw s ASN 299 N 1.69 5.01 0.47 6.67 3.84 -1.26 -5.07 114.94 126.29 3aaw s ASN 299 Ca -0.03 -0.93 -0.24 0.00 0.21 0.00 0.00 52.86 51.87 3aaw s ASN 299 Cb -0.12 0.32 -0.08 0.00 -0.55 0.00 0.00 41.25 40.83 3aaw s ASN 299 CO -0.06 -1.30 1.32 1.33 -2.79 0.00 0.00 177.10 175.61 3aaw n VAL 300 N -2.15 3.03 -1.64 -5.21 0.24 -1.26 -4.74 118.33 106.59 3aaw n VAL 300 Ca 0.12 -0.50 -0.31 0.00 -2.04 0.00 0.00 64.34 61.61 3aaw n VAL 300 Cb 0.62 -1.65 0.05 0.00 -1.47 0.00 0.00 33.84 31.39 3aaw n VAL 300 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3aaw s SER 301 N -0.65 5.36 -0.02 -1.34 1.04 -1.26 -4.88 113.70 111.94 3aaw s SER 301 Ca 0.65 1.69 -0.26 0.00 0.48 0.00 0.00 55.95 58.51 3aaw s SER 301 Cb -0.46 -2.51 -0.04 0.00 0.10 0.00 0.00 66.02 63.11 3aaw s SER 301 CO 0.55 -1.46 0.83 -0.94 0.98 0.00 0.00 173.24 173.20 3aaw s SER 302 N -3.50 7.18 0.23 7.02 1.04 -0.77 -4.91 113.70 120.00 3aaw s SER 302 Ca 0.60 1.42 -0.07 0.00 0.48 0.00 0.00 55.95 58.38 3aaw s SER 302 Cb -0.15 -2.49 0.28 0.00 0.10 0.00 0.00 66.02 63.77 3aaw s SER 302 CO 0.51 -0.16 1.87 -0.37 0.98 0.00 0.00 173.24 176.06 3aaw h VAL 303 N 4.70 1.10 -0.04 5.02 -1.51 -1.95 0.20 116.25 123.77 3aaw h VAL 303 Ca -0.41 -0.35 0.01 0.00 -1.23 0.00 0.00 66.70 64.71 3aaw h VAL 303 Cb 1.21 -0.01 -0.01 0.00 -2.13 0.00 0.00 31.29 30.34 3aaw h VAL 303 CO 0.75 0.19 -0.07 -0.33 -1.23 0.00 0.00 177.57 176.87 3aaw h GLU 304 N 1.03 -0.05 0.00 5.19 4.39 -1.98 -3.32 114.58 119.83 3aaw h GLU 304 Ca 0.35 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 60.01 3aaw h GLU 304 Cb 0.06 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.72 3aaw h GLU 304 CO -0.14 -0.04 -0.67 -0.44 -1.16 0.00 0.00 179.01 176.56 3aaw h ASP 305 N -0.06 0.00 -1.70 1.42 3.32 -1.90 -3.47 116.42 114.03 3aaw h ASP 305 Ca 0.01 0.00 -0.29 0.00 0.02 0.00 0.00 57.03 56.77 3aaw h ASP 305 Cb 0.08 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.59 3aaw h ASP 305 CO -0.07 0.15 -0.34 0.61 -1.72 0.00 0.00 179.24 177.87 3aaw n GLY 306 N 1.19 0.20 3.18 2.75 0.00 0.67 -4.98 105.19 108.20 3aaw n GLY 306 Ca 0.00 -0.30 -0.14 0.00 0.00 0.00 0.00 46.02 45.58 3aaw n GLY 306 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3aaw s THR 307 N -2.67 0.94 0.15 2.61 -4.23 -1.25 -0.57 115.64 110.62 3aaw s THR 307 Ca 0.00 -1.69 0.01 0.00 -1.18 0.00 0.00 61.69 58.84 3aaw s THR 307 Cb 0.00 -1.41 -0.00 0.00 1.34 0.00 0.00 72.50 72.42 3aaw s THR 307 CO 0.00 -0.59 0.17 1.07 -0.54 0.00 0.00 174.62 174.73 3aaw n THR 308 N 0.47 0.00 -4.38 3.99 5.66 0.20 -1.84 114.28 118.39 3aaw n THR 308 Ca -0.15 -0.94 -0.24 0.00 -3.05 0.00 0.00 64.05 59.67 3aaw n THR 308 Cb 0.58 0.51 -0.11 0.00 -1.55 0.00 0.00 70.33 69.76 3aaw n THR 308 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 3aaw s ASP 309 N -1.99 3.04 -0.11 1.09 1.01 -1.26 -1.01 116.67 117.44 3aaw s ASP 309 Ca 0.15 -0.87 0.01 0.00 0.71 0.00 0.00 52.55 52.55 3aaw s ASP 309 Cb 0.00 -0.20 0.02 0.00 1.01 0.00 0.00 42.92 43.75 3aaw s ASP 309 CO 0.11 0.04 -0.11 -0.63 0.21 0.00 0.00 175.17 174.79 3aaw s ILE 310 N -1.89 1.23 0.03 0.77 1.01 -0.75 -4.28 121.20 117.32 3aaw s ILE 310 Ca 0.18 -0.45 0.04 0.00 0.00 0.00 0.00 60.65 60.42 3aaw s ILE 310 Cb -0.07 -1.19 -0.04 0.00 0.01 0.00 0.00 42.46 41.18 3aaw s ILE 310 CO 0.08 0.40 -0.06 -0.89 0.00 0.00 0.00 174.94 174.47 3aaw s THR 311 N 1.36 3.70 0.15 2.92 2.01 0.02 -0.48 115.64 125.31 3aaw s THR 311 Ca -0.00 -0.87 -0.08 0.00 0.31 0.00 0.00 61.69 61.05 3aaw s THR 311 Cb -0.14 -2.65 -0.01 0.00 0.01 0.00 0.00 72.50 69.71 3aaw s THR 311 CO -0.06 0.31 0.24 0.72 -0.69 0.00 0.00 174.62 175.14 3aaw s PHE 312 N -1.08 0.46 0.13 4.92 -0.12 -0.44 -0.10 117.98 121.75 3aaw s PHE 312 Ca 0.19 -0.83 0.07 0.00 -0.05 0.00 0.00 56.93 56.31 3aaw s PHE 312 Cb -0.11 -0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.11 3aaw s PHE 312 CO 0.10 -0.67 -0.03 0.95 -0.05 0.00 0.00 175.22 175.52 3aaw s THR 313 N -3.97 3.71 0.18 -4.49 -4.23 0.23 -0.96 115.64 106.11 3aaw s THR 313 Ca 0.17 -1.27 -0.06 0.00 -1.18 0.00 0.00 61.69 59.36 3aaw s THR 313 Cb 0.04 -2.81 -0.02 0.00 1.34 0.00 0.00 72.50 71.05 3aaw s THR 313 CO -0.01 0.01 0.23 0.00 -0.54 0.00 0.00 174.62 174.31 3aaw s PRO 315 N -4.04 3.49 0.45 0.00 0.02 -1.26 0.06 135.00 133.71 3aaw s PRO 315 Ca 0.25 2.38 0.15 0.00 0.02 0.00 0.00 61.00 63.80 3aaw s PRO 315 Cb 0.04 -2.52 1.07 0.00 0.02 0.00 0.00 34.50 33.11 3aaw s PRO 315 CO 0.05 -0.96 1.99 0.00 -0.33 0.00 0.00 177.00 177.75 3aaw h ARG 316 N 2.03 0.35 -0.22 5.54 3.08 -1.70 -0.20 114.38 123.25 3aaw h ARG 316 Ca -0.51 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 59.48 3aaw h ARG 316 Cb 1.28 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 3aaw h ARG 316 CO 0.60 0.23 -0.05 0.66 -1.07 0.00 0.00 179.97 180.33 3aaw h SER 317 N 0.36 0.31 1.15 7.04 4.64 -1.90 -2.12 113.55 123.03 3aaw h SER 317 Ca 0.26 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.52 3aaw h SER 317 Cb 0.55 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 3aaw h SER 317 CO -0.07 0.41 -0.23 0.47 -0.87 0.00 0.00 176.83 176.54 3aaw n ASP 318 N -4.31 0.65 -0.26 4.97 8.00 -0.13 -4.30 116.55 121.16 3aaw n ASP 318 Ca 0.00 0.36 0.05 0.00 0.71 0.00 0.00 54.79 55.91 3aaw n ASP 318 Cb 0.23 -0.38 0.19 0.00 -0.02 0.00 0.00 41.12 41.14 3aaw n ASP 318 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 3aaw h GLY 319 N 4.62 1.16 1.00 0.44 0.00 -0.87 -1.84 103.07 107.58 3aaw h GLY 319 Ca 0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.14 3aaw h GLY 319 CO 0.00 -0.08 -0.27 -0.09 0.00 0.00 0.00 176.54 176.10 3aaw h ARG 320 N 0.47 -0.72 -0.53 4.80 2.43 -1.75 -2.07 114.38 117.01 3aaw h ARG 320 Ca 0.41 0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.63 3aaw h ARG 320 Cb 0.61 0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 30.30 3aaw h ARG 320 CO -0.39 -0.47 0.30 -0.09 -1.51 0.00 0.00 179.97 177.81 3aaw h ARG 321 N -0.76 0.73 -0.75 0.20 2.43 -1.77 -1.12 114.38 113.34 3aaw h ARG 321 Ca -0.08 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.03 3aaw h ARG 321 Cb 0.58 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 3aaw h ARG 321 CO 0.13 0.53 0.46 0.00 -1.51 0.00 0.00 179.97 179.58 3aaw h ALA 322 N 1.59 0.95 -0.35 2.80 0.00 -1.13 -1.25 119.26 121.87 3aaw h ALA 322 Ca 0.19 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.90 3aaw h ALA 322 Cb 0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3aaw h ALA 322 CO -0.03 0.41 -0.27 1.98 0.00 0.00 0.00 179.25 181.34 3aaw h MET 323 N 1.02 0.80 -0.71 0.00 1.85 -0.61 -1.82 114.93 115.45 3aaw h MET 323 Ca 0.27 -0.39 -0.00 0.00 -0.61 0.00 0.00 59.70 58.97 3aaw h MET 323 Cb -0.06 -0.00 -0.03 0.00 0.43 0.00 0.00 31.60 31.94 3aaw h MET 323 CO -0.05 1.02 0.44 0.93 -0.40 0.00 0.00 176.91 178.85 3aaw h GLU 324 N 0.58 0.96 0.30 0.39 5.08 -0.92 0.08 114.58 121.06 3aaw h GLU 324 Ca 0.07 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 3aaw h GLU 324 Cb 0.84 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.89 3aaw h GLU 324 CO 0.07 0.68 -0.15 0.82 -1.00 0.00 0.00 179.01 179.43 3aaw h ILE 325 N 0.97 0.72 0.00 3.13 5.03 -1.17 -2.89 117.51 123.31 3aaw h ILE 325 Ca 0.26 -0.43 -0.07 0.00 -0.12 0.00 0.00 64.86 64.50 3aaw h ILE 325 Cb -0.04 0.95 -0.01 0.00 -3.03 0.00 0.00 36.82 34.69 3aaw h ILE 325 CO -0.05 0.09 -0.32 -0.07 -0.68 0.00 0.00 178.15 177.12 3aaw h LEU 326 N -0.64 0.00 -0.54 1.44 3.38 -1.24 -2.96 115.31 114.75 3aaw h LEU 326 Ca -0.04 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.82 3aaw h LEU 326 Cb 0.46 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 3aaw h LEU 326 CO 0.07 0.32 -0.10 0.11 0.09 0.00 0.00 178.44 178.93 3aaw h LYS 327 N 0.00 1.02 -0.14 1.13 1.79 -0.95 -0.03 116.57 119.40 3aaw h LYS 327 Ca -0.00 -0.38 0.05 0.00 -2.18 0.00 0.00 60.65 58.14 3aaw h LYS 327 Cb 0.61 -0.07 -0.06 0.00 -1.58 0.00 0.00 32.23 31.13 3aaw h LYS 327 CO 0.04 1.06 -0.29 0.87 -1.08 0.00 0.00 179.45 180.06 3aaw h LYS 328 N 0.90 -0.34 -0.24 3.15 6.56 -1.35 -1.94 116.57 123.30 3aaw h LYS 328 Ca 0.14 0.02 -0.02 0.00 -1.06 0.00 0.00 60.65 59.74 3aaw h LYS 328 Cb 0.67 0.08 -0.01 0.00 -0.57 0.00 0.00 32.23 32.39 3aaw h LYS 328 CO 0.05 -0.23 0.07 -0.07 -2.06 0.00 0.00 179.45 177.21 3aaw h LEU 329 N -0.36 0.30 -0.14 2.94 4.07 -1.40 -2.18 115.31 118.55 3aaw h LEU 329 Ca 0.10 -0.03 -0.00 0.00 0.08 0.00 0.00 57.88 58.03 3aaw h LEU 329 Cb 0.51 -0.08 -0.01 0.00 1.08 0.00 0.00 40.66 42.17 3aaw h LEU 329 CO -0.34 0.30 0.08 -0.61 -1.08 0.00 0.00 178.44 176.79 3aaw h GLN 330 N 0.34 0.19 0.00 1.13 4.15 -0.48 -2.69 115.11 117.75 3aaw h GLN 330 Ca 0.08 -0.02 -0.02 0.00 0.77 0.00 0.00 58.65 59.47 3aaw h GLN 330 Cb 0.11 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.76 3aaw h GLN 330 CO -0.01 0.18 -0.09 0.28 -1.93 0.00 0.00 178.83 177.26 3aaw h VAL 331 N 0.14 0.39 0.00 2.39 2.07 -0.92 0.36 116.25 120.68 3aaw h VAL 331 Ca 0.05 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.05 3aaw h VAL 331 Cb 0.04 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 3aaw h VAL 331 CO -0.01 0.09 0.00 0.00 0.02 0.00 0.00 177.57 177.67 3aaw n GLN 332 N -3.45 0.15 -0.08 1.57 6.02 -0.86 -4.92 117.38 115.81 3aaw n GLN 332 Ca -0.01 0.35 0.00 0.00 -0.01 0.00 0.00 57.00 57.32 3aaw n GLN 332 Cb 0.25 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 29.74 3aaw n GLN 332 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3aaw n GLY 333 N 0.18 0.96 0.20 1.08 0.00 0.13 -4.98 105.19 102.75 3aaw n GLY 333 Ca 0.03 -0.03 0.14 0.00 0.00 0.00 0.00 46.02 46.17 3aaw n GLY 333 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 3aaw h ASN 334 N 0.00 0.00 -5.24 1.61 2.35 -1.65 -3.47 115.58 109.19 3aaw h ASN 334 Ca 0.00 0.00 0.14 0.00 -0.55 0.00 0.00 56.30 55.89 3aaw h ASN 334 Cb 0.00 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.31 3aaw h ASN 334 CO 0.00 0.00 0.42 -1.66 -1.65 0.00 0.00 177.43 174.54 3aaw s TRP 335 N -3.42 -0.10 -0.00 1.19 -2.14 -1.26 -4.48 118.94 108.73 3aaw s TRP 335 Ca 0.04 -0.28 -0.20 0.00 2.66 0.00 0.00 56.10 58.32 3aaw s TRP 335 Cb 0.09 0.68 -0.24 0.00 -3.10 0.00 0.00 33.47 30.90 3aaw s TRP 335 CO 0.52 -0.99 1.08 1.15 -2.66 0.00 0.00 176.95 176.05 3aaw h THR 336 N 2.00 1.44 -2.95 0.66 2.02 -0.18 -3.46 112.91 112.46 3aaw h THR 336 Ca -0.24 -2.11 0.01 0.00 0.77 0.00 0.00 66.41 64.84 3aaw h THR 336 Cb 1.24 2.66 -0.11 0.00 -1.74 0.00 0.00 68.15 70.20 3aaw h THR 336 CO 0.27 0.61 0.24 0.21 0.37 0.00 0.00 175.52 177.22 3aaw s ASN 337 N -6.74 -0.49 -0.10 4.18 3.04 -0.99 -4.99 114.94 108.86 3aaw s ASN 337 Ca -0.13 -0.14 0.00 0.00 0.04 0.00 0.00 52.86 52.63 3aaw s ASN 337 Cb 0.03 0.61 0.02 0.00 -1.54 0.00 0.00 41.25 40.38 3aaw s ASN 337 CO 0.82 -1.03 -0.08 -0.69 -3.04 0.00 0.00 177.10 173.07 3aaw s VAL 338 N -3.74 1.02 0.03 -5.21 1.01 -1.26 -0.37 120.40 111.87 3aaw s VAL 338 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.70 3aaw s VAL 338 Cb -0.02 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 3aaw s VAL 338 CO -0.08 0.36 0.13 -0.76 0.00 0.00 0.00 175.10 174.74 3aaw s LEU 339 N 1.43 4.07 -0.08 3.92 1.43 0.15 -4.94 118.68 124.65 3aaw s LEU 339 Ca -0.00 0.17 0.03 0.00 -1.03 0.00 0.00 54.13 53.30 3aaw s LEU 339 Cb -0.13 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.56 3aaw s LEU 339 CO -0.05 0.22 -0.15 -0.47 0.23 0.00 0.00 176.35 176.13 3aaw s TYR 340 N -1.34 1.78 -0.18 0.29 5.04 -1.26 -2.22 117.35 119.46 3aaw s TYR 340 Ca 0.28 -0.71 -0.05 0.00 -2.44 0.00 0.00 57.07 54.15 3aaw s TYR 340 Cb -0.12 -1.26 0.07 0.00 0.35 0.00 0.00 41.96 40.99 3aaw s TYR 340 CO 0.20 -0.34 0.13 0.34 -1.34 0.00 0.00 175.55 174.54 3aaw s ASP 341 N 0.65 2.05 -0.24 4.32 2.15 -0.73 -5.02 116.67 119.85 3aaw s ASP 341 Ca -0.14 -0.50 0.12 0.00 0.43 0.00 0.00 52.55 52.45 3aaw s ASP 341 Cb -0.16 -0.04 0.47 0.00 -0.30 0.00 0.00 42.92 42.90 3aaw s ASP 341 CO 0.04 -0.34 1.38 -0.90 -0.17 0.00 0.00 175.17 175.18 3aaw n ASP 342 N 5.29 2.58 -1.27 -0.34 3.85 -1.26 -0.62 116.55 124.77 3aaw n ASP 342 Ca -0.06 -3.60 0.01 0.00 -0.71 0.00 0.00 54.79 50.43 3aaw n ASP 342 Cb 0.49 -0.58 0.11 0.00 -1.35 0.00 0.00 41.12 39.79 3aaw n ASP 342 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 3aaw n GLN 343 N -1.05 1.40 -3.92 0.11 6.02 -1.26 -4.92 117.38 113.75 3aaw n GLN 343 Ca 0.27 -3.05 -0.35 0.00 -0.01 0.00 0.00 57.00 53.86 3aaw n GLN 343 Cb 0.91 -1.21 -0.06 0.00 1.02 0.00 0.00 30.24 30.90 3aaw n GLN 343 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3aaw s VAL 344 N -2.49 5.38 0.29 5.09 0.11 -1.26 -1.36 120.40 126.16 3aaw s VAL 344 Ca 0.38 0.01 0.10 0.00 -2.93 0.00 0.00 61.98 59.54 3aaw s VAL 344 Cb 0.38 -3.42 -0.05 0.00 -1.53 0.00 0.00 36.38 31.75 3aaw s VAL 344 CO -0.08 0.49 -0.15 -0.83 -3.33 0.00 0.00 175.10 171.19 3aaw s GLY 345 N -1.43 1.93 -0.02 6.54 0.00 0.66 -4.60 107.32 110.40 3aaw s GLY 345 Ca 0.20 -1.92 0.05 0.00 0.00 0.00 0.00 44.72 43.05 3aaw s GLY 345 CO 0.10 -1.96 -0.15 -1.59 0.00 0.00 0.00 173.10 169.50 3aaw s LYS 346 N -3.57 1.30 0.02 2.90 -2.85 -0.56 -0.33 119.74 116.64 3aaw s LYS 346 Ca 0.30 -0.55 0.08 0.00 -1.00 0.00 0.00 55.97 54.80 3aaw s LYS 346 Cb -0.02 -1.24 -0.02 0.00 -2.06 0.00 0.00 37.83 34.49 3aaw s LYS 346 CO 0.14 0.31 -0.24 0.08 0.10 0.00 0.00 175.35 175.75 3aaw s VAL 347 N -0.29 1.91 0.05 1.79 1.01 -0.70 -1.87 120.40 122.31 3aaw s VAL 347 Ca 0.04 -1.18 0.01 0.00 0.00 0.00 0.00 61.98 60.86 3aaw s VAL 347 Cb -0.07 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 3aaw s VAL 347 CO -0.00 0.41 -0.06 -0.44 0.00 0.00 0.00 175.10 175.00 3aaw s SER 348 N -0.92 0.72 -0.11 3.32 0.01 -0.04 -1.20 113.70 115.49 3aaw s SER 348 Ca 0.10 -0.65 0.03 0.00 1.31 0.00 0.00 55.95 56.74 3aaw s SER 348 Cb -0.09 0.08 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 3aaw s SER 348 CO 0.01 -0.30 -0.20 -0.22 0.41 0.00 0.00 173.24 172.93 3aaw s LEU 349 N -1.90 2.32 -0.01 2.44 2.96 0.10 -1.78 118.68 122.81 3aaw s LEU 349 Ca -0.07 -0.47 0.08 0.00 -0.22 0.00 0.00 54.13 53.45 3aaw s LEU 349 Cb -0.06 -1.48 -0.02 0.00 0.50 0.00 0.00 46.19 45.13 3aaw s LEU 349 CO -0.02 0.17 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.25 3aaw s VAL 350 N 0.29 1.91 0.00 1.68 1.01 -0.64 -1.14 120.40 123.50 3aaw s VAL 350 Ca -0.15 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 60.77 3aaw s VAL 350 Cb -0.17 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.62 3aaw s VAL 350 CO 0.07 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.29 3aaw n GLY 351 N 2.40 1.11 0.39 4.51 0.00 -0.21 -0.75 105.19 112.64 3aaw n GLY 351 Ca -0.16 0.32 0.17 0.00 0.00 0.00 0.00 46.02 46.36 3aaw n GLY 351 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3aaw h ALA 352 N 0.00 2.09 0.00 4.61 0.00 -1.77 -2.03 119.26 122.16 3aaw h ALA 352 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3aaw h ALA 352 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3aaw h ALA 352 CO 0.00 -0.38 0.29 0.78 0.00 0.00 0.00 179.25 179.95 3aaw h GLY 353 N 0.49 0.00 -0.16 0.00 0.00 -1.24 -2.39 103.07 99.77 3aaw h GLY 353 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.81 3aaw h GLY 353 CO -0.21 0.00 -0.43 1.15 0.00 0.00 0.00 176.54 177.06 3aaw n MET 354 N -2.55 0.82 0.08 4.80 3.85 -0.76 -4.05 117.12 119.31 3aaw n MET 354 Ca -0.02 -0.59 -0.12 0.00 -1.00 0.00 0.00 57.70 55.97 3aaw n MET 354 Cb 0.33 -1.49 -0.07 0.00 -1.05 0.00 0.00 33.22 30.95 3aaw n MET 354 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 175.97 175.75 3aaw h LYS 355 N 1.43 -0.17 -0.09 3.17 3.64 -1.53 -3.34 116.57 119.68 3aaw h LYS 355 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3aaw h LYS 355 Cb 0.60 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 3aaw h LYS 355 CO 0.00 -0.11 0.00 0.43 -2.27 0.00 0.00 179.45 177.50 3aaw n SER 356 N -5.19 2.00 -4.29 4.20 7.64 -1.26 -4.94 113.62 111.79 3aaw n SER 356 Ca -0.07 -1.55 -0.37 0.00 1.01 0.00 0.00 58.87 57.89 3aaw n SER 356 Cb 0.11 -0.05 -0.13 0.00 -1.01 0.00 0.00 64.21 63.13 3aaw n SER 356 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 3aaw s HIS 357 N -0.79 3.19 0.73 1.43 3.76 -1.25 -5.10 115.29 117.26 3aaw s HIS 357 Ca 0.12 -1.29 -0.14 0.00 -0.15 0.00 0.00 55.06 53.60 3aaw s HIS 357 Cb 0.08 -2.23 0.04 0.00 1.11 0.00 0.00 32.58 31.58 3aaw s HIS 357 CO 0.11 -0.67 1.17 -2.14 -0.85 0.00 0.00 174.74 172.35 3aaw s PRO 358 N 1.42 2.22 0.00 8.40 0.02 -1.26 -3.93 135.00 141.86 3aaw s PRO 358 Ca 0.00 1.59 0.00 0.00 0.02 0.00 0.00 61.00 62.61 3aaw s PRO 358 Cb -0.18 -1.86 0.00 0.00 0.02 0.00 0.00 34.50 32.48 3aaw s PRO 358 CO 0.01 -1.74 0.00 0.41 -0.33 0.00 0.00 177.00 175.35 3aaw n GLY 359 N 0.01 0.86 0.07 0.52 0.00 -1.26 -4.94 105.19 100.44 3aaw n GLY 359 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 3aaw n GLY 359 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3aaw h VAL 360 N 0.00 1.26 -0.50 1.61 2.07 -1.94 -0.73 116.25 118.02 3aaw h VAL 360 Ca 0.00 -0.79 0.05 0.00 0.82 0.00 0.00 66.70 66.77 3aaw h VAL 360 Cb 0.00 1.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.40 3aaw h VAL 360 CO 0.00 0.22 0.24 0.74 0.02 0.00 0.00 177.57 178.79 3aaw h THR 361 N -0.19 0.94 -0.09 2.57 2.02 -1.92 -0.04 112.91 116.19 3aaw h THR 361 Ca 0.02 -0.16 0.03 0.00 0.77 0.00 0.00 66.41 67.06 3aaw h THR 361 Cb 0.35 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 3aaw h THR 361 CO 0.00 0.09 -0.07 0.00 0.37 0.00 0.00 175.52 175.91 3aaw h ALA 362 N 1.28 0.01 -0.98 6.16 0.00 -1.94 -1.14 119.26 122.65 3aaw h ALA 362 Ca 0.22 0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.18 3aaw h ALA 362 Cb 0.15 0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.04 3aaw h ALA 362 CO -0.17 -0.53 0.65 0.93 0.00 0.00 0.00 179.25 180.13 3aaw h GLU 363 N -0.08 1.29 0.22 0.00 5.08 -0.87 0.86 114.58 121.09 3aaw h GLU 363 Ca 0.06 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.35 3aaw h GLU 363 Cb 0.16 -0.29 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 3aaw h GLU 363 CO -0.14 0.85 -0.28 0.35 -1.00 0.00 0.00 179.01 178.80 3aaw h PHE 364 N 1.33 -0.74 -0.70 4.33 3.57 -0.58 0.17 116.94 124.33 3aaw h PHE 364 Ca 0.36 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.80 3aaw h PHE 364 Cb -0.15 0.30 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 3aaw h PHE 364 CO -0.00 -0.39 0.17 0.52 -2.23 0.00 0.00 178.31 176.37 3aaw h MET 365 N -0.55 1.11 -0.78 1.11 2.86 -0.91 -2.67 114.93 115.09 3aaw h MET 365 Ca 0.00 -0.26 -0.00 0.00 -2.06 0.00 0.00 59.70 57.38 3aaw h MET 365 Cb 0.53 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 32.01 3aaw h MET 365 CO -0.09 0.98 0.48 0.93 1.06 0.00 0.00 176.91 180.27 3aaw h GLU 366 N 1.05 1.06 -0.39 1.72 5.08 -0.70 -1.14 114.58 121.27 3aaw h GLU 366 Ca 0.22 -0.09 0.03 0.00 -1.00 0.00 0.00 59.36 58.52 3aaw h GLU 366 Cb 0.37 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.36 3aaw h GLU 366 CO 0.00 0.74 0.19 0.00 -1.00 0.00 0.00 179.01 178.94 3aaw h ALA 367 N 1.26 0.48 -0.06 3.43 0.00 -0.62 -1.01 119.26 122.74 3aaw h ALA 367 Ca 0.28 0.02 -0.17 0.00 0.00 0.00 0.00 54.91 55.03 3aaw h ALA 367 Cb -0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 3aaw h ALA 367 CO -0.05 -0.17 -0.72 -0.07 0.00 0.00 0.00 179.25 178.23 3aaw h LEU 368 N 0.39 0.36 -0.69 0.00 3.38 -1.42 -3.01 115.31 114.33 3aaw h LEU 368 Ca 0.17 -0.24 0.05 0.00 0.09 0.00 0.00 57.88 57.95 3aaw h LEU 368 Cb 0.08 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.67 3aaw h LEU 368 CO -0.12 0.97 0.39 -0.09 0.09 0.00 0.00 178.44 179.68 3aaw h ARG 369 N 0.20 0.71 0.00 1.13 2.43 -0.83 0.21 114.38 118.23 3aaw h ARG 369 Ca -0.03 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 3aaw h ARG 369 Cb 1.29 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 3aaw h ARG 369 CO 0.12 0.47 0.00 -0.44 -1.51 0.00 0.00 179.97 178.61 3aaw h ASP 370 N 0.73 0.00 -0.51 -3.80 3.32 -1.06 -0.02 116.42 115.08 3aaw h ASP 370 Ca 0.30 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.35 3aaw h ASP 370 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3aaw h ASP 370 CO -0.17 0.00 0.00 1.33 -1.72 0.00 0.00 179.24 178.68 3aaw n VAL 371 N -2.97 2.41 -3.92 -1.35 0.24 -1.11 -4.97 118.33 106.66 3aaw n VAL 371 Ca 0.01 -1.46 -0.25 0.00 -2.04 0.00 0.00 64.34 60.60 3aaw n VAL 371 Cb 0.34 -0.16 -0.01 0.00 -1.47 0.00 0.00 33.84 32.53 3aaw n VAL 371 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 3aaw n ASN 372 N 0.46 -0.48 -4.50 -1.34 2.85 -0.02 -4.98 115.26 107.25 3aaw n ASN 372 Ca 0.25 -0.99 -0.36 0.00 -0.11 0.00 0.00 54.58 53.37 3aaw n ASN 372 Cb 1.04 -3.16 -0.12 0.00 1.24 0.00 0.00 39.78 38.78 3aaw n ASN 372 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 3aaw s VAL 373 N -3.92 4.48 0.10 3.44 1.01 0.71 -5.02 120.40 121.20 3aaw s VAL 373 Ca 0.01 -0.12 -0.29 0.00 0.00 0.00 0.00 61.98 61.58 3aaw s VAL 373 Cb -0.00 -3.08 -0.06 0.00 0.00 0.00 0.00 36.38 33.24 3aaw s VAL 373 CO 0.88 0.36 0.92 0.21 0.00 0.00 0.00 175.10 177.47 3aaw s ASN 374 N 1.36 7.45 -0.36 3.32 3.04 -1.26 -4.22 114.94 124.27 3aaw s ASN 374 Ca 0.05 1.73 -0.16 0.00 0.04 0.00 0.00 52.86 54.53 3aaw s ASN 374 Cb -0.15 -2.56 -0.00 0.00 -1.54 0.00 0.00 41.25 36.99 3aaw s ASN 374 CO 0.04 -0.04 0.38 -0.63 -3.04 0.00 0.00 177.10 173.81 3aaw s ILE 375 N -0.06 5.15 -0.13 -5.21 1.01 -1.26 -4.69 121.20 116.01 3aaw s ILE 375 Ca 0.45 -0.03 -0.10 0.00 0.00 0.00 0.00 60.65 60.97 3aaw s ILE 375 Cb -0.23 -3.87 -0.26 0.00 0.01 0.00 0.00 42.46 38.11 3aaw s ILE 375 CO 0.29 -0.16 0.38 -0.33 0.00 0.00 0.00 174.94 175.11 3aaw h GLU 376 N 8.52 0.24 -3.65 2.79 5.08 -1.65 -3.48 114.58 122.44 3aaw h GLU 376 Ca -0.29 -0.41 -0.16 0.00 -1.00 0.00 0.00 59.36 57.50 3aaw h GLU 376 Cb 1.14 0.15 -0.22 0.00 0.50 0.00 0.00 28.75 30.32 3aaw h GLU 376 CO 0.72 1.20 -0.58 -1.17 -1.00 0.00 0.00 179.01 178.18 3aaw s LEU 377 N -7.21 1.77 -0.05 1.33 0.20 -1.20 -4.97 118.68 108.56 3aaw s LEU 377 Ca -0.23 -0.21 0.02 0.00 0.69 0.00 0.00 54.13 54.41 3aaw s LEU 377 Cb 0.06 0.43 0.01 0.00 -0.43 0.00 0.00 46.19 46.27 3aaw s LEU 377 CO 0.75 -0.28 -0.11 -0.63 -0.29 0.00 0.00 176.35 175.80 3aaw s ILE 378 N -1.10 0.98 0.16 6.68 1.01 -1.26 -1.45 121.20 126.23 3aaw s ILE 378 Ca -0.12 -0.41 -0.00 0.00 0.00 0.00 0.00 60.65 60.11 3aaw s ILE 378 Cb -0.07 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.46 3aaw s ILE 378 CO 0.00 0.31 0.06 -0.55 0.00 0.00 0.00 174.94 174.77 3aaw s SER 379 N 0.54 0.53 -0.09 3.58 0.15 -0.25 -5.02 113.70 113.13 3aaw s SER 379 Ca -0.11 -1.25 -0.24 0.00 0.70 0.00 0.00 55.95 55.05 3aaw s SER 379 Cb -0.14 0.27 0.05 0.00 -1.71 0.00 0.00 66.02 64.49 3aaw s SER 379 CO 0.02 -0.72 0.56 -0.89 1.20 0.00 0.00 173.24 173.41 3aaw s THR 380 N -3.97 0.01 0.51 6.45 2.01 -1.26 -1.24 115.64 118.16 3aaw s THR 380 Ca 0.28 -0.12 0.01 0.00 0.31 0.00 0.00 61.69 62.17 3aaw s THR 380 Cb 0.07 -0.85 -0.01 0.00 0.01 0.00 0.00 72.50 71.73 3aaw s THR 380 CO 0.05 -0.07 0.02 -0.94 -0.69 0.00 0.00 174.62 172.99 3aaw s SER 381 N -0.79 4.15 0.57 3.53 1.04 -0.58 -4.99 113.70 116.64 3aaw s SER 381 Ca -0.08 -1.64 0.35 0.00 0.48 0.00 0.00 55.95 55.05 3aaw s SER 381 Cb -0.03 0.53 1.67 0.00 0.10 0.00 0.00 66.02 68.29 3aaw s SER 381 CO 0.06 -0.87 2.11 1.05 0.98 0.00 0.00 173.24 176.57 3aaw h GLU 382 N 1.32 0.00 0.00 4.02 4.11 -2.00 -2.67 114.58 119.37 3aaw h GLU 382 Ca -0.44 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 58.98 3aaw h GLU 382 Cb 1.32 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.55 3aaw h GLU 382 CO 0.74 0.04 -0.30 0.44 0.07 0.00 0.00 179.01 179.99 3aaw n ILE 383 N -3.22 1.82 -3.75 -1.06 -5.35 -1.26 -3.86 119.36 102.69 3aaw n ILE 383 Ca -0.01 -2.50 -0.12 0.00 -0.27 0.00 0.00 62.75 59.85 3aaw n ILE 383 Cb 0.23 -0.13 -0.11 0.00 -1.74 0.00 0.00 39.64 37.88 3aaw n ILE 383 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 3aaw s ARG 384 N -2.72 0.33 -0.16 6.28 3.52 -1.01 -1.05 118.95 124.14 3aaw s ARG 384 Ca 0.33 0.51 -0.01 0.00 -0.13 0.00 0.00 55.73 56.42 3aaw s ARG 384 Cb 0.31 0.07 -0.01 0.00 -1.56 0.00 0.00 34.95 33.76 3aaw s ARG 384 CO -0.03 -0.09 -0.10 0.42 -0.81 0.00 0.00 175.30 174.69 3aaw s ILE 385 N 0.62 3.10 0.00 4.11 1.01 -0.29 -1.53 121.20 128.22 3aaw s ILE 385 Ca -0.04 -0.62 0.06 0.00 0.00 0.00 0.00 60.65 60.05 3aaw s ILE 385 Cb -0.05 -2.34 -0.02 0.00 0.01 0.00 0.00 42.46 40.06 3aaw s ILE 385 CO -0.04 0.49 -0.20 -0.44 0.00 0.00 0.00 174.94 174.76 3aaw s SER 386 N 0.80 2.32 0.07 3.58 0.01 -0.37 -0.72 113.70 119.38 3aaw s SER 386 Ca -0.04 -0.40 0.02 0.00 1.31 0.00 0.00 55.95 56.84 3aaw s SER 386 Cb -0.15 -0.24 -0.03 0.00 0.21 0.00 0.00 66.02 65.81 3aaw s SER 386 CO 0.01 0.22 -0.07 0.68 0.41 0.00 0.00 173.24 174.49 3aaw s VAL 387 N -0.55 0.59 -0.10 3.43 -7.23 -0.34 -1.10 120.40 115.10 3aaw s VAL 387 Ca 0.07 -1.50 -0.04 0.00 -1.81 0.00 0.00 61.98 58.71 3aaw s VAL 387 Cb -0.08 -1.13 -0.04 0.00 0.56 0.00 0.00 36.38 35.69 3aaw s VAL 387 CO -0.00 -0.63 0.05 -0.76 -0.31 0.00 0.00 175.10 173.44 3aaw s LEU 388 N -2.30 3.85 0.32 1.32 1.43 -0.53 -1.72 118.68 121.04 3aaw s LEU 388 Ca 0.01 0.24 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 3aaw s LEU 388 Cb -0.02 -1.91 -0.02 0.00 0.03 0.00 0.00 46.19 44.27 3aaw s LEU 388 CO -0.02 0.37 0.34 0.27 0.23 0.00 0.00 176.35 177.53 3aaw s ILE 389 N -0.83 0.00 0.33 -0.59 -4.36 0.55 -1.44 121.20 114.86 3aaw s ILE 389 Ca 0.13 -1.85 -0.29 0.00 -0.26 0.00 0.00 60.65 58.38 3aaw s ILE 389 Cb -0.12 -2.54 -0.10 0.00 1.25 0.00 0.00 42.46 40.94 3aaw s ILE 389 CO 0.03 0.00 1.39 -0.13 0.24 0.00 0.00 174.94 176.46 3aaw s ARG 390 N -3.39 4.26 0.45 0.37 1.81 -1.26 -0.25 118.95 120.95 3aaw s ARG 390 Ca 0.37 2.35 0.11 0.00 -1.72 0.00 0.00 55.73 56.84 3aaw s ARG 390 Cb 0.02 -3.04 1.02 0.00 -0.45 0.00 0.00 34.95 32.50 3aaw s ARG 390 CO 0.23 -0.34 2.07 1.05 -0.68 0.00 0.00 175.30 177.64 3aaw h GLU 391 N 3.53 0.34 0.00 3.54 4.11 -1.47 -0.85 114.58 123.78 3aaw h GLU 391 Ca -0.49 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 58.92 3aaw h GLU 391 Cb 1.23 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.40 3aaw h GLU 391 CO 0.67 0.23 0.00 -0.44 0.07 0.00 0.00 179.01 179.54 3aaw h ASP 392 N 0.35 0.00 0.38 3.06 3.45 -1.91 -2.64 116.42 119.11 3aaw h ASP 392 Ca 0.13 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.59 3aaw h ASP 392 Cb 0.08 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.85 3aaw h ASP 392 CO -0.03 0.00 -0.20 0.47 -1.57 0.00 0.00 179.24 177.91 3aaw n ASP 393 N -2.98 0.62 0.06 6.45 10.43 -0.33 -4.48 116.55 126.32 3aaw n ASP 393 Ca -0.00 -0.56 -0.11 0.00 2.57 0.00 0.00 54.79 56.68 3aaw n ASP 393 Cb 0.22 0.01 -0.05 0.00 1.84 0.00 0.00 41.12 43.14 3aaw n ASP 393 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 3aaw h LEU 394 N 0.67 -0.42 -0.27 0.64 3.38 -1.52 -0.90 115.31 116.88 3aaw h LEU 394 Ca 0.00 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.09 3aaw h LEU 394 Cb 0.43 0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.30 3aaw h LEU 394 CO 0.00 -0.21 -0.10 0.44 0.09 0.00 0.00 178.44 178.67 3aaw h ASP 395 N -0.25 -0.33 -0.10 -0.43 5.19 -1.81 -0.08 116.42 118.60 3aaw h ASP 395 Ca 0.05 0.09 0.02 0.00 -0.62 0.00 0.00 57.03 56.57 3aaw h ASP 395 Cb 0.31 0.20 -0.02 0.00 0.18 0.00 0.00 39.33 40.00 3aaw h ASP 395 CO -0.13 -0.12 -0.05 0.00 -3.12 0.00 0.00 179.24 175.81 3aaw h ALA 396 N 1.21 0.04 0.07 3.45 0.00 -1.78 -1.38 119.26 120.87 3aaw h ALA 396 Ca 0.14 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.09 3aaw h ALA 396 Cb 0.25 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3aaw h ALA 396 CO -0.31 -0.51 -0.06 0.00 0.00 0.00 0.00 179.25 178.37 3aaw h ALA 397 N 1.06 -0.12 -0.52 0.00 0.00 -0.80 0.95 119.26 119.83 3aaw h ALA 397 Ca 0.06 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3aaw h ALA 397 Cb 0.13 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 3aaw h ALA 397 CO -0.13 -0.58 0.31 0.00 0.00 0.00 0.00 179.25 178.86 3aaw h ALA 398 N 0.78 0.66 -0.41 0.00 0.00 -0.91 -0.03 119.26 119.36 3aaw h ALA 398 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3aaw h ALA 398 Cb 0.14 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 3aaw h ALA 398 CO -0.01 0.03 0.17 -0.09 0.00 0.00 0.00 179.25 179.34 3aaw h ARG 399 N 0.63 0.60 -0.40 0.00 2.43 -1.03 -0.70 114.38 115.91 3aaw h ARG 399 Ca 0.21 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 3aaw h ARG 399 Cb 0.01 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 3aaw h ARG 399 CO -0.09 0.56 0.19 0.00 -1.51 0.00 0.00 179.97 179.12 3aaw h ALA 400 N 1.02 0.51 -0.37 2.80 0.00 -0.35 -2.29 119.26 120.58 3aaw h ALA 400 Ca 0.14 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 3aaw h ALA 400 Cb 0.17 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3aaw h ALA 400 CO -0.01 0.08 0.06 -0.07 0.00 0.00 0.00 179.25 179.31 3aaw h LEU 401 N 0.50 0.59 -0.54 0.00 3.38 -0.91 -0.67 115.31 117.67 3aaw h LEU 401 Ca 0.14 -0.26 0.02 0.00 0.09 0.00 0.00 57.88 57.87 3aaw h LEU 401 Cb 0.12 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3aaw h LEU 401 CO -0.02 0.70 0.33 -0.74 0.09 0.00 0.00 178.44 178.80 3aaw h HIS 402 N 0.46 0.62 0.05 1.13 2.76 -0.96 -1.70 115.15 117.52 3aaw h HIS 402 Ca 0.11 0.02 -0.24 0.00 -2.20 0.00 0.00 60.37 58.06 3aaw h HIS 402 Cb 0.36 -0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.10 3aaw h HIS 402 CO 0.02 0.36 -1.13 1.05 -1.30 0.00 0.00 177.93 176.94 3aaw h GLU 403 N 0.66 0.11 -0.94 5.26 4.11 -1.40 -2.03 114.58 120.35 3aaw h GLU 403 Ca 0.21 -0.19 0.03 0.00 0.07 0.00 0.00 59.36 59.49 3aaw h GLU 403 Cb -0.00 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 3aaw h GLU 403 CO -0.08 1.08 0.62 0.37 0.07 0.00 0.00 179.01 181.06 3aaw h GLN 404 N 0.03 1.16 -0.43 1.06 5.75 -0.81 -2.38 115.11 119.49 3aaw h GLN 404 Ca -0.07 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.36 3aaw h GLN 404 Cb 1.86 -0.26 0.00 0.00 1.07 0.00 0.00 27.48 30.15 3aaw h GLN 404 CO 0.16 0.77 0.00 1.19 -2.65 0.00 0.00 178.83 178.30 3aaw n PHE 405 N -4.44 0.55 -3.55 3.99 3.01 -0.66 -5.00 117.46 111.37 3aaw n PHE 405 Ca 0.13 -0.28 -0.23 0.00 1.01 0.00 0.00 57.45 58.07 3aaw n PHE 405 Cb 0.09 0.00 0.05 0.00 -0.01 0.00 0.00 39.48 39.61 3aaw n PHE 405 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3aaw n GLN 406 N 1.39 -2.64 -0.18 -1.08 1.13 -0.81 -4.89 117.38 110.30 3aaw n GLN 406 Ca 0.20 0.64 0.04 0.00 -1.94 0.00 0.00 57.00 55.93 3aaw n GLN 406 Cb 0.58 -4.97 0.13 0.00 0.11 0.00 0.00 30.24 26.08 3aaw n GLN 406 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3aaw n LEU 407 N -3.91 1.74 0.00 1.08 4.77 -0.91 -4.59 117.00 115.18 3aaw n LEU 407 Ca -0.15 -0.87 0.00 0.00 -0.03 0.00 0.00 56.01 54.96 3aaw n LEU 407 Cb 0.63 -0.26 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 3aaw n LEU 407 CO 0.65 0.37 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 3aaw n GLY 408 N 0.79 -0.91 0.00 -0.72 0.00 -1.26 -4.59 105.19 98.51 3aaw n GLY 408 Ca 0.09 0.30 0.00 0.00 0.00 0.00 0.00 46.02 46.41 3aaw n GLY 408 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93