#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x0x n MET 1 N 0.00 -2.29 -3.34 1.43 2.81 -1.26 -4.99 117.12 109.48 1x0x n MET 1 Ca 0.00 1.77 -0.18 0.00 -1.81 0.00 0.00 57.70 57.48 1x0x n MET 1 Cb 0.00 -2.44 -0.00 0.00 -0.71 0.00 0.00 33.22 30.07 1x0x n MET 1 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1x0x s ALA 2 N -4.72 4.32 0.04 3.04 0.00 -1.26 -5.06 121.76 118.12 1x0x s ALA 2 Ca 0.00 -1.53 -0.30 0.00 0.00 0.00 0.00 51.96 50.13 1x0x s ALA 2 Cb 0.00 -1.65 -0.05 0.00 0.00 0.00 0.00 23.12 21.42 1x0x s ALA 2 CO 0.00 -0.11 1.12 -1.54 0.00 0.00 0.00 175.76 175.24 1x0x s SER 3 N -4.22 7.18 0.09 0.00 1.04 -1.26 -4.92 113.70 111.60 1x0x s SER 3 Ca 0.48 1.90 -0.30 0.00 0.48 0.00 0.00 55.95 58.51 1x0x s SER 3 Cb -0.10 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.39 1x0x s SER 3 CO 0.32 -0.39 1.04 -0.54 0.98 0.00 0.00 173.24 174.64 1x0x s LYS 4 N 1.01 4.59 -0.06 4.02 -0.14 0.83 -4.49 119.74 125.51 1x0x s LYS 4 Ca 0.56 1.55 -0.23 0.00 -1.36 0.00 0.00 55.97 56.50 1x0x s LYS 4 Cb -0.27 -3.37 -0.04 0.00 -1.68 0.00 0.00 37.83 32.47 1x0x s LYS 4 CO 0.29 0.03 0.66 0.15 -0.76 0.00 0.00 175.35 175.73 1x0x s LYS 5 N 0.38 4.42 -0.12 1.68 1.02 -1.26 -1.20 119.74 124.66 1x0x s LYS 5 Ca 0.51 0.82 -0.03 0.00 0.02 0.00 0.00 55.97 57.29 1x0x s LYS 5 Cb -0.25 -3.43 -0.03 0.00 -0.52 0.00 0.00 37.83 33.60 1x0x s LYS 5 CO 0.30 0.12 -0.00 0.08 -0.92 0.00 0.00 175.35 174.93 1x0x s VAL 6 N 0.61 4.24 -0.13 3.17 1.01 -1.26 0.83 120.40 128.87 1x0x s VAL 6 Ca 0.35 -0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.10 1x0x s VAL 6 Cb -0.18 -2.82 0.01 0.00 0.00 0.00 0.00 36.38 33.40 1x0x s VAL 6 CO 0.17 0.55 -0.20 0.00 0.00 0.00 0.00 175.10 175.63 1x0x s ILE 8 N 0.85 5.16 -0.62 0.00 1.01 0.12 -1.17 121.20 126.55 1x0x s ILE 8 Ca -0.08 -0.41 -0.22 0.00 0.00 0.00 0.00 60.65 59.95 1x0x s ILE 8 Cb -0.15 -3.97 0.07 0.00 0.01 0.00 0.00 42.46 38.42 1x0x s ILE 8 CO -0.01 -0.33 0.87 -0.69 0.00 0.00 0.00 174.94 174.78 1x0x s VAL 9 N 1.95 4.49 0.00 2.92 1.01 0.07 -0.01 120.40 130.84 1x0x s VAL 9 Ca 0.09 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.61 1x0x s VAL 9 Cb -0.18 -4.59 0.00 0.00 0.00 0.00 0.00 36.38 31.61 1x0x s VAL 9 CO 0.12 -1.29 0.00 0.61 0.00 0.00 0.00 175.10 174.54 1x0x n GLY 10 N 5.28 3.69 0.53 4.51 0.00 -1.10 -0.88 105.19 117.22 1x0x n GLY 10 Ca -0.05 -1.79 -0.00 0.00 0.00 0.00 0.00 46.02 44.17 1x0x n GLY 10 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1x0x n SER 11 N 0.00 -0.04 -3.23 1.61 3.41 -1.25 -4.39 113.62 109.72 1x0x n SER 11 Ca 0.00 -1.13 0.00 0.00 -0.26 0.00 0.00 58.87 57.48 1x0x n SER 11 Cb 0.00 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1x0x n SER 11 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x0x n GLY 12 N 0.00 -0.68 0.25 5.00 0.00 -1.26 -3.97 105.19 104.52 1x0x n GLY 12 Ca -0.01 -1.45 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 1x0x n GLY 12 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1x0x h ASN 13 N 0.00 -0.78 -0.52 1.61 -0.00 -1.97 0.35 115.58 114.27 1x0x h ASN 13 Ca 0.00 0.08 -0.05 0.00 -0.00 0.00 0.00 56.30 56.32 1x0x h ASN 13 Cb 0.00 0.28 -0.02 0.00 -0.00 0.00 0.00 38.32 38.58 1x0x h ASN 13 CO 0.00 -0.30 0.11 -0.25 -0.00 0.00 0.00 177.43 176.99 1x0x h TRP 14 N -0.42 0.89 -0.68 0.67 -0.00 -1.92 -2.70 115.95 111.79 1x0x h TRP 14 Ca -0.01 -0.11 0.07 0.00 -0.00 0.00 0.00 58.89 58.83 1x0x h TRP 14 Cb 0.40 -0.25 -0.06 0.00 -0.00 0.00 0.00 29.16 29.26 1x0x h TRP 14 CO -0.31 0.79 0.37 0.78 -0.00 0.00 0.00 178.44 180.06 1x0x h GLY 15 N 0.74 1.00 1.31 2.65 0.00 -1.78 0.12 103.07 107.11 1x0x h GLY 15 Ca 0.16 -0.25 -0.13 0.00 0.00 0.00 0.00 47.33 47.11 1x0x h GLY 15 CO 0.00 0.13 -0.31 1.76 0.00 0.00 0.00 176.54 178.13 1x0x h SER 16 N 0.67 0.80 -0.66 0.19 0.02 -0.25 -1.86 113.55 112.46 1x0x h SER 16 Ca 0.31 -0.33 -0.08 0.00 -0.84 0.00 0.00 61.79 60.86 1x0x h SER 16 Cb 0.23 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 1x0x h SER 16 CO -0.20 1.05 0.11 0.00 -1.14 0.00 0.00 176.83 176.65 1x0x h ALA 17 N 1.00 0.93 0.00 3.77 0.00 -1.05 -2.10 119.26 121.81 1x0x h ALA 17 Ca 0.07 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1x0x h ALA 17 Cb 0.84 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1x0x h ALA 17 CO 0.07 0.66 -0.25 0.97 0.00 0.00 0.00 179.25 180.71 1x0x h ILE 18 N 1.03 0.94 0.00 0.00 6.09 -0.48 -2.22 117.51 122.88 1x0x h ILE 18 Ca 0.20 -0.92 -0.12 0.00 -1.37 0.00 0.00 64.86 62.66 1x0x h ILE 18 Cb 0.43 1.53 -0.02 0.00 0.47 0.00 0.00 36.82 39.24 1x0x h ILE 18 CO 0.01 0.24 -0.56 0.00 -3.07 0.00 0.00 178.15 174.78 1x0x h ALA 19 N 1.75 1.04 -0.13 0.18 0.00 -0.67 0.32 119.26 121.75 1x0x h ALA 19 Ca -0.00 -0.51 -0.02 0.00 0.00 0.00 0.00 54.91 54.38 1x0x h ALA 19 Cb 0.51 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1x0x h ALA 19 CO 0.03 0.69 0.00 0.87 0.00 0.00 0.00 179.25 180.85 1x0x h LYS 20 N 0.00 0.23 0.39 0.00 1.57 -1.01 0.25 116.57 118.00 1x0x h LYS 20 Ca -0.01 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1x0x h LYS 20 Cb 1.01 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.30 1x0x h LYS 20 CO 0.07 0.47 -0.19 0.82 -0.57 0.00 0.00 179.45 180.05 1x0x h ILE 21 N -0.04 0.62 -0.14 1.86 2.04 -1.39 -2.07 117.51 118.39 1x0x h ILE 21 Ca 0.04 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 1x0x h ILE 21 Cb 0.36 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 1x0x h ILE 21 CO 0.01 0.05 0.04 0.58 0.00 0.00 0.00 178.15 178.83 1x0x h VAL 22 N -0.67 1.18 -0.83 1.67 2.07 -0.97 -1.68 116.25 117.02 1x0x h VAL 22 Ca -0.05 -0.57 0.15 0.00 0.82 0.00 0.00 66.70 67.04 1x0x h VAL 22 Cb 0.48 1.30 -0.10 0.00 -1.52 0.00 0.00 31.29 31.45 1x0x h VAL 22 CO 0.09 0.17 0.41 1.23 0.02 0.00 0.00 177.57 179.49 1x0x h GLY 23 N 0.05 1.34 1.57 2.17 0.00 -0.53 0.63 103.07 108.29 1x0x h GLY 23 Ca 0.05 -0.23 -0.14 0.00 0.00 0.00 0.00 47.33 47.00 1x0x h GLY 23 CO -0.00 -0.06 -0.51 -1.33 0.00 0.00 0.00 176.54 174.64 1x0x h GLY 24 N 0.58 0.51 1.45 4.60 0.00 -1.16 -2.43 103.07 106.61 1x0x h GLY 24 Ca 0.46 -0.56 -0.27 0.00 0.00 0.00 0.00 47.33 46.96 1x0x h GLY 24 CO -0.38 0.50 -1.16 3.43 0.00 0.00 0.00 176.54 178.94 1x0x h ASN 25 N 0.36 0.64 -0.55 0.19 -0.26 -0.26 -2.66 115.58 113.04 1x0x h ASN 25 Ca 0.01 -0.59 -0.07 0.00 -0.56 0.00 0.00 56.30 55.09 1x0x h ASN 25 Cb 1.02 -0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 38.05 1x0x h ASN 25 CO 0.09 1.42 0.09 0.00 -1.06 0.00 0.00 177.43 177.97 1x0x h ALA 26 N 0.51 1.05 0.00 -0.83 0.00 -0.96 0.35 119.26 119.38 1x0x h ALA 26 Ca -0.14 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 1x0x h ALA 26 Cb 1.83 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 19.39 1x0x h ALA 26 CO 0.21 0.61 -0.12 0.00 0.00 0.00 0.00 179.25 179.94 1x0x h ALA 27 N 1.20 1.13 0.00 0.00 0.00 -1.40 -3.22 119.26 116.96 1x0x h ALA 27 Ca 0.18 -0.11 -0.33 0.00 0.00 0.00 0.00 54.91 54.65 1x0x h ALA 27 Cb 0.40 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.10 1x0x h ALA 27 CO 0.01 0.15 -2.33 0.94 0.00 0.00 0.00 179.25 178.02 1x0x n GLN 28 N -3.42 0.69 -4.09 0.00 -0.06 -0.68 -4.95 117.38 104.85 1x0x n GLN 28 Ca -0.01 -0.02 -0.35 0.00 -2.00 0.00 0.00 57.00 54.62 1x0x n GLN 28 Cb 0.30 -1.53 -0.10 0.00 -4.06 0.00 0.00 30.24 24.85 1x0x n GLN 28 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 1x0x s LEU 29 N -5.40 3.77 0.26 1.69 1.43 0.11 -5.00 118.68 115.53 1x0x s LEU 29 Ca -0.10 0.10 -0.03 0.00 -1.03 0.00 0.00 54.13 53.07 1x0x s LEU 29 Cb 0.07 -1.93 0.32 0.00 0.03 0.00 0.00 46.19 44.68 1x0x s LEU 29 CO 0.84 0.23 1.83 0.00 0.23 0.00 0.00 176.35 179.47 1x0x h ALA 30 N 6.31 1.18 -0.22 4.21 0.00 -1.88 -2.79 119.26 126.07 1x0x h ALA 30 Ca -0.40 -0.19 0.06 0.00 0.00 0.00 0.00 54.91 54.39 1x0x h ALA 30 Cb 1.18 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1x0x h ALA 30 CO 0.66 0.59 0.24 -0.56 0.00 0.00 0.00 179.25 180.18 1x0x h GLN 31 N 0.96 0.00 -5.36 0.00 -0.00 -1.92 -3.41 115.11 105.38 1x0x h GLN 31 Ca 0.22 0.00 -0.65 0.00 -0.00 0.00 0.00 58.65 58.22 1x0x h GLN 31 Cb 0.22 0.00 -0.23 0.00 -0.00 0.00 0.00 27.48 27.47 1x0x h GLN 31 CO -0.01 0.00 -0.70 -0.06 -0.00 0.00 0.00 178.83 178.06 1x0x s PHE 32 N -4.64 2.95 0.13 0.06 0.40 -1.05 -0.12 117.98 115.70 1x0x s PHE 32 Ca -0.05 -0.39 -0.31 0.00 -0.60 0.00 0.00 56.93 55.59 1x0x s PHE 32 Cb 0.15 -1.90 -0.10 0.00 0.51 0.00 0.00 43.02 41.68 1x0x s PHE 32 CO 0.55 -0.07 1.80 0.34 0.70 0.00 0.00 175.22 178.55 1x0x s ASP 33 N 0.28 6.44 0.55 1.36 -1.08 -0.34 -4.66 116.67 119.22 1x0x s ASP 33 Ca -0.05 2.74 0.25 0.00 -0.52 0.00 0.00 52.55 54.97 1x0x s ASP 33 Cb -0.15 -2.57 1.48 0.00 -1.46 0.00 0.00 42.92 40.22 1x0x s ASP 33 CO 0.04 -0.99 2.06 1.55 0.52 0.00 0.00 175.17 178.35 1x0x h PRO 34 N 8.40 0.00 -6.16 4.34 0.13 -1.90 -3.38 132.00 133.43 1x0x h PRO 34 Ca -0.45 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.16 1x0x h PRO 34 Cb 1.21 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 1x0x h PRO 34 CO 0.95 0.00 1.19 0.50 -0.23 0.00 0.00 178.00 180.41 1x0x s ARG 35 N -4.86 2.96 -0.32 0.86 3.52 -1.26 -4.71 118.95 115.13 1x0x s ARG 35 Ca -0.05 0.04 -0.11 0.00 -0.13 0.00 0.00 55.73 55.48 1x0x s ARG 35 Cb 0.17 -4.38 -0.01 0.00 -1.56 0.00 0.00 34.95 29.17 1x0x s ARG 35 CO 0.64 -2.45 0.19 0.08 -0.81 0.00 0.00 175.30 172.95 1x0x s VAL 36 N 7.25 4.89 0.22 7.11 1.01 -1.01 -4.50 120.40 135.37 1x0x s VAL 36 Ca 0.50 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 62.05 1x0x s VAL 36 Cb -0.09 -3.51 -0.07 0.00 0.00 0.00 0.00 36.38 32.71 1x0x s VAL 36 CO 0.15 0.03 0.52 0.42 0.00 0.00 0.00 175.10 176.21 1x0x s THR 37 N 1.66 4.98 -0.08 3.92 -4.23 -1.09 -0.17 115.64 120.63 1x0x s THR 37 Ca 0.05 0.36 -0.01 0.00 -1.18 0.00 0.00 61.69 60.91 1x0x s THR 37 Cb -0.17 -3.62 0.03 0.00 1.34 0.00 0.00 72.50 70.07 1x0x s THR 37 CO 0.08 -0.06 -0.02 -0.32 -0.54 0.00 0.00 174.62 173.75 1x0x s MET 38 N -2.83 0.87 -0.06 3.99 -2.45 0.74 0.13 119.30 119.68 1x0x s MET 38 Ca 0.46 0.00 -0.30 0.00 -1.25 0.00 0.00 55.69 54.60 1x0x s MET 38 Cb -0.11 -1.13 -0.03 0.00 1.25 0.00 0.00 34.83 34.80 1x0x s MET 38 CO 0.22 -0.28 1.25 -0.46 1.05 0.00 0.00 175.02 176.80 1x0x s TRP 39 N 1.86 3.05 -0.17 4.11 -0.00 0.99 -0.83 118.94 127.96 1x0x s TRP 39 Ca 0.04 1.09 0.01 0.00 -0.00 0.00 0.00 56.10 57.25 1x0x s TRP 39 Cb -0.12 -3.49 0.02 0.00 -0.00 0.00 0.00 33.47 29.88 1x0x s TRP 39 CO -0.06 -1.62 -0.19 0.08 -0.00 0.00 0.00 176.95 175.16 1x0x s VAL 40 N 2.49 1.97 -0.39 5.86 1.01 -1.02 -2.72 120.40 127.61 1x0x s VAL 40 Ca 0.57 -0.89 -0.28 0.00 0.00 0.00 0.00 61.98 61.38 1x0x s VAL 40 Cb -0.25 -1.78 -0.02 0.00 0.00 0.00 0.00 36.38 34.32 1x0x s VAL 40 CO 0.22 0.53 1.81 0.12 0.00 0.00 0.00 175.10 177.78 1x0x s PHE 41 N 1.23 1.78 0.31 5.22 2.19 -1.26 -3.92 117.98 123.54 1x0x s PHE 41 Ca 0.03 0.69 -0.27 0.00 0.33 0.00 0.00 56.93 57.70 1x0x s PHE 41 Cb -0.13 -4.11 -0.14 0.00 -1.31 0.00 0.00 43.02 37.33 1x0x s PHE 41 CO -0.11 -2.77 0.95 -1.91 1.83 0.00 0.00 175.22 173.21 1x0x n GLU 42 N 8.58 1.22 -3.95 10.12 4.07 -1.26 -4.98 120.64 134.43 1x0x n GLU 42 Ca 0.23 0.43 -0.09 0.00 -0.06 0.00 0.00 57.16 57.66 1x0x n GLU 42 Cb 0.48 -1.80 -0.10 0.00 -0.06 0.00 0.00 31.44 29.96 1x0x n GLU 42 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1x0x s GLU 43 N -1.59 0.49 -0.45 5.31 2.02 -1.26 -4.99 118.70 118.23 1x0x s GLU 43 Ca 0.60 -0.71 -0.16 0.00 0.02 0.00 0.00 54.97 54.71 1x0x s GLU 43 Cb -0.68 0.19 0.04 0.00 0.10 0.00 0.00 34.13 33.78 1x0x s GLU 43 CO 0.59 -0.11 0.42 0.34 0.02 0.00 0.00 175.26 176.52 1x0x s ASP 44 N -1.91 6.16 -0.58 -0.19 2.15 -1.26 -1.42 116.67 119.63 1x0x s ASP 44 Ca -0.08 -0.96 -0.08 0.00 0.43 0.00 0.00 52.55 51.86 1x0x s ASP 44 Cb -0.04 -2.21 0.15 0.00 -0.30 0.00 0.00 42.92 40.53 1x0x s ASP 44 CO -0.03 -0.62 0.44 -0.63 -0.17 0.00 0.00 175.17 174.16 1x0x s ILE 45 N 1.95 4.27 -1.34 4.11 1.09 0.08 -4.68 121.20 126.67 1x0x s ILE 45 Ca 0.08 -2.28 -0.04 0.00 -1.10 0.00 0.00 60.65 57.31 1x0x s ILE 45 Cb -0.20 -3.77 0.02 0.00 -1.06 0.00 0.00 42.46 37.45 1x0x s ILE 45 CO 0.10 -0.85 0.90 0.61 -0.10 0.00 0.00 174.94 175.60 1x0x n GLY 46 N 4.30 -0.39 1.38 6.18 0.00 -1.26 -2.28 105.19 113.12 1x0x n GLY 46 Ca 0.01 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1x0x n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x0x n GLY 47 N -1.57 2.60 3.86 -0.02 0.00 -1.26 -5.02 105.19 103.78 1x0x n GLY 47 Ca -0.18 -0.30 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 1x0x n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x0x s LYS 48 N 0.00 3.88 0.12 1.61 1.02 -0.96 -5.05 119.74 120.36 1x0x s LYS 48 Ca 0.00 0.62 -0.25 0.00 0.02 0.00 0.00 55.97 56.36 1x0x s LYS 48 Cb 0.00 -2.36 -0.07 0.00 -0.52 0.00 0.00 37.83 34.88 1x0x s LYS 48 CO 0.00 -0.01 0.76 0.15 -0.92 0.00 0.00 175.35 175.33 1x0x s LYS 49 N -3.61 4.52 0.34 1.68 1.02 -1.26 -0.74 119.74 121.69 1x0x s LYS 49 Ca 0.53 1.11 0.02 0.00 0.02 0.00 0.00 55.97 57.65 1x0x s LYS 49 Cb -0.10 -3.29 0.62 0.00 -0.52 0.00 0.00 37.83 34.54 1x0x s LYS 49 CO 0.27 0.48 2.00 1.25 -0.92 0.00 0.00 175.35 178.42 1x0x h LEU 50 N 4.77 0.75 -1.84 3.17 5.85 -1.60 -1.20 115.31 125.22 1x0x h LEU 50 Ca -0.46 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.22 1x0x h LEU 50 Cb 1.21 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.05 1x0x h LEU 50 CO 0.67 0.54 -0.10 0.71 -0.34 0.00 0.00 178.44 179.92 1x0x h THR 51 N 0.88 1.03 0.09 1.05 1.35 -1.92 -1.87 112.91 113.52 1x0x h THR 51 Ca 0.26 -0.34 -0.26 0.00 -0.55 0.00 0.00 66.41 65.52 1x0x h THR 51 Cb -0.04 1.18 0.01 0.00 -1.73 0.00 0.00 68.15 67.57 1x0x h THR 51 CO -0.06 0.09 -1.16 -0.33 -0.25 0.00 0.00 175.52 173.82 1x0x h GLU 52 N 0.00 0.36 0.18 4.72 5.08 -1.63 -2.73 114.58 120.56 1x0x h GLU 52 Ca -0.00 -0.52 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1x0x h GLU 52 Cb 0.18 0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.59 1x0x h GLU 52 CO 0.01 1.21 -0.16 0.82 -1.00 0.00 0.00 179.01 179.89 1x0x h ILE 53 N 0.15 0.64 0.11 3.13 1.08 -0.87 -1.15 117.51 120.60 1x0x h ILE 53 Ca -0.13 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.36 1x0x h ILE 53 Cb 1.84 0.64 -0.03 0.00 -3.07 0.00 0.00 36.82 36.21 1x0x h ILE 53 CO 0.20 0.00 -0.20 0.40 -0.69 0.00 0.00 178.15 177.85 1x0x h ILE 54 N -0.36 0.54 0.00 -0.67 2.04 -1.45 0.79 117.51 118.39 1x0x h ILE 54 Ca -0.00 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1x0x h ILE 54 Cb 0.34 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1x0x h ILE 54 CO -0.03 0.00 0.00 0.59 0.00 0.00 0.00 178.15 178.71 1x0x n ASN 55 N -5.33 0.27 -0.11 1.72 3.02 -1.03 0.86 115.26 114.66 1x0x n ASN 55 Ca -0.07 0.57 -0.22 0.00 -0.03 0.00 0.00 54.58 54.83 1x0x n ASN 55 Cb 0.24 -0.63 -0.07 0.00 -0.61 0.00 0.00 39.78 38.71 1x0x n ASN 55 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 1x0x n THR 56 N -1.80 1.41 1.07 3.41 -1.04 -0.44 -4.63 114.28 112.25 1x0x n THR 56 Ca 0.02 -0.22 0.12 0.00 -2.04 0.00 0.00 64.05 61.93 1x0x n THR 56 Cb 0.17 -1.95 0.14 0.00 -1.82 0.00 0.00 70.33 66.86 1x0x n THR 56 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1x0x n GLN 57 N -4.19 1.82 -3.84 -2.82 6.02 0.27 -4.99 117.38 109.64 1x0x n GLN 57 Ca -0.40 -1.44 -0.38 0.00 -0.01 0.00 0.00 57.00 54.76 1x0x n GLN 57 Cb 0.76 -1.47 0.03 0.00 1.02 0.00 0.00 30.24 30.58 1x0x n GLN 57 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1x0x n HIS 58 N 0.67 -1.69 -3.64 1.08 8.25 0.25 -4.84 115.22 115.29 1x0x n HIS 58 Ca 0.13 0.29 -0.04 0.00 -0.26 0.00 0.00 57.72 57.84 1x0x n HIS 58 Cb 0.52 -3.16 -0.07 0.00 1.12 0.00 0.00 29.99 28.40 1x0x n HIS 58 CO 0.00 0.00 0.00 -1.83 0.64 0.00 0.00 176.34 175.15 1x0x s GLU 59 N -6.58 0.46 -0.91 -0.41 -1.05 -1.25 -0.11 118.70 108.85 1x0x s GLU 59 Ca 0.49 0.76 0.00 0.00 -0.15 0.00 0.00 54.97 56.07 1x0x s GLU 59 Cb -0.21 0.11 0.30 0.00 -0.44 0.00 0.00 34.13 33.88 1x0x s GLU 59 CO 0.91 -0.09 1.31 -1.71 0.95 0.00 0.00 175.26 176.63 1x0x n ASN 60 N 3.67 5.75 0.12 0.83 4.05 -1.26 -4.28 115.26 124.15 1x0x n ASN 60 Ca -0.18 -3.51 0.13 0.00 0.45 0.00 0.00 54.58 51.47 1x0x n ASN 60 Cb 0.58 -1.03 0.65 0.00 1.23 0.00 0.00 39.78 41.21 1x0x n ASN 60 CO 0.00 0.00 0.00 -0.37 -3.05 0.00 0.00 177.26 173.84 1x0x h VAL 61 N 3.08 0.88 -0.88 3.44 -1.51 -1.86 0.41 116.25 119.82 1x0x h VAL 61 Ca 0.26 -0.01 0.05 0.00 -1.23 0.00 0.00 66.70 65.77 1x0x h VAL 61 Cb 0.56 0.85 -0.06 0.00 -2.13 0.00 0.00 31.29 30.50 1x0x h VAL 61 CO 1.13 0.01 0.56 0.50 -1.23 0.00 0.00 177.57 178.53 1x0x h LYS 62 N 0.03 1.01 0.00 5.19 3.64 -1.99 -2.72 116.57 121.73 1x0x h LYS 62 Ca 0.13 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 1x0x h LYS 62 Cb 0.46 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 32.06 1x0x h LYS 62 CO -0.01 0.67 -1.54 0.66 -2.27 0.00 0.00 179.45 176.96 1x0x n TYR 63 N -4.58 0.00 -3.11 1.91 4.02 -0.78 -4.76 117.16 109.85 1x0x n TYR 63 Ca 0.12 0.00 -0.18 0.00 -0.01 0.00 0.00 57.90 57.83 1x0x n TYR 63 Cb 0.15 -0.30 -0.05 0.00 -0.02 0.00 0.00 39.34 39.13 1x0x n TYR 63 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 176.86 175.74 1x0x n LEU 64 N -1.92 -1.50 -4.77 7.72 7.94 0.14 -3.81 117.00 120.79 1x0x n LEU 64 Ca -0.01 -3.89 -0.40 0.00 -1.11 0.00 0.00 56.01 50.60 1x0x n LEU 64 Cb 0.41 0.65 0.00 0.00 0.53 0.00 0.00 43.42 45.01 1x0x n LEU 64 CO 0.37 1.93 1.01 -2.84 -1.11 0.00 0.00 177.39 176.74 1x0x s PRO 65 N 0.18 3.91 -0.98 1.96 0.02 -1.03 -3.70 135.00 135.35 1x0x s PRO 65 Ca 0.32 2.27 0.00 0.00 0.02 0.00 0.00 61.00 63.61 1x0x s PRO 65 Cb 0.06 -2.75 0.00 0.00 0.02 0.00 0.00 34.50 31.83 1x0x s PRO 65 CO -0.15 -0.58 0.00 0.41 -0.33 0.00 0.00 177.00 176.35 1x0x n GLY 66 N 0.63 0.81 2.91 0.52 0.00 -1.26 -5.01 105.19 103.78 1x0x n GLY 66 Ca 0.04 -0.56 -0.11 0.00 0.00 0.00 0.00 46.02 45.39 1x0x n GLY 66 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1x0x s HIS 67 N -2.40 0.03 0.28 1.61 3.76 -1.24 -5.10 115.29 112.23 1x0x s HIS 67 Ca 0.00 -0.06 0.06 0.00 -0.15 0.00 0.00 55.06 54.92 1x0x s HIS 67 Cb 0.00 -0.03 -0.03 0.00 1.11 0.00 0.00 32.58 33.63 1x0x s HIS 67 CO 0.00 -0.05 0.31 0.15 -0.85 0.00 0.00 174.74 174.30 1x0x s LYS 68 N -0.28 3.08 0.06 1.40 -0.14 -1.26 -4.45 119.74 118.15 1x0x s LYS 68 Ca -0.03 -1.00 0.04 0.00 -1.36 0.00 0.00 55.97 53.62 1x0x s LYS 68 Cb -0.02 -2.69 -0.04 0.00 -1.68 0.00 0.00 37.83 33.40 1x0x s LYS 68 CO -0.00 0.30 -0.00 -0.51 -0.76 0.00 0.00 175.35 174.37 1x0x s LEU 69 N -3.97 3.46 0.30 3.17 1.43 0.85 -4.91 118.68 119.01 1x0x s LEU 69 Ca 0.37 -0.13 -0.29 0.00 -1.03 0.00 0.00 54.13 53.04 1x0x s LEU 69 Cb -0.08 -2.13 -0.13 0.00 0.03 0.00 0.00 46.19 43.89 1x0x s LEU 69 CO 0.27 0.21 1.37 -2.65 0.23 0.00 0.00 176.35 175.78 1x0x n PRO 70 N 0.84 2.18 0.28 1.29 -0.02 -1.26 -4.78 135.00 133.53 1x0x n PRO 70 Ca -0.12 0.77 0.18 0.00 -2.02 0.00 0.00 63.50 62.31 1x0x n PRO 70 Cb 0.52 -2.40 0.92 0.00 -0.02 0.00 0.00 33.50 32.52 1x0x n PRO 70 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1x0x h PRO 71 N 3.35 0.00 -0.00 0.52 0.11 -1.97 -1.85 132.00 132.16 1x0x h PRO 71 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1x0x h PRO 71 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1x0x h PRO 71 CO 0.69 0.00 -0.01 0.27 -0.21 0.00 0.00 178.00 178.74 1x0x n ASN 72 N -3.25 0.18 -4.63 -2.05 6.94 -1.26 -4.71 115.26 106.49 1x0x n ASN 72 Ca -0.01 -0.85 -0.41 0.00 -0.02 0.00 0.00 54.58 53.29 1x0x n ASN 72 Cb 0.30 -0.06 -0.06 0.00 -2.36 0.00 0.00 39.78 37.61 1x0x n ASN 72 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1x0x s VAL 73 N -2.15 4.91 -0.20 3.53 1.01 -0.70 -2.41 120.40 124.40 1x0x s VAL 73 Ca 0.42 1.25 -0.11 0.00 0.00 0.00 0.00 61.98 63.54 1x0x s VAL 73 Cb 0.21 -4.02 -0.05 0.00 0.00 0.00 0.00 36.38 32.53 1x0x s VAL 73 CO 0.39 -0.05 0.16 -0.69 0.00 0.00 0.00 175.10 174.91 1x0x s VAL 74 N 2.67 5.39 0.03 2.92 1.01 0.76 -4.89 120.40 128.28 1x0x s VAL 74 Ca 0.29 0.24 -0.30 0.00 0.00 0.00 0.00 61.98 62.22 1x0x s VAL 74 Cb -0.15 -3.50 -0.04 0.00 0.00 0.00 0.00 36.38 32.69 1x0x s VAL 74 CO 0.09 0.42 1.10 0.00 0.00 0.00 0.00 175.10 176.71 1x0x s ALA 75 N 0.45 3.29 -0.24 5.51 0.00 -1.26 -0.19 121.76 129.33 1x0x s ALA 75 Ca 0.09 0.69 -0.04 0.00 0.00 0.00 0.00 51.96 52.71 1x0x s ALA 75 Cb -0.12 -3.40 0.08 0.00 0.00 0.00 0.00 23.12 19.68 1x0x s ALA 75 CO -0.00 -0.36 0.10 0.08 0.00 0.00 0.00 175.76 175.58 1x0x s VAL 76 N 1.10 0.10 0.59 0.00 1.01 -0.01 -4.91 120.40 118.28 1x0x s VAL 76 Ca 0.55 -0.59 0.29 0.00 0.00 0.00 0.00 61.98 62.23 1x0x s VAL 76 Cb -0.25 -0.91 0.36 0.00 0.00 0.00 0.00 36.38 35.57 1x0x s VAL 76 CO 0.28 -0.50 2.18 1.55 0.00 0.00 0.00 175.10 178.61 1x0x h PRO 77 N 8.36 0.00 -4.72 2.72 0.13 -1.84 -2.70 132.00 133.95 1x0x h PRO 77 Ca -0.17 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.27 1x0x h PRO 77 Cb 1.07 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.01 1x0x h PRO 77 CO 0.38 0.00 -0.39 0.34 -0.23 0.00 0.00 178.00 178.10 1x0x s ASP 78 N -6.00 6.12 0.50 1.44 3.68 -1.26 -4.64 116.67 116.51 1x0x s ASP 78 Ca -0.05 -0.56 0.15 0.00 2.13 0.00 0.00 52.55 54.22 1x0x s ASP 78 Cb 0.15 -2.17 1.21 0.00 -1.45 0.00 0.00 42.92 40.67 1x0x s ASP 78 CO 0.55 -0.36 2.14 1.62 0.13 0.00 0.00 175.17 179.24 1x0x h VAL 79 N 5.57 1.02 -0.33 1.11 3.04 -1.94 -1.06 116.25 123.65 1x0x h VAL 79 Ca -0.29 -0.03 -0.11 0.00 -1.01 0.00 0.00 66.70 65.26 1x0x h VAL 79 Cb 1.14 0.93 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 1x0x h VAL 79 CO 0.69 0.02 -0.22 0.58 -1.01 0.00 0.00 177.57 177.63 1x0x h VAL 80 N 0.08 1.29 -0.54 1.51 2.07 -1.93 -2.23 116.25 116.51 1x0x h VAL 80 Ca 0.02 -1.36 -0.02 0.00 0.82 0.00 0.00 66.70 66.16 1x0x h VAL 80 Cb -0.01 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.18 1x0x h VAL 80 CO -0.00 0.44 0.25 1.56 0.02 0.00 0.00 177.57 179.84 1x0x h GLN 81 N 0.51 0.78 -0.41 1.57 4.20 -1.79 -0.35 115.11 119.61 1x0x h GLN 81 Ca 0.07 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1x0x h GLN 81 Cb 0.78 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.40 1x0x h GLN 81 CO 0.06 0.65 0.23 0.00 -0.67 0.00 0.00 178.83 179.10 1x0x h ALA 82 N 1.09 1.63 0.00 3.87 0.00 -1.07 -3.16 119.26 121.63 1x0x h ALA 82 Ca 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1x0x h ALA 82 Cb 0.13 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1x0x h ALA 82 CO -0.02 0.32 -1.21 0.00 0.00 0.00 0.00 179.25 178.34 1x0x n ALA 83 N -2.47 3.67 -0.34 0.00 0.00 -0.85 -4.71 120.51 115.82 1x0x n ALA 83 Ca 0.03 -0.48 -0.01 0.00 0.00 0.00 0.00 53.44 52.97 1x0x n ALA 83 Cb 0.09 -0.87 0.03 0.00 0.00 0.00 0.00 19.45 18.70 1x0x n ALA 83 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1x0x n GLU 84 N -1.88 -0.22 -0.49 0.00 1.02 -0.17 -1.73 120.64 117.17 1x0x n GLU 84 Ca 0.01 1.34 0.09 0.00 -0.02 0.00 0.00 57.16 58.59 1x0x n GLU 84 Cb 0.43 -1.99 0.31 0.00 -0.02 0.00 0.00 31.44 30.17 1x0x n GLU 84 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1x0x n ASP 85 N -5.27 4.28 -4.78 1.62 8.00 -1.26 -3.90 116.55 115.24 1x0x n ASP 85 Ca 0.08 -2.36 -0.37 0.00 0.71 0.00 0.00 54.79 52.86 1x0x n ASP 85 Cb 0.34 -0.51 -0.03 0.00 -0.02 0.00 0.00 41.12 40.90 1x0x n ASP 85 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1x0x s ALA 86 N -1.67 3.07 -0.15 2.24 0.00 -0.70 -4.60 121.76 119.95 1x0x s ALA 86 Ca 0.46 0.77 0.12 0.00 0.00 0.00 0.00 51.96 53.31 1x0x s ALA 86 Cb 0.29 -3.30 -0.18 0.00 0.00 0.00 0.00 23.12 19.93 1x0x s ALA 86 CO 0.23 -0.33 0.03 -0.25 0.00 0.00 0.00 175.76 175.44 1x0x n ASP 87 N -0.13 1.47 -4.08 0.00 8.00 0.24 -4.36 116.55 117.70 1x0x n ASP 87 Ca 0.05 -0.01 -0.27 0.00 0.71 0.00 0.00 54.79 55.27 1x0x n ASP 87 Cb 0.49 0.77 -0.17 0.00 -0.02 0.00 0.00 41.12 42.19 1x0x n ASP 87 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1x0x s ILE 88 N -2.36 1.45 -0.24 0.53 -1.09 -0.85 -1.46 121.20 117.19 1x0x s ILE 88 Ca -0.09 -0.65 0.02 0.00 -2.23 0.00 0.00 60.65 57.71 1x0x s ILE 88 Cb 0.05 -1.30 0.05 0.00 -1.58 0.00 0.00 42.46 39.67 1x0x s ILE 88 CO 0.59 0.43 -0.13 -0.76 -1.23 0.00 0.00 174.94 173.83 1x0x s LEU 89 N 0.67 3.04 -0.33 2.97 1.02 -0.49 -1.16 118.68 124.40 1x0x s LEU 89 Ca -0.14 -1.18 -0.22 0.00 0.02 0.00 0.00 54.13 52.61 1x0x s LEU 89 Cb -0.16 -1.51 0.00 0.00 0.02 0.00 0.00 46.19 44.54 1x0x s LEU 89 CO 0.04 -0.14 0.71 -0.63 0.02 0.00 0.00 176.35 176.34 1x0x s ILE 90 N 1.17 4.84 -0.42 -0.59 1.09 -0.32 -2.00 121.20 124.97 1x0x s ILE 90 Ca -0.05 0.90 -0.19 0.00 -1.10 0.00 0.00 60.65 60.20 1x0x s ILE 90 Cb -0.18 -4.10 0.02 0.00 -1.06 0.00 0.00 42.46 37.14 1x0x s ILE 90 CO -0.07 -0.27 0.57 -0.36 -0.10 0.00 0.00 174.94 174.70 1x0x s PHE 91 N 2.84 3.11 -0.40 3.97 0.40 0.05 -0.75 117.98 127.20 1x0x s PHE 91 Ca 0.28 -0.11 0.03 0.00 -0.60 0.00 0.00 56.93 56.54 1x0x s PHE 91 Cb -0.14 -3.16 0.16 0.00 0.51 0.00 0.00 43.02 40.39 1x0x s PHE 91 CO 0.14 -0.77 0.35 0.54 0.70 0.00 0.00 175.22 176.18 1x0x s VAL 92 N 2.56 0.06 0.06 -0.44 0.11 -0.06 -1.09 120.40 121.61 1x0x s VAL 92 Ca 0.19 -2.02 -0.10 0.00 -2.93 0.00 0.00 61.98 57.12 1x0x s VAL 92 Cb -0.15 -1.01 0.00 0.00 -1.53 0.00 0.00 36.38 33.69 1x0x s VAL 92 CO 0.17 -0.97 0.20 0.68 -3.33 0.00 0.00 175.10 171.85 1x0x s VAL 93 N 0.58 0.12 0.49 2.04 -7.23 -1.26 -4.10 120.40 111.04 1x0x s VAL 93 Ca 0.27 -0.98 -0.22 0.00 -1.81 0.00 0.00 61.98 59.23 1x0x s VAL 93 Cb -0.06 -1.08 -0.09 0.00 0.56 0.00 0.00 36.38 35.71 1x0x s VAL 93 CO -0.11 -0.54 0.96 -2.65 -0.31 0.00 0.00 175.10 172.45 1x0x n PRO 94 N 0.38 1.17 -0.29 4.82 -0.02 -1.26 -4.82 135.00 134.99 1x0x n PRO 94 Ca -0.17 0.43 0.04 0.00 -2.02 0.00 0.00 63.50 61.77 1x0x n PRO 94 Cb 0.60 -2.06 0.12 0.00 -0.02 0.00 0.00 33.50 32.14 1x0x n PRO 94 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1x0x h HIS 95 N 1.15 -0.37 -0.10 6.00 2.76 -1.94 -1.61 115.15 121.04 1x0x h HIS 95 Ca -0.46 0.07 0.03 0.00 -2.20 0.00 0.00 60.37 57.81 1x0x h HIS 95 Cb 1.35 0.29 -0.00 0.00 1.55 0.00 0.00 27.41 30.60 1x0x h HIS 95 CO 0.41 -0.34 0.39 -0.56 -1.30 0.00 0.00 177.93 176.53 1x0x h GLN 96 N 0.01 0.00 -0.00 5.26 -0.00 -1.97 -3.10 115.11 115.31 1x0x h GLN 96 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.05 1x0x h GLN 96 Cb 0.64 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.12 1x0x h GLN 96 CO -0.82 0.00 -0.86 1.19 -0.00 0.00 0.00 178.83 178.34 1x0x n PHE 97 N -3.07 0.00 -0.16 0.06 3.01 -0.60 -4.61 117.46 112.09 1x0x n PHE 97 Ca 0.00 0.00 -0.11 0.00 1.01 0.00 0.00 57.45 58.35 1x0x n PHE 97 Cb 0.47 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.94 1x0x n PHE 97 CO 0.00 0.00 0.00 -0.84 1.01 0.00 0.00 176.76 176.93 1x0x h ILE 98 N 0.31 1.27 -0.27 4.37 3.07 -1.68 -2.96 117.51 121.63 1x0x h ILE 98 Ca 0.00 -1.35 0.05 0.00 1.55 0.00 0.00 64.86 65.11 1x0x h ILE 98 Cb 0.50 1.11 -0.08 0.00 -0.27 0.00 0.00 36.82 38.08 1x0x h ILE 98 CO 0.00 0.47 -0.51 1.23 -1.05 0.00 0.00 178.15 178.29 1x0x h GLY 99 N 0.84 -0.91 0.62 0.16 0.00 -1.81 0.27 103.07 102.24 1x0x h GLY 99 Ca 0.11 0.65 0.05 0.00 0.00 0.00 0.00 47.33 48.14 1x0x h GLY 99 CO 0.06 -0.17 0.11 1.70 0.00 0.00 0.00 176.54 178.24 1x0x h LYS 100 N -0.47 0.25 -0.82 4.80 3.64 -1.87 0.23 116.57 122.34 1x0x h LYS 100 Ca 0.07 -0.01 0.14 0.00 -1.27 0.00 0.00 60.65 59.57 1x0x h LYS 100 Cb 0.63 -0.06 -0.09 0.00 -0.41 0.00 0.00 32.23 32.31 1x0x h LYS 100 CO -0.51 0.16 0.41 0.82 -2.27 0.00 0.00 179.45 178.06 1x0x h ILE 101 N 0.25 0.75 -0.23 2.00 1.08 -1.20 0.16 117.51 120.32 1x0x h ILE 101 Ca 0.18 -0.21 -0.13 0.00 -0.39 0.00 0.00 64.86 64.31 1x0x h ILE 101 Cb 0.18 0.09 -0.01 0.00 -3.07 0.00 0.00 36.82 34.00 1x0x h ILE 101 CO -0.20 0.11 -0.38 0.00 -0.69 0.00 0.00 178.15 176.99 1x0x h ASP 103 N 0.44 -0.33 0.94 0.00 3.32 0.22 -1.96 116.42 119.05 1x0x h ASP 103 Ca 0.04 0.08 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 1x0x h ASP 103 Cb 0.86 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.59 1x0x h ASP 103 CO 0.07 -0.13 -0.50 1.56 -1.72 0.00 0.00 179.24 178.53 1x0x h GLN 104 N -0.06 0.00 0.00 3.56 4.20 -0.89 -3.29 115.11 118.62 1x0x h GLN 104 Ca 0.12 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.62 1x0x h GLN 104 Cb 0.24 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.99 1x0x h GLN 104 CO -0.27 0.50 -1.30 -0.07 -0.67 0.00 0.00 178.83 177.02 1x0x h LEU 105 N 0.00 0.00 -8.99 1.46 3.38 -1.17 -3.46 115.31 106.53 1x0x h LEU 105 Ca -0.00 0.00 -0.88 0.00 0.09 0.00 0.00 57.88 57.09 1x0x h LEU 105 Cb 1.10 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.86 1x0x h LEU 105 CO 0.06 0.79 0.66 1.17 0.09 0.00 0.00 178.44 181.22 1x0x n LYS 106 N -3.08 0.00 -0.92 1.13 4.81 -0.75 -0.18 118.16 119.16 1x0x n LYS 106 Ca -0.08 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.36 1x0x n LYS 106 Cb 0.92 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 34.47 1x0x n LYS 106 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1x0x n GLY 107 N 3.90 0.81 0.12 3.14 0.00 -1.26 -4.88 105.19 107.01 1x0x n GLY 107 Ca 0.31 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.41 1x0x n GLY 107 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1x0x n HIS 108 N -2.34 0.07 -3.97 1.61 8.25 0.75 -5.04 115.22 114.55 1x0x n HIS 108 Ca 0.00 -0.93 -0.30 0.00 -0.26 0.00 0.00 57.72 56.22 1x0x n HIS 108 Cb 0.00 -0.15 -0.05 0.00 1.12 0.00 0.00 29.99 30.91 1x0x n HIS 108 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1x0x s LEU 109 N -2.66 4.17 0.61 2.41 1.43 -1.26 -4.42 118.68 118.98 1x0x s LEU 109 Ca 0.29 0.17 -0.19 0.00 -1.03 0.00 0.00 54.13 53.37 1x0x s LEU 109 Cb 0.25 -2.80 -0.03 0.00 0.03 0.00 0.00 46.19 43.64 1x0x s LEU 109 CO 0.03 0.16 1.16 0.29 0.23 0.00 0.00 176.35 178.22 1x0x n LYS 110 N 0.25 1.11 -0.36 1.70 5.02 -1.25 -4.90 118.16 119.72 1x0x n LYS 110 Ca -0.06 0.43 -0.10 0.00 -2.02 0.00 0.00 58.31 56.55 1x0x n LYS 110 Cb 0.52 -2.37 -0.09 0.00 -0.02 0.00 0.00 35.03 33.06 1x0x n LYS 110 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1x0x h ALA 111 N 0.66 -0.53 -0.94 7.82 0.00 -1.95 -2.36 119.26 121.96 1x0x h ALA 111 Ca -0.50 0.10 -0.58 0.00 0.00 0.00 0.00 54.91 53.93 1x0x h ALA 111 Cb 1.35 1.32 -0.29 0.00 0.00 0.00 0.00 17.79 20.17 1x0x h ALA 111 CO 0.53 -0.90 0.64 0.09 0.00 0.00 0.00 179.25 179.61 1x0x n ASN 112 N -5.06 5.76 -4.77 0.00 3.02 -1.26 -5.00 115.26 107.94 1x0x n ASN 112 Ca 0.01 -3.72 -0.36 0.00 -0.03 0.00 0.00 54.58 50.48 1x0x n ASN 112 Cb 0.24 -0.87 -0.01 0.00 -0.61 0.00 0.00 39.78 38.54 1x0x n ASN 112 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x0x s ALA 113 N -3.59 2.89 0.19 5.41 0.00 -0.89 -5.00 121.76 120.77 1x0x s ALA 113 Ca 0.60 0.90 0.05 0.00 0.00 0.00 0.00 51.96 53.52 1x0x s ALA 113 Cb 0.49 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 20.18 1x0x s ALA 113 CO 0.04 -0.69 -0.09 0.95 0.00 0.00 0.00 175.76 175.96 1x0x s THR 114 N -1.61 1.37 0.06 0.00 -4.23 -0.54 -4.28 115.64 106.40 1x0x s THR 114 Ca 0.66 -2.11 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 1x0x s THR 114 Cb -0.27 -2.07 -0.04 0.00 1.34 0.00 0.00 72.50 71.46 1x0x s THR 114 CO 0.32 -0.57 -0.04 -0.83 -0.54 0.00 0.00 174.62 172.96 1x0x s GLY 115 N -3.27 0.52 -0.05 3.99 0.00 -0.67 -1.39 107.32 106.45 1x0x s GLY 115 Ca 0.22 -1.13 0.02 0.00 0.00 0.00 0.00 44.72 43.83 1x0x s GLY 115 CO 0.05 -1.23 -0.09 -1.50 0.00 0.00 0.00 173.10 170.33 1x0x s ILE 116 N -3.32 0.87 -0.12 0.90 2.07 -0.85 -0.59 121.20 120.17 1x0x s ILE 116 Ca 0.04 -0.34 -0.05 0.00 -1.41 0.00 0.00 60.65 58.90 1x0x s ILE 116 Cb 0.03 -0.82 -0.04 0.00 0.13 0.00 0.00 42.46 41.77 1x0x s ILE 116 CO -0.07 0.29 0.06 -0.55 -1.91 0.00 0.00 174.94 172.77 1x0x s SER 117 N 0.68 5.68 -0.03 4.50 0.15 0.11 -0.77 113.70 124.03 1x0x s SER 117 Ca -0.12 0.23 0.10 0.00 0.70 0.00 0.00 55.95 56.86 1x0x s SER 117 Cb -0.14 -1.78 0.28 0.00 -1.71 0.00 0.00 66.02 62.67 1x0x s SER 117 CO 0.02 0.34 1.23 0.18 1.20 0.00 0.00 173.24 176.21 1x0x n LEU 118 N 2.43 2.87 -4.72 3.45 4.32 -0.25 -1.40 117.00 123.69 1x0x n LEU 118 Ca -0.19 -2.18 -0.41 0.00 -0.02 0.00 0.00 56.01 53.21 1x0x n LEU 118 Cb 0.54 -0.24 -0.04 0.00 -1.62 0.00 0.00 43.42 42.06 1x0x n LEU 118 CO 0.31 0.68 0.64 -0.63 -1.22 0.00 0.00 177.39 177.16 1x0x s ILE 119 N -1.33 4.70 -0.37 -0.08 1.01 -1.25 -4.94 121.20 118.93 1x0x s ILE 119 Ca 0.22 1.99 -0.12 0.00 0.00 0.00 0.00 60.65 62.74 1x0x s ILE 119 Cb 0.13 -4.29 0.02 0.00 0.01 0.00 0.00 42.46 38.34 1x0x s ILE 119 CO 0.11 0.25 0.22 -0.54 0.00 0.00 0.00 174.94 174.99 1x0x s LYS 120 N 0.44 2.98 0.00 2.79 1.02 -1.26 -4.85 119.74 120.86 1x0x s LYS 120 Ca 0.48 -0.99 0.00 0.00 0.02 0.00 0.00 55.97 55.48 1x0x s LYS 120 Cb -0.22 -3.77 0.00 0.00 -0.52 0.00 0.00 37.83 33.32 1x0x s LYS 120 CO 0.28 -0.65 0.00 0.41 -0.92 0.00 0.00 175.35 174.47 1x0x n GLY 121 N 5.04 -1.76 3.20 -3.33 0.00 -1.26 -4.75 105.19 102.32 1x0x n GLY 121 Ca -0.12 -1.34 -0.12 0.00 0.00 0.00 0.00 46.02 44.45 1x0x n GLY 121 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1x0x s VAL 122 N -2.47 0.08 0.47 1.61 -7.23 -1.26 -4.61 120.40 106.99 1x0x s VAL 122 Ca 0.00 -0.69 0.05 0.00 -1.81 0.00 0.00 61.98 59.53 1x0x s VAL 122 Cb 0.00 -0.75 -0.02 0.00 0.56 0.00 0.00 36.38 36.16 1x0x s VAL 122 CO 0.00 -0.38 0.16 -1.81 -0.31 0.00 0.00 175.10 172.76 1x0x s ASP 123 N -1.74 4.31 -0.03 4.85 1.11 0.04 -4.96 116.67 120.25 1x0x s ASP 123 Ca -0.09 -1.33 0.06 0.00 0.18 0.00 0.00 52.55 51.37 1x0x s ASP 123 Cb -0.03 0.04 -0.02 0.00 1.07 0.00 0.00 42.92 43.97 1x0x s ASP 123 CO -0.00 -0.75 -0.21 -0.70 1.18 0.00 0.00 175.17 174.68 1x0x s GLU 124 N -3.96 2.27 0.42 8.23 2.12 -1.26 -0.76 118.70 125.77 1x0x s GLU 124 Ca 0.28 -0.83 0.08 0.00 0.36 0.00 0.00 54.97 54.85 1x0x s GLU 124 Cb 0.03 -2.19 -0.02 0.00 0.26 0.00 0.00 34.13 32.21 1x0x s GLU 124 CO 0.16 0.59 0.36 0.20 -0.54 0.00 0.00 175.26 176.03 1x0x s GLY 125 N -0.69 2.16 0.66 -1.50 0.00 0.19 -4.77 107.32 103.38 1x0x s GLY 125 Ca 0.11 -1.90 0.13 0.00 0.00 0.00 0.00 44.72 43.06 1x0x s GLY 125 CO -0.00 -1.73 1.40 -2.55 0.00 0.00 0.00 173.10 170.22 1x0x h PRO 126 N 1.05 0.00 -1.50 2.90 0.11 -2.00 -2.93 132.00 129.63 1x0x h PRO 126 Ca -0.41 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.34 1x0x h PRO 126 Cb 1.27 0.00 -0.26 0.00 0.11 0.00 0.00 31.00 32.12 1x0x h PRO 126 CO 0.58 0.00 -0.73 0.09 -0.21 0.00 0.00 178.00 177.74 1x0x n ASN 127 N -2.66 -1.98 0.00 -2.05 4.13 -1.26 -5.14 115.26 106.31 1x0x n ASN 127 Ca -0.01 -2.73 0.00 0.00 1.68 0.00 0.00 54.58 53.52 1x0x n ASN 127 Cb 0.72 0.69 0.00 0.00 -1.54 0.00 0.00 39.78 39.65 1x0x n ASN 127 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1x0x n GLY 128 N 2.64 -1.24 3.76 7.41 0.00 -1.11 -4.97 105.19 111.68 1x0x n GLY 128 Ca 0.22 -1.94 -0.41 0.00 0.00 0.00 0.00 46.02 43.89 1x0x n GLY 128 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1x0x s LEU 129 N 0.00 4.48 -0.14 0.99 2.96 -1.26 0.56 118.68 126.27 1x0x s LEU 129 Ca 0.00 2.51 -0.02 0.00 -0.22 0.00 0.00 54.13 56.40 1x0x s LEU 129 Cb 0.00 -3.64 0.05 0.00 0.50 0.00 0.00 46.19 43.10 1x0x s LEU 129 CO 0.00 -0.38 0.02 -0.75 -1.32 0.00 0.00 176.35 173.93 1x0x s LYS 130 N -1.60 0.63 0.39 1.98 2.20 0.07 -4.55 119.74 118.85 1x0x s LYS 130 Ca 0.47 -0.20 -0.26 0.00 -0.36 0.00 0.00 55.97 55.63 1x0x s LYS 130 Cb -0.37 -1.65 -0.09 0.00 -1.51 0.00 0.00 37.83 34.21 1x0x s LYS 130 CO 0.48 -0.51 1.19 -0.51 -0.36 0.00 0.00 175.35 175.64 1x0x s LEU 131 N 1.91 4.24 0.25 5.43 1.43 -1.26 -0.78 118.68 129.90 1x0x s LEU 131 Ca 0.02 2.40 -0.05 0.00 -1.03 0.00 0.00 54.13 55.47 1x0x s LEU 131 Cb -0.15 -3.95 0.31 0.00 0.03 0.00 0.00 46.19 42.43 1x0x s LEU 131 CO -0.07 -0.65 1.90 0.40 0.23 0.00 0.00 176.35 178.16 1x0x h ILE 132 N 2.45 1.17 -0.10 -0.59 2.04 -1.92 -0.15 117.51 120.40 1x0x h ILE 132 Ca -0.49 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 64.91 1x0x h ILE 132 Cb 1.23 -0.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1x0x h ILE 132 CO 0.63 0.22 -0.11 0.77 0.00 0.00 0.00 178.15 179.67 1x0x h SER 133 N 1.23 0.15 -0.21 1.72 4.64 -1.93 0.61 113.55 119.75 1x0x h SER 133 Ca 0.39 -0.02 -0.11 0.00 -0.47 0.00 0.00 61.79 61.57 1x0x h SER 133 Cb -0.00 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.05 1x0x h SER 133 CO -0.12 0.28 -0.29 -0.33 -0.87 0.00 0.00 176.83 175.49 1x0x h GLU 134 N 0.15 0.57 0.29 4.77 5.08 -1.57 0.22 114.58 124.08 1x0x h GLU 134 Ca 0.03 -0.33 -0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1x0x h GLU 134 Cb 0.29 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 1x0x h GLU 134 CO 0.02 0.93 -0.23 0.28 -1.00 0.00 0.00 179.01 179.01 1x0x h VAL 135 N 0.24 0.50 -0.53 3.13 2.07 -0.39 -0.07 116.25 121.21 1x0x h VAL 135 Ca 0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.58 1x0x h VAL 135 Cb 0.87 0.50 -0.04 0.00 -1.52 0.00 0.00 31.29 31.10 1x0x h VAL 135 CO 0.07 0.00 0.28 0.40 0.02 0.00 0.00 177.57 178.34 1x0x h ILE 136 N -0.53 0.98 -0.80 4.57 2.04 -0.88 -1.98 117.51 120.90 1x0x h ILE 136 Ca -0.02 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.62 1x0x h ILE 136 Cb 0.47 0.39 -0.04 0.00 -0.74 0.00 0.00 36.82 36.90 1x0x h ILE 136 CO -0.02 0.10 0.37 1.23 0.00 0.00 0.00 178.15 179.83 1x0x h GLY 137 N 0.54 1.24 1.36 5.37 0.00 -0.23 -2.60 103.07 108.75 1x0x h GLY 137 Ca 0.23 -0.63 -0.28 0.00 0.00 0.00 0.00 47.33 46.66 1x0x h GLY 137 CO -0.15 0.59 -1.15 0.83 0.00 0.00 0.00 176.54 176.66 1x0x h GLU 138 N 1.15 0.54 -0.21 4.80 5.08 -0.79 0.34 114.58 125.49 1x0x h GLU 138 Ca 0.27 -0.69 -0.06 0.00 -1.00 0.00 0.00 59.36 57.89 1x0x h GLU 138 Cb 0.14 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.60 1x0x h GLU 138 CO -0.03 1.29 -0.11 0.00 -1.00 0.00 0.00 179.01 179.15 1x0x h ARG 139 N 0.25 0.44 -0.00 2.33 2.47 -1.38 -3.20 114.38 115.29 1x0x h ARG 139 Ca -0.15 -0.20 0.00 0.00 -1.26 0.00 0.00 59.98 58.37 1x0x h ARG 139 Cb 1.82 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 30.13 1x0x h ARG 139 CO 0.21 0.74 -0.33 1.28 0.56 0.00 0.00 179.97 182.43 1x0x n LEU 140 N -4.54 0.36 -3.30 3.04 4.77 -0.98 -4.78 117.00 111.57 1x0x n LEU 140 Ca -0.05 0.15 -0.17 0.00 -0.03 0.00 0.00 56.01 55.91 1x0x n LEU 140 Cb 0.34 -0.32 0.08 0.00 -2.33 0.00 0.00 43.42 41.19 1x0x n LEU 140 CO 0.40 0.09 0.12 0.61 -1.33 0.00 0.00 177.39 177.27 1x0x n GLY 141 N 1.49 -0.33 3.11 -0.72 0.00 0.04 -4.76 105.19 104.02 1x0x n GLY 141 Ca 0.06 0.08 -0.12 0.00 0.00 0.00 0.00 46.02 46.04 1x0x n GLY 141 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1x0x s ILE 142 N -3.33 0.61 0.50 -0.61 -4.36 -0.80 -5.01 121.20 108.20 1x0x s ILE 142 Ca 0.06 -1.44 -0.22 0.00 -0.26 0.00 0.00 60.65 58.79 1x0x s ILE 142 Cb -0.03 -1.06 -0.06 0.00 1.25 0.00 0.00 42.46 42.56 1x0x s ILE 142 CO 0.69 -0.59 1.20 -2.84 0.24 0.00 0.00 174.94 173.64 1x0x s PRO 143 N -2.52 3.50 0.03 0.37 0.02 -1.26 -4.57 135.00 130.57 1x0x s PRO 143 Ca -0.01 1.85 0.03 0.00 0.02 0.00 0.00 61.00 62.89 1x0x s PRO 143 Cb -0.04 -2.28 -0.02 0.00 0.02 0.00 0.00 34.50 32.19 1x0x s PRO 143 CO -0.02 -0.78 -0.10 -1.64 -0.33 0.00 0.00 177.00 174.13 1x0x s MET 144 N -2.88 0.69 0.46 5.54 -1.94 -1.26 -1.67 119.30 118.24 1x0x s MET 144 Ca 0.68 -0.61 0.02 0.00 -1.71 0.00 0.00 55.69 54.07 1x0x s MET 144 Cb -0.30 -0.61 -0.02 0.00 2.01 0.00 0.00 34.83 35.91 1x0x s MET 144 CO 0.36 0.15 0.07 -1.12 -0.01 0.00 0.00 175.02 174.46 1x0x s SER 145 N -1.01 3.50 -0.02 3.03 0.01 0.24 -4.78 113.70 114.67 1x0x s SER 145 Ca -0.02 -1.67 -0.04 0.00 1.31 0.00 0.00 55.95 55.53 1x0x s SER 145 Cb -0.07 0.53 0.00 0.00 0.21 0.00 0.00 66.02 66.69 1x0x s SER 145 CO 0.01 -0.90 0.09 0.68 0.41 0.00 0.00 173.24 173.53 1x0x s VAL 146 N -3.03 0.04 -0.19 3.43 -7.23 -0.81 0.08 120.40 112.68 1x0x s VAL 146 Ca 0.14 -0.30 0.01 0.00 -1.81 0.00 0.00 61.98 60.03 1x0x s VAL 146 Cb 0.02 -0.24 0.03 0.00 0.56 0.00 0.00 36.38 36.75 1x0x s VAL 146 CO 0.09 -0.16 -0.17 -0.22 -0.31 0.00 0.00 175.10 174.32 1x0x s LEU 147 N -0.51 2.35 -0.06 1.32 0.20 -0.49 -0.50 118.68 120.99 1x0x s LEU 147 Ca -0.06 -0.79 -0.03 0.00 0.69 0.00 0.00 54.13 53.94 1x0x s LEU 147 Cb -0.04 -1.46 0.03 0.00 -0.43 0.00 0.00 46.19 44.29 1x0x s LEU 147 CO 0.00 -0.05 0.13 -0.04 -0.29 0.00 0.00 176.35 176.11 1x0x s MET 148 N 1.27 0.09 0.10 1.98 -1.94 0.18 -4.47 119.30 116.50 1x0x s MET 148 Ca 0.02 0.32 -0.25 0.00 -1.71 0.00 0.00 55.69 54.07 1x0x s MET 148 Cb -0.14 -0.14 0.09 0.00 2.01 0.00 0.00 34.83 36.64 1x0x s MET 148 CO -0.11 -0.14 1.15 0.20 -0.01 0.00 0.00 175.02 176.11 1x0x s GLY 149 N 0.96 -0.01 -0.93 -0.03 0.00 -1.26 -0.27 107.32 105.78 1x0x s GLY 149 Ca -0.07 -0.14 -0.24 0.00 0.00 0.00 0.00 44.72 44.26 1x0x s GLY 149 CO -0.05 3.57 1.55 0.00 0.00 0.00 0.00 173.10 178.17 1x0x s ALA 150 N -2.14 2.47 -0.49 3.20 0.00 -1.25 -4.73 121.76 118.83 1x0x s ALA 150 Ca 0.24 -1.88 0.08 0.00 0.00 0.00 0.00 51.96 50.40 1x0x s ALA 150 Cb -0.01 -4.48 0.33 0.00 0.00 0.00 0.00 23.12 18.95 1x0x s ALA 150 CO 0.03 -3.83 0.80 0.09 0.00 0.00 0.00 175.76 172.85 1x0x n ASN 151 N 10.21 2.59 -4.65 0.00 3.02 -1.26 -4.56 115.26 120.60 1x0x n ASN 151 Ca 0.29 -3.30 -0.49 0.00 -0.03 0.00 0.00 54.58 51.04 1x0x n ASN 151 Cb 0.50 -0.60 -0.05 0.00 -0.61 0.00 0.00 39.78 39.02 1x0x n ASN 151 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1x0x n ILE 152 N 0.24 0.14 0.14 2.41 2.08 -1.26 -4.82 119.36 118.28 1x0x n ILE 152 Ca 0.28 -0.03 -0.13 0.00 0.56 0.00 0.00 62.75 63.43 1x0x n ILE 152 Cb 0.51 -1.36 -0.06 0.00 -0.75 0.00 0.00 39.64 37.98 1x0x n ILE 152 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1x0x h ALA 153 N 6.30 -0.36 -0.93 -1.39 0.00 -1.97 -1.82 119.26 119.10 1x0x h ALA 153 Ca -0.47 -0.05 0.19 0.00 0.00 0.00 0.00 54.91 54.58 1x0x h ALA 153 Cb 1.29 0.26 -0.11 0.00 0.00 0.00 0.00 17.79 19.23 1x0x h ALA 153 CO 0.88 -0.73 0.51 0.66 0.00 0.00 0.00 179.25 180.57 1x0x h SER 154 N -0.39 0.59 -0.32 0.00 4.64 -1.91 0.35 113.55 116.51 1x0x h SER 154 Ca 0.00 0.11 -0.15 0.00 -0.47 0.00 0.00 61.79 61.29 1x0x h SER 154 Cb 0.37 0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1x0x h SER 154 CO -0.05 0.18 -0.37 -0.33 -0.87 0.00 0.00 176.83 175.39 1x0x h GLU 155 N 0.62 0.81 -0.13 4.77 5.08 -1.86 -1.91 114.58 121.97 1x0x h GLU 155 Ca 0.55 -0.45 0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1x0x h GLU 155 Cb 0.89 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1x0x h GLU 155 CO -0.42 1.08 0.06 0.28 -1.00 0.00 0.00 179.01 179.01 1x0x h VAL 156 N 0.59 0.99 -0.55 3.13 2.07 -0.25 -1.69 116.25 120.54 1x0x h VAL 156 Ca 0.04 -0.04 0.11 0.00 0.82 0.00 0.00 66.70 67.63 1x0x h VAL 156 Cb 0.96 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 1x0x h VAL 156 CO 0.09 0.02 0.38 0.00 0.02 0.00 0.00 177.57 178.08 1x0x h ALA 157 N 1.07 2.15 -0.00 1.67 0.00 -0.33 0.22 119.26 124.02 1x0x h ALA 157 Ca 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1x0x h ALA 157 Cb 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1x0x h ALA 157 CO -0.04 -0.28 -0.02 -0.25 0.00 0.00 0.00 179.25 178.66 1x0x n ASP 158 N -4.45 0.41 -1.47 0.00 8.00 -0.69 -4.93 116.55 113.42 1x0x n ASP 158 Ca 0.09 -0.97 -0.15 0.00 0.71 0.00 0.00 54.79 54.48 1x0x n ASP 158 Cb 0.43 -0.03 -0.03 0.00 -0.02 0.00 0.00 41.12 41.46 1x0x n ASP 158 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1x0x n GLU 159 N -0.76 -1.11 -2.31 -1.24 1.02 0.76 -4.99 120.64 112.01 1x0x n GLU 159 Ca 0.20 0.83 -0.39 0.00 -0.02 0.00 0.00 57.16 57.78 1x0x n GLU 159 Cb 0.20 -5.07 -0.03 0.00 -0.02 0.00 0.00 31.44 26.53 1x0x n GLU 159 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1x0x s LYS 160 N -4.17 4.26 0.28 3.49 -0.14 -1.02 -4.89 119.74 117.55 1x0x s LYS 160 Ca 0.00 1.90 -0.30 0.00 -1.36 0.00 0.00 55.97 56.21 1x0x s LYS 160 Cb 0.00 -2.88 -0.12 0.00 -1.68 0.00 0.00 37.83 33.15 1x0x s LYS 160 CO 0.00 -0.16 1.48 0.34 -0.76 0.00 0.00 175.35 176.25 1x0x n PHE 161 N 0.49 2.49 -3.73 3.18 7.35 -1.26 -4.74 117.46 121.23 1x0x n PHE 161 Ca 0.02 0.37 -0.03 0.00 -0.76 0.00 0.00 57.45 57.05 1x0x n PHE 161 Cb 0.45 -2.52 -0.01 0.00 0.35 0.00 0.00 39.48 37.75 1x0x n PHE 161 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1x0x s GLU 163 N -3.19 1.58 0.17 0.00 -1.05 -1.26 -1.67 118.70 113.29 1x0x s GLU 163 Ca 0.12 -1.89 -0.15 0.00 -0.15 0.00 0.00 54.97 52.91 1x0x s GLU 163 Cb -0.01 -0.44 0.02 0.00 -0.44 0.00 0.00 34.13 33.26 1x0x s GLU 163 CO 0.01 -0.32 0.43 -0.08 0.95 0.00 0.00 175.26 176.26 1x0x s THR 164 N -3.53 0.05 -0.11 1.83 -1.32 -0.52 -3.90 115.64 108.13 1x0x s THR 164 Ca 0.35 -0.89 0.02 0.00 -1.21 0.00 0.00 61.69 59.96 1x0x s THR 164 Cb 0.07 -1.55 -0.01 0.00 -1.51 0.00 0.00 72.50 69.50 1x0x s THR 164 CO 0.15 -0.21 -0.18 -0.89 -2.21 0.00 0.00 174.62 171.28 1x0x s THR 165 N -3.88 2.63 -0.18 5.08 2.01 0.63 -2.17 115.64 119.76 1x0x s THR 165 Ca 0.10 -0.82 -0.03 0.00 0.31 0.00 0.00 61.69 61.25 1x0x s THR 165 Cb 0.01 -2.06 -0.02 0.00 0.01 0.00 0.00 72.50 70.45 1x0x s THR 165 CO -0.04 0.55 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.74 1x0x s ILE 166 N 0.22 3.42 -0.25 1.82 1.01 -0.02 -0.65 121.20 126.74 1x0x s ILE 166 Ca -0.11 -0.51 -0.14 0.00 0.00 0.00 0.00 60.65 59.89 1x0x s ILE 166 Cb -0.16 -2.50 -0.04 0.00 0.01 0.00 0.00 42.46 39.76 1x0x s ILE 166 CO 0.06 0.47 0.30 -0.83 0.00 0.00 0.00 174.94 174.95 1x0x s GLY 167 N 0.84 1.95 -0.19 6.18 0.00 0.35 -0.46 107.32 115.99 1x0x s GLY 167 Ca -0.02 -0.82 -0.13 0.00 0.00 0.00 0.00 44.72 43.75 1x0x s GLY 167 CO 0.01 0.77 0.47 0.00 0.00 0.00 0.00 173.10 174.35 1x0x h LYS 169 N 6.46 0.12 -5.59 0.00 1.57 -1.84 -3.36 116.57 113.93 1x0x h LYS 169 Ca -0.32 -0.20 -0.63 0.00 -1.87 0.00 0.00 60.65 57.63 1x0x h LYS 169 Cb 1.19 0.07 -0.13 0.00 0.08 0.00 0.00 32.23 33.44 1x0x h LYS 169 CO 0.24 1.02 0.23 0.34 -0.57 0.00 0.00 179.45 180.71 1x0x s ASP 170 N -6.80 6.46 0.18 0.86 2.15 -1.26 -4.97 116.67 113.28 1x0x s ASP 170 Ca -0.03 0.19 -0.15 0.00 0.43 0.00 0.00 52.55 52.99 1x0x s ASP 170 Cb 0.08 -2.35 0.15 0.00 -0.30 0.00 0.00 42.92 40.50 1x0x s ASP 170 CO 0.84 -0.66 1.69 -0.65 -0.17 0.00 0.00 175.17 176.23 1x0x h PRO 171 N 8.50 0.10 -0.07 4.34 0.11 -1.99 0.46 132.00 143.45 1x0x h PRO 171 Ca -0.26 -0.01 0.04 0.00 0.11 0.00 0.00 66.00 65.88 1x0x h PRO 171 Cb 1.10 -0.02 -0.05 0.00 0.11 0.00 0.00 31.00 32.15 1x0x h PRO 171 CO 0.87 0.07 -0.19 0.00 -0.21 0.00 0.00 178.00 178.53 1x0x h ALA 172 N 1.40 -0.18 -0.82 -0.75 0.00 -1.99 -0.94 119.26 115.97 1x0x h ALA 172 Ca 0.22 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1x0x h ALA 172 Cb 0.33 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 1x0x h ALA 172 CO -0.37 -0.67 0.37 0.37 0.00 0.00 0.00 179.25 178.95 1x0x h GLN 173 N -0.27 1.20 -0.38 0.00 5.75 -1.88 -2.00 115.11 117.53 1x0x h GLN 173 Ca 0.08 -0.19 0.06 0.00 -0.15 0.00 0.00 58.65 58.44 1x0x h GLN 173 Cb 0.39 -0.21 -0.05 0.00 1.07 0.00 0.00 27.48 28.68 1x0x h GLN 173 CO -0.23 0.94 0.08 0.78 -2.65 0.00 0.00 178.83 177.75 1x0x h GLY 174 N 1.19 0.45 1.52 2.39 0.00 0.73 -1.20 103.07 108.14 1x0x h GLY 174 Ca 0.28 -0.03 -0.10 0.00 0.00 0.00 0.00 47.33 47.48 1x0x h GLY 174 CO -0.03 -0.02 -0.25 -1.61 0.00 0.00 0.00 176.54 174.62 1x0x h GLN 175 N 0.21 0.56 -0.32 4.80 5.75 -0.79 -2.59 115.11 122.73 1x0x h GLN 175 Ca 0.18 -0.22 -0.05 0.00 -0.15 0.00 0.00 58.65 58.41 1x0x h GLN 175 Cb 0.20 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.71 1x0x h GLN 175 CO -0.23 0.76 0.02 1.25 -2.65 0.00 0.00 178.83 177.99 1x0x h LEU 176 N 0.49 0.54 -1.07 -2.39 7.12 -0.93 -1.88 115.31 117.19 1x0x h LEU 176 Ca 0.07 -0.29 -0.05 0.00 0.13 0.00 0.00 57.88 57.74 1x0x h LEU 176 Cb 0.70 -0.14 -0.02 0.00 -0.53 0.00 0.00 40.66 40.66 1x0x h LEU 176 CO 0.05 0.70 0.11 -0.07 -0.13 0.00 0.00 178.44 179.10 1x0x h LEU 177 N 0.37 0.72 -0.89 2.25 3.38 -1.23 -2.16 115.31 117.74 1x0x h LEU 177 Ca 0.09 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.85 1x0x h LEU 177 Cb 0.41 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1x0x h LEU 177 CO 0.01 0.72 -0.09 0.50 0.09 0.00 0.00 178.44 179.67 1x0x h LYS 178 N 0.74 0.71 -0.33 1.13 3.64 -1.29 -1.57 116.57 119.61 1x0x h LYS 178 Ca 0.16 -0.22 -0.12 0.00 -1.27 0.00 0.00 60.65 59.21 1x0x h LYS 178 Cb 0.30 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.04 1x0x h LYS 178 CO 0.00 0.79 -0.27 0.93 -2.27 0.00 0.00 179.45 178.63 1x0x h GLU 179 N 0.65 0.67 -0.13 1.90 5.08 -0.79 -0.87 114.58 121.09 1x0x h GLU 179 Ca 0.12 -0.29 -0.09 0.00 -1.00 0.00 0.00 59.36 58.10 1x0x h GLU 179 Cb 0.54 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1x0x h GLU 179 CO 0.03 0.88 -0.34 1.25 -1.00 0.00 0.00 179.01 179.83 1x0x h LEU 180 N 0.58 0.26 0.00 1.33 5.85 -0.98 -3.35 115.31 119.00 1x0x h LEU 180 Ca 0.07 -0.10 -0.36 0.00 0.84 0.00 0.00 57.88 58.34 1x0x h LEU 180 Cb 0.77 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.66 1x0x h LEU 180 CO 0.06 0.60 -2.35 0.23 -0.34 0.00 0.00 178.44 176.63 1x0x n MET 181 N -4.08 0.78 -1.87 1.25 2.81 -0.63 -4.53 117.12 110.85 1x0x n MET 181 Ca -0.01 0.02 -0.41 0.00 -1.81 0.00 0.00 57.70 55.48 1x0x n MET 181 Cb 0.43 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.43 1x0x n MET 181 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 1x0x s GLN 182 N -2.48 4.16 0.16 0.03 0.74 -0.35 -4.92 119.66 117.02 1x0x s GLN 182 Ca -0.14 2.50 0.03 0.00 0.05 0.00 0.00 55.36 57.80 1x0x s GLN 182 Cb 0.06 -2.99 -0.05 0.00 1.10 0.00 0.00 33.01 31.13 1x0x s GLN 182 CO 0.76 -0.46 -0.04 0.99 -0.55 0.00 0.00 175.29 175.99 1x0x s THR 183 N -1.05 0.91 -0.95 -0.34 2.01 -0.59 -4.95 115.64 110.67 1x0x s THR 183 Ca 0.53 -2.01 0.08 0.00 0.31 0.00 0.00 61.69 60.59 1x0x s THR 183 Cb -0.45 -2.01 0.07 0.00 0.01 0.00 0.00 72.50 70.12 1x0x s THR 183 CO 0.60 -0.60 1.24 -2.65 -0.69 0.00 0.00 174.62 172.53 1x0x n PRO 184 N -0.23 0.01 0.00 4.92 -0.02 -1.26 -1.78 135.00 136.64 1x0x n PRO 184 Ca -0.08 0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1x0x n PRO 184 Cb 0.62 -1.53 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 1x0x n PRO 184 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1x0x n ASN 185 N -1.56 1.37 -3.63 2.55 4.13 -1.26 -4.79 115.26 112.08 1x0x n ASN 185 Ca 0.01 -1.41 -0.27 0.00 1.68 0.00 0.00 54.58 54.59 1x0x n ASN 185 Cb 0.08 0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.21 1x0x n ASN 185 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1x0x n PHE 186 N -0.21 1.29 -2.64 3.10 7.35 -0.74 -1.71 117.46 123.90 1x0x n PHE 186 Ca 0.00 -3.83 -0.43 0.00 -0.76 0.00 0.00 57.45 52.43 1x0x n PHE 186 Cb 0.12 -0.22 -0.02 0.00 0.35 0.00 0.00 39.48 39.71 1x0x n PHE 186 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1x0x s ARG 187 N -0.84 4.35 -0.08 -4.13 1.81 -0.67 -1.55 118.95 117.85 1x0x s ARG 187 Ca 0.30 1.42 -0.00 0.00 -1.72 0.00 0.00 55.73 55.72 1x0x s ARG 187 Cb 0.01 -3.59 -0.03 0.00 -0.45 0.00 0.00 34.95 30.89 1x0x s ARG 187 CO -0.17 -0.46 -0.05 0.42 -0.68 0.00 0.00 175.30 174.36 1x0x s ILE 188 N 2.52 3.83 -0.07 1.52 1.01 -1.26 -1.44 121.20 127.31 1x0x s ILE 188 Ca 0.48 -0.42 0.05 0.00 0.00 0.00 0.00 60.65 60.76 1x0x s ILE 188 Cb -0.18 -2.59 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1x0x s ILE 188 CO 0.14 0.59 -0.23 -0.89 0.00 0.00 0.00 174.94 174.55 1x0x s THR 189 N -0.67 2.23 -0.18 2.92 2.01 -0.92 -4.99 115.64 116.03 1x0x s THR 189 Ca 0.10 -1.00 -0.06 0.00 0.31 0.00 0.00 61.69 61.04 1x0x s THR 189 Cb -0.11 -1.83 -0.03 0.00 0.01 0.00 0.00 72.50 70.53 1x0x s THR 189 CO 0.02 0.57 0.03 -0.69 -0.69 0.00 0.00 174.62 173.86 1x0x s VAL 190 N -0.13 4.44 0.22 3.82 1.01 -1.26 -0.84 120.40 127.65 1x0x s VAL 190 Ca -0.04 -0.16 0.05 0.00 0.00 0.00 0.00 61.98 61.83 1x0x s VAL 190 Cb -0.14 -2.99 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 1x0x s VAL 190 CO 0.04 0.46 -0.06 0.68 0.00 0.00 0.00 175.10 176.22 1x0x s VAL 191 N 0.52 1.30 -0.15 2.92 -7.23 0.39 -4.94 120.40 113.22 1x0x s VAL 191 Ca 0.01 -2.09 0.19 0.00 -1.81 0.00 0.00 61.98 58.28 1x0x s VAL 191 Cb -0.13 -2.23 -0.11 0.00 0.56 0.00 0.00 36.38 34.47 1x0x s VAL 191 CO 0.02 -0.44 0.86 0.00 -0.31 0.00 0.00 175.10 175.22 1x0x n GLN 192 N -0.41 0.62 -2.63 4.82 6.02 -1.26 -0.97 117.38 123.58 1x0x n GLN 192 Ca -0.07 0.17 -0.43 0.00 -0.01 0.00 0.00 57.00 56.67 1x0x n GLN 192 Cb 0.63 -1.80 -0.01 0.00 1.02 0.00 0.00 30.24 30.08 1x0x n GLN 192 CO 0.00 0.00 0.00 -1.83 -1.01 0.00 0.00 177.06 174.22 1x0x s GLU 193 N -3.07 3.91 0.20 -1.09 -1.05 -1.26 -4.35 118.70 111.99 1x0x s GLU 193 Ca -0.03 -1.88 -0.17 0.00 -0.15 0.00 0.00 54.97 52.75 1x0x s GLU 193 Cb 0.09 -5.43 0.19 0.00 -0.44 0.00 0.00 34.13 28.54 1x0x s GLU 193 CO 0.81 -2.18 1.61 0.28 0.95 0.00 0.00 175.26 176.72 1x0x h VAL 194 N 5.73 0.26 -0.23 1.83 2.07 -1.86 -2.66 116.25 121.40 1x0x h VAL 194 Ca 0.38 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.95 1x0x h VAL 194 Cb 0.90 0.26 -0.07 0.00 -1.52 0.00 0.00 31.29 30.86 1x0x h VAL 194 CO 1.42 0.00 -0.42 0.44 0.02 0.00 0.00 177.57 179.03 1x0x h ASP 195 N -0.08 -1.33 -0.60 0.57 3.32 -1.94 -0.60 116.42 115.76 1x0x h ASP 195 Ca 0.28 0.19 0.01 0.00 0.02 0.00 0.00 57.03 57.53 1x0x h ASP 195 Cb 0.52 0.56 -0.03 0.00 0.22 0.00 0.00 39.33 40.59 1x0x h ASP 195 CO -0.67 -0.40 0.38 0.74 -1.72 0.00 0.00 179.24 177.57 1x0x h THR 196 N -0.43 1.12 -0.52 0.35 2.02 -1.85 -1.07 112.91 112.53 1x0x h THR 196 Ca 0.10 -0.27 0.02 0.00 0.77 0.00 0.00 66.41 67.03 1x0x h THR 196 Cb 0.61 0.28 -0.03 0.00 -1.74 0.00 0.00 68.15 67.26 1x0x h THR 196 CO -0.46 0.14 0.32 0.58 0.37 0.00 0.00 175.52 176.48 1x0x h VAL 197 N 0.77 1.07 -0.23 3.16 2.07 -1.13 -1.97 116.25 120.00 1x0x h VAL 197 Ca 0.23 -0.22 -0.03 0.00 0.82 0.00 0.00 66.70 67.50 1x0x h VAL 197 Cb -0.05 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1x0x h VAL 197 CO -0.07 0.12 0.02 -0.08 0.02 0.00 0.00 177.57 177.58 1x0x h GLU 198 N 0.64 0.39 -0.51 1.57 4.81 -0.74 -2.98 114.58 117.75 1x0x h GLU 198 Ca 0.21 -0.11 0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1x0x h GLU 198 Cb 0.00 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1x0x h GLU 198 CO -0.08 0.54 0.34 0.97 -0.73 0.00 0.00 179.01 180.05 1x0x h ILE 199 N 0.18 1.05 -0.15 2.32 6.09 -1.05 -1.83 117.51 124.12 1x0x h ILE 199 Ca 0.07 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.36 1x0x h ILE 199 Cb 0.35 0.43 -0.01 0.00 0.47 0.00 0.00 36.82 38.07 1x0x h ILE 199 CO 0.01 0.10 0.09 0.00 -3.07 0.00 0.00 178.15 175.28 1x0x h GLY 201 N 0.19 0.57 0.41 0.00 0.00 -1.27 -2.29 103.07 100.69 1x0x h GLY 201 Ca 0.05 -0.21 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1x0x h GLY 201 CO -0.01 0.20 -0.00 0.00 0.00 0.00 0.00 176.54 176.72 1x0x h ALA 202 N 1.74 -0.00 0.00 3.60 0.00 -0.90 -3.35 119.26 120.34 1x0x h ALA 202 Ca 0.16 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 1x0x h ALA 202 Cb -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1x0x h ALA 202 CO -0.04 -0.21 -0.43 -0.07 0.00 0.00 0.00 179.25 178.50 1x0x h LEU 203 N -0.59 0.00 -1.96 0.00 3.38 -0.94 -3.23 115.31 111.96 1x0x h LEU 203 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1x0x h LEU 203 Cb 0.58 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.33 1x0x h LEU 203 CO 0.00 0.43 -0.10 0.07 0.09 0.00 0.00 178.44 178.94 1x0x h LYS 204 N 0.00 0.00 0.00 1.13 5.09 -1.55 -2.16 116.57 119.09 1x0x h LYS 204 Ca -0.00 0.00 -0.09 0.00 0.09 0.00 0.00 60.65 60.65 1x0x h LYS 204 Cb 1.01 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 33.33 1x0x h LYS 204 CO 0.06 0.10 -0.42 -0.91 -2.09 0.00 0.00 179.45 176.18 1x0x h ASN 205 N 0.00 0.00 -0.03 7.07 2.35 -1.73 -0.86 115.58 122.38 1x0x h ASN 205 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.73 1x0x h ASN 205 Cb 0.20 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.57 1x0x h ASN 205 CO 0.01 0.42 -0.04 0.58 -1.65 0.00 0.00 177.43 176.75 1x0x h VAL 206 N 0.00 1.42 -0.68 2.81 2.07 -1.58 -2.70 116.25 117.59 1x0x h VAL 206 Ca -0.00 -1.31 0.09 0.00 0.82 0.00 0.00 66.70 66.30 1x0x h VAL 206 Cb 0.85 2.24 -0.07 0.00 -1.52 0.00 0.00 31.29 32.79 1x0x h VAL 206 CO 0.05 0.35 0.32 0.58 0.02 0.00 0.00 177.57 178.89 1x0x h VAL 207 N -0.44 0.82 0.00 2.57 2.07 -1.38 -1.49 116.25 118.41 1x0x h VAL 207 Ca 0.00 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.33 1x0x h VAL 207 Cb 0.59 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1x0x h VAL 207 CO 0.01 0.10 -0.02 0.00 0.02 0.00 0.00 177.57 177.67 1x0x h ALA 208 N 1.43 1.93 -0.55 1.67 0.00 -1.07 0.27 119.26 122.94 1x0x h ALA 208 Ca 0.34 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 55.13 1x0x h ALA 208 Cb 0.37 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1x0x h ALA 208 CO -0.28 0.03 -0.03 0.28 0.00 0.00 0.00 179.25 179.25 1x0x h VAL 209 N 0.00 1.26 -0.59 0.00 2.07 -0.94 -1.45 116.25 116.60 1x0x h VAL 209 Ca -0.00 -1.14 -0.08 0.00 0.82 0.00 0.00 66.70 66.30 1x0x h VAL 209 Cb 0.04 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 1x0x h VAL 209 CO 0.00 0.41 0.07 1.23 0.02 0.00 0.00 177.57 179.30 1x0x h GLY 210 N 0.99 1.07 1.16 2.17 0.00 -0.82 -1.92 103.07 105.72 1x0x h GLY 210 Ca 0.16 -0.74 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 1x0x h GLY 210 CO 0.03 0.68 0.44 0.00 0.00 0.00 0.00 176.54 177.70 1x0x h ALA 211 N 1.00 1.28 -0.45 3.60 0.00 -0.83 -2.04 119.26 121.81 1x0x h ALA 211 Ca 0.18 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 1x0x h ALA 211 Cb 0.46 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1x0x h ALA 211 CO 0.02 0.59 0.00 0.78 0.00 0.00 0.00 179.25 180.64 1x0x h GLY 212 N 1.14 0.80 1.00 0.00 0.00 -0.84 -1.52 103.07 103.64 1x0x h GLY 212 Ca 0.28 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 47.09 1x0x h GLY 212 CO -0.05 0.49 -0.05 0.74 0.00 0.00 0.00 176.54 177.67 1x0x h PHE 213 N 0.70 -0.13 -0.50 5.60 0.05 -0.74 0.16 116.94 122.07 1x0x h PHE 213 Ca 0.14 -0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.92 1x0x h PHE 213 Cb 0.43 0.04 -0.02 0.00 2.00 0.00 0.00 35.95 38.40 1x0x h PHE 213 CO 0.02 -0.08 0.31 0.00 -0.18 0.00 0.00 178.31 178.38 1x0x h ASP 215 N 0.68 0.86 0.77 0.00 3.32 -0.97 0.17 116.42 121.26 1x0x h ASP 215 Ca 0.18 -0.26 0.00 0.00 0.02 0.00 0.00 57.03 56.97 1x0x h ASP 215 Cb -0.04 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.28 1x0x h ASP 215 CO -0.04 0.97 0.00 1.23 -1.72 0.00 0.00 179.24 179.69 1x0x h GLY 216 N 0.97 0.00 -2.00 2.75 0.00 0.25 -1.57 103.07 103.47 1x0x h GLY 216 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.46 1x0x h GLY 216 CO 0.04 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.62 1x0x n LEU 217 N -2.64 3.10 0.00 3.11 4.77 0.22 -4.52 117.00 121.04 1x0x n LEU 217 Ca 0.01 -1.15 0.00 0.00 -0.03 0.00 0.00 56.01 54.84 1x0x n LEU 217 Cb 0.24 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1x0x n LEU 217 CO 0.22 0.57 0.00 0.61 -1.33 0.00 0.00 177.39 177.47 1x0x n GLY 218 N 1.40 0.79 3.95 -0.72 0.00 -0.59 -5.07 105.19 104.94 1x0x n GLY 218 Ca 0.16 -0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 1x0x n GLY 218 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x0x s PHE 219 N -2.00 2.31 0.00 1.61 0.40 0.56 -5.00 117.98 115.87 1x0x s PHE 219 Ca 0.00 0.22 0.00 0.00 -0.60 0.00 0.00 56.93 56.55 1x0x s PHE 219 Cb 0.00 -3.32 0.00 0.00 0.51 0.00 0.00 43.02 40.21 1x0x s PHE 219 CO 0.00 -1.72 0.00 0.41 0.70 0.00 0.00 175.22 174.61 1x0x n GLY 220 N -3.05 5.09 0.18 4.36 0.00 -1.26 -4.56 105.19 105.95 1x0x n GLY 220 Ca 0.11 -1.77 -0.09 0.00 0.00 0.00 0.00 46.02 44.27 1x0x n GLY 220 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1x0x h ASP 221 N 0.00 0.51 -0.96 1.61 3.32 -1.99 -0.52 116.42 118.40 1x0x h ASP 221 Ca 0.00 -0.16 0.09 0.00 0.02 0.00 0.00 57.03 56.98 1x0x h ASP 221 Cb 0.00 -0.13 -0.07 0.00 0.22 0.00 0.00 39.33 39.35 1x0x h ASP 221 CO 0.00 0.54 0.61 0.78 -1.72 0.00 0.00 179.24 179.45 1x0x h ASN 222 N 0.46 0.91 0.07 6.45 2.35 -1.99 0.35 115.58 124.18 1x0x h ASN 222 Ca 0.12 0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1x0x h ASN 222 Cb 0.18 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.39 1x0x h ASN 222 CO -0.01 0.54 -0.03 0.74 -1.65 0.00 0.00 177.43 177.01 1x0x h THR 223 N 1.01 1.23 -1.00 2.81 2.02 -1.92 -2.31 112.91 114.73 1x0x h THR 223 Ca 0.44 -1.28 0.11 0.00 0.77 0.00 0.00 66.41 66.45 1x0x h THR 223 Cb 0.35 2.03 -0.08 0.00 -1.74 0.00 0.00 68.15 68.71 1x0x h THR 223 CO -0.20 0.31 0.64 0.50 0.37 0.00 0.00 175.52 177.13 1x0x h LYS 224 N -0.70 1.00 -0.77 6.66 3.64 -0.57 0.51 116.57 126.35 1x0x h LYS 224 Ca -0.01 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 1x0x h LYS 224 Cb 0.57 -0.23 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 1x0x h LYS 224 CO 0.02 0.66 0.36 0.00 -2.27 0.00 0.00 179.45 178.22 1x0x h ALA 225 N 1.52 0.99 -0.07 5.00 0.00 -0.32 -0.29 119.26 126.10 1x0x h ALA 225 Ca 0.48 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1x0x h ALA 225 Cb 0.42 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1x0x h ALA 225 CO -0.24 0.56 0.04 0.00 0.00 0.00 0.00 179.25 179.61 1x0x h ALA 226 N 1.18 0.08 -0.76 0.00 0.00 -0.40 0.13 119.26 119.49 1x0x h ALA 226 Ca 0.26 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.23 1x0x h ALA 226 Cb 0.13 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.83 1x0x h ALA 226 CO -0.03 -0.42 0.45 0.28 0.00 0.00 0.00 179.25 179.53 1x0x h VAL 227 N 0.09 1.00 -0.54 0.00 2.07 -0.58 0.11 116.25 118.39 1x0x h VAL 227 Ca 0.02 -0.28 -0.08 0.00 0.82 0.00 0.00 66.70 67.19 1x0x h VAL 227 Cb -0.01 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 1x0x h VAL 227 CO -0.01 0.15 0.04 0.40 0.02 0.00 0.00 177.57 178.17 1x0x h ILE 228 N 0.82 1.26 -0.03 4.57 2.04 -0.45 -0.41 117.51 125.30 1x0x h ILE 228 Ca 0.34 -1.05 -0.00 0.00 1.00 0.00 0.00 64.86 65.15 1x0x h ILE 228 Cb 0.19 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.14 1x0x h ILE 228 CO -0.18 0.37 0.01 -0.09 0.00 0.00 0.00 178.15 178.27 1x0x h ARG 229 N 0.82 0.05 -0.29 2.37 2.43 0.14 -0.82 114.38 119.07 1x0x h ARG 229 Ca 0.16 -0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.24 1x0x h ARG 229 Cb 0.48 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1x0x h ARG 229 CO 0.02 0.18 -0.15 -0.07 -1.51 0.00 0.00 179.97 178.44 1x0x h LEU 230 N -0.10 0.50 -0.56 3.80 3.38 -0.79 -1.39 115.31 120.14 1x0x h LEU 230 Ca 0.01 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 1x0x h LEU 230 Cb 0.15 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.75 1x0x h LEU 230 CO -0.00 0.68 0.13 1.23 0.09 0.00 0.00 178.44 180.57 1x0x h GLY 231 N 0.95 0.98 1.23 0.83 0.00 -0.89 -1.07 103.07 105.10 1x0x h GLY 231 Ca 0.08 -0.62 -0.07 0.00 0.00 0.00 0.00 47.33 46.72 1x0x h GLY 231 CO 0.03 0.58 0.06 -2.00 0.00 0.00 0.00 176.54 175.21 1x0x h LEU 232 N 0.81 0.90 -0.63 3.11 5.85 -0.80 0.69 115.31 125.24 1x0x h LEU 232 Ca 0.18 -0.21 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 1x0x h LEU 232 Cb 0.36 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1x0x h LEU 232 CO 0.00 0.93 0.37 -0.03 -0.34 0.00 0.00 178.44 179.37 1x0x h MET 233 N 0.88 0.87 -0.23 1.25 4.05 -0.93 -1.68 114.93 119.14 1x0x h MET 233 Ca 0.18 -0.08 -0.13 0.00 -0.28 0.00 0.00 59.70 59.38 1x0x h MET 233 Cb 0.43 -0.18 -0.01 0.00 -0.80 0.00 0.00 31.60 31.04 1x0x h MET 233 CO 0.01 0.63 -0.39 0.93 0.23 0.00 0.00 176.91 178.32 1x0x h GLU 234 N 0.86 0.53 -0.21 0.39 5.08 -0.57 -2.83 114.58 117.83 1x0x h GLU 234 Ca 0.23 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.32 1x0x h GLU 234 Cb -0.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 1x0x h GLU 234 CO -0.04 0.84 0.11 0.52 -1.00 0.00 0.00 179.01 179.44 1x0x h MET 235 N 0.44 0.30 0.02 2.33 2.86 -0.45 0.14 114.93 120.58 1x0x h MET 235 Ca 0.04 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1x0x h MET 235 Cb 0.88 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.48 1x0x h MET 235 CO 0.07 0.30 -0.01 0.82 1.06 0.00 0.00 176.91 179.16 1x0x h ILE 236 N 0.23 1.12 -0.70 -1.22 2.04 -1.35 0.16 117.51 117.78 1x0x h ILE 236 Ca 0.07 -0.45 0.07 0.00 1.00 0.00 0.00 64.86 65.56 1x0x h ILE 236 Cb 0.09 1.42 -0.06 0.00 -0.74 0.00 0.00 36.82 37.53 1x0x h ILE 236 CO -0.01 0.11 0.39 0.00 0.00 0.00 0.00 178.15 178.64 1x0x h ALA 237 N 0.75 0.96 -0.41 1.87 0.00 -1.42 -0.03 119.26 120.98 1x0x h ALA 237 Ca -0.00 0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1x0x h ALA 237 Cb 0.21 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1x0x h ALA 237 CO 0.00 0.06 -0.31 0.35 0.00 0.00 0.00 179.25 179.35 1x0x h PHE 238 N 0.71 1.07 -0.34 0.00 3.57 -0.55 -2.34 116.94 119.06 1x0x h PHE 238 Ca 0.32 -0.29 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 1x0x h PHE 238 Cb 0.23 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 1x0x h PHE 238 CO -0.08 1.10 0.06 0.00 -2.23 0.00 0.00 178.31 177.16 1x0x h ALA 239 N 0.87 0.45 -0.75 2.41 0.00 -0.17 -2.29 119.26 119.78 1x0x h ALA 239 Ca 0.08 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1x0x h ALA 239 Cb 0.88 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.51 1x0x h ALA 239 CO 0.08 0.14 0.42 0.87 0.00 0.00 0.00 179.25 180.76 1x0x h LYS 240 N 0.39 1.04 0.28 0.00 1.57 -0.93 -0.81 116.57 118.10 1x0x h LYS 240 Ca 0.10 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1x0x h LYS 240 Cb 0.34 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1x0x h LYS 240 CO 0.01 0.75 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.44 1x0x h LEU 241 N 1.04 -0.31 -0.24 2.94 3.38 -1.33 -3.38 115.31 117.42 1x0x h LEU 241 Ca 0.27 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1x0x h LEU 241 Cb 0.01 0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1x0x h LEU 241 CO -0.04 0.15 -0.37 0.49 0.09 0.00 0.00 178.44 178.75 1x0x n PHE 242 N -5.05 0.00 -3.37 1.13 3.01 -0.87 -4.92 117.46 107.39 1x0x n PHE 242 Ca -0.08 0.00 -0.38 0.00 1.01 0.00 0.00 57.45 58.00 1x0x n PHE 242 Cb 0.26 -0.19 -0.06 0.00 -0.01 0.00 0.00 39.48 39.48 1x0x n PHE 242 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1x0x s SER 244 N -1.14 6.42 0.27 0.00 0.01 -1.26 -4.85 113.70 113.14 1x0x s SER 244 Ca 0.28 1.66 0.00 0.00 1.31 0.00 0.00 55.95 59.19 1x0x s SER 244 Cb -0.18 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.53 1x0x s SER 244 CO 0.17 -0.73 0.00 0.61 0.41 0.00 0.00 173.24 173.70 1x0x n GLY 245 N -1.30 -2.58 3.77 3.44 0.00 -1.26 -4.83 105.19 102.43 1x0x n GLY 245 Ca 0.07 -1.28 -0.41 0.00 0.00 0.00 0.00 46.02 44.40 1x0x n GLY 245 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1x0x s PRO 246 N -3.03 4.20 -0.21 1.61 0.02 -1.26 -5.02 135.00 131.30 1x0x s PRO 246 Ca 0.00 2.45 0.01 0.00 0.02 0.00 0.00 61.00 63.47 1x0x s PRO 246 Cb 0.00 -3.01 0.03 0.00 0.02 0.00 0.00 34.50 31.54 1x0x s PRO 246 CO 0.00 -0.42 -0.14 0.08 -0.33 0.00 0.00 177.00 176.18 1x0x s VAL 247 N -1.00 2.33 -0.11 3.83 1.01 -1.26 -4.92 120.40 120.28 1x0x s VAL 247 Ca 0.53 -1.08 -0.03 0.00 0.00 0.00 0.00 61.98 61.40 1x0x s VAL 247 Cb -0.44 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.79 1x0x s VAL 247 CO 0.58 0.34 -0.01 -0.94 0.00 0.00 0.00 175.10 175.07 1x0x s SER 248 N 1.27 5.11 0.42 3.32 1.04 -1.26 -4.94 113.70 118.66 1x0x s SER 248 Ca 0.01 0.05 0.10 0.00 0.48 0.00 0.00 55.95 56.59 1x0x s SER 248 Cb -0.15 -1.58 0.94 0.00 0.10 0.00 0.00 66.02 65.33 1x0x s SER 248 CO -0.09 0.30 2.02 0.28 0.98 0.00 0.00 173.24 176.73 1x0x h SER 249 N 5.74 0.42 -0.90 7.02 0.02 -1.99 -1.86 113.55 121.99 1x0x h SER 249 Ca -0.44 -0.00 0.20 0.00 -0.84 0.00 0.00 61.79 60.71 1x0x h SER 249 Cb 1.19 -0.09 -0.07 0.00 0.14 0.00 0.00 62.40 63.57 1x0x h SER 249 CO 0.58 0.28 0.59 0.00 -1.14 0.00 0.00 176.83 177.14 1x0x h ALA 250 N 1.73 2.14 0.00 3.77 0.00 -2.02 0.44 119.26 125.32 1x0x h ALA 250 Ca 0.21 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.14 1x0x h ALA 250 Cb 0.22 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 17.98 1x0x h ALA 250 CO -0.05 -0.43 -0.01 1.15 0.00 0.00 0.00 179.25 179.90 1x0x h THR 251 N 0.45 0.78 0.00 0.00 2.02 -1.76 -1.11 112.91 113.29 1x0x h THR 251 Ca 0.47 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.60 1x0x h THR 251 Cb 1.11 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 1x0x h THR 251 CO -0.19 0.01 0.00 0.49 0.37 0.00 0.00 175.52 176.20 1x0x n PHE 252 N -4.19 0.00 1.28 3.16 3.01 0.15 -2.04 117.46 118.83 1x0x n PHE 252 Ca -0.03 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.55 1x0x n PHE 252 Cb 0.10 -0.44 0.42 0.00 -0.01 0.00 0.00 39.48 39.54 1x0x n PHE 252 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1x0x n LEU 253 N -1.44 1.79 -4.92 4.37 4.77 -0.42 -0.39 117.00 120.76 1x0x n LEU 253 Ca 0.07 -0.67 -0.28 0.00 -0.03 0.00 0.00 56.01 55.10 1x0x n LEU 253 Cb 0.23 -0.06 0.10 0.00 -2.33 0.00 0.00 43.42 41.36 1x0x n LEU 253 CO 0.19 0.34 0.72 -1.61 -1.33 0.00 0.00 177.39 175.70 1x0x s GLU 254 N -1.89 1.84 0.23 3.23 0.41 -0.87 -4.81 118.70 116.84 1x0x s GLU 254 Ca 0.35 -0.17 -0.06 0.00 -0.41 0.00 0.00 54.97 54.68 1x0x s GLU 254 Cb 0.20 -2.04 0.34 0.00 -1.78 0.00 0.00 34.13 30.85 1x0x s GLU 254 CO 0.30 -1.57 1.80 1.03 -0.49 0.00 0.00 175.26 176.33 1x0x h SER 255 N -0.94 0.57 -0.06 -0.19 0.87 -1.88 -0.65 113.55 111.28 1x0x h SER 255 Ca -0.45 0.05 0.02 0.00 -1.23 0.00 0.00 61.79 60.18 1x0x h SER 255 Cb 1.31 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1x0x h SER 255 CO 0.58 0.34 0.21 0.00 -0.53 0.00 0.00 176.83 177.43 1x0x n GLY 257 N -1.23 0.14 0.33 0.00 0.00 -0.25 -4.15 105.19 100.03 1x0x n GLY 257 Ca -0.01 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.13 1x0x n GLY 257 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1x0x h VAL 258 N 0.00 0.63 -0.01 1.61 3.04 -0.75 -1.66 116.25 119.11 1x0x h VAL 258 Ca 0.00 -0.21 -0.00 0.00 -1.01 0.00 0.00 66.70 65.48 1x0x h VAL 258 Cb 0.00 -0.03 -0.00 0.00 -2.01 0.00 0.00 31.29 29.25 1x0x h VAL 258 CO 0.00 0.11 -0.00 0.00 -1.01 0.00 0.00 177.57 176.67 1x0x h ALA 259 N 1.65 0.01 -0.02 3.17 0.00 -1.71 -2.05 119.26 120.31 1x0x h ALA 259 Ca 0.55 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.20 1x0x h ALA 259 Cb 0.92 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1x0x h ALA 259 CO -0.42 -0.28 -0.24 0.22 0.00 0.00 0.00 179.25 178.53 1x0x h ASP 260 N -0.38 0.04 -0.59 0.00 3.58 -0.91 -0.44 116.42 117.72 1x0x h ASP 260 Ca 0.00 -0.01 -0.09 0.00 0.42 0.00 0.00 57.03 57.35 1x0x h ASP 260 Cb 0.41 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.43 1x0x h ASP 260 CO 0.00 0.28 0.02 0.25 -2.88 0.00 0.00 179.24 176.92 1x0x h LEU 261 N 0.03 1.01 0.29 2.28 5.85 -1.24 -2.06 115.31 121.48 1x0x h LEU 261 Ca 0.00 -0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.44 1x0x h LEU 261 Cb 0.45 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1x0x h LEU 261 CO 0.03 1.05 -0.14 0.40 -0.34 0.00 0.00 178.44 179.44 1x0x h ILE 262 N 0.96 0.52 -0.93 4.05 1.08 -0.53 -2.52 117.51 120.13 1x0x h ILE 262 Ca 0.18 -0.82 0.05 0.00 -0.39 0.00 0.00 64.86 63.88 1x0x h ILE 262 Cb 0.52 0.84 -0.06 0.00 -3.07 0.00 0.00 36.82 35.05 1x0x h ILE 262 CO 0.03 0.12 0.61 0.00 -0.69 0.00 0.00 178.15 178.22 1x0x h THR 263 N -0.94 1.11 -0.29 -0.27 1.03 -1.18 -2.49 112.91 109.87 1x0x h THR 263 Ca -0.04 -0.38 -0.08 0.00 -0.01 0.00 0.00 66.41 65.90 1x0x h THR 263 Cb 0.50 -0.10 -0.01 0.00 -1.07 0.00 0.00 68.15 67.47 1x0x h THR 263 CO 0.07 0.20 -0.12 0.74 -0.01 0.00 0.00 175.52 176.40 1x0x h THR 264 N 1.11 1.29 0.00 0.00 2.02 -1.45 -1.14 112.91 114.74 1x0x h THR 264 Ca 0.39 -1.19 0.00 0.00 0.77 0.00 0.00 66.41 66.38 1x0x h THR 264 Cb 0.12 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 1x0x h THR 264 CO -0.14 0.38 0.00 0.00 0.37 0.00 0.00 175.52 176.13 1x0x n TYR 266 N -2.09 0.00 -2.03 0.00 4.02 -0.97 -4.79 117.16 111.30 1x0x n TYR 266 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 1x0x n TYR 266 Cb 0.17 -0.81 0.00 0.00 -0.02 0.00 0.00 39.34 38.68 1x0x n TYR 266 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1x0x n GLY 267 N 2.27 0.55 3.89 2.72 0.00 -0.45 -5.03 105.19 109.13 1x0x n GLY 267 Ca -0.33 -0.05 -0.29 0.00 0.00 0.00 0.00 46.02 45.35 1x0x n GLY 267 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x0x s GLY 268 N -1.04 1.61 0.19 -0.02 0.00 -0.03 -4.97 107.32 103.07 1x0x s GLY 268 Ca 0.02 -0.42 -0.07 0.00 0.00 0.00 0.00 44.72 44.24 1x0x s GLY 268 CO -0.01 -0.12 1.62 3.21 0.00 0.00 0.00 173.10 177.80 1x0x h ARG 269 N -0.37 0.94 -0.93 2.90 3.08 -1.97 -2.47 114.38 115.56 1x0x h ARG 269 Ca -0.45 -0.35 0.06 0.00 0.07 0.00 0.00 59.98 59.30 1x0x h ARG 269 Cb 1.24 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 31.17 1x0x h ARG 269 CO 0.62 1.02 0.60 -0.91 -1.07 0.00 0.00 179.97 180.23 1x0x h ASN 270 N 0.83 0.96 -0.50 7.04 4.21 -1.93 -1.84 115.58 124.35 1x0x h ASN 270 Ca 0.13 0.00 -0.12 0.00 1.21 0.00 0.00 56.30 57.52 1x0x h ASN 270 Cb 0.69 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 37.67 1x0x h ASN 270 CO 0.05 0.63 -0.17 -0.09 -1.29 0.00 0.00 177.43 176.56 1x0x h ARG 271 N 1.09 0.99 0.75 0.81 2.43 -1.63 -1.13 114.38 117.69 1x0x h ARG 271 Ca 0.39 -0.40 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 1x0x h ARG 271 Cb 0.14 -0.05 0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1x0x h ARG 271 CO -0.14 1.08 -0.36 -0.22 -1.51 0.00 0.00 179.97 178.82 1x0x h LYS 272 N 0.85 -0.97 -0.68 0.20 3.64 -0.94 -1.74 116.57 116.93 1x0x h LYS 272 Ca 0.12 0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.55 1x0x h LYS 272 Cb 0.74 0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 32.75 1x0x h LYS 272 CO 0.06 -0.65 0.35 0.28 -2.27 0.00 0.00 179.45 177.22 1x0x h VAL 273 N -1.01 1.21 -0.47 2.00 2.07 -1.42 -2.55 116.25 116.08 1x0x h VAL 273 Ca -0.10 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.86 1x0x h VAL 273 Cb 0.77 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1x0x h VAL 273 CO 0.17 0.24 0.31 0.00 0.02 0.00 0.00 177.57 178.31 1x0x h ALA 274 N 1.43 0.60 -0.39 1.67 0.00 -1.06 -0.92 119.26 120.58 1x0x h ALA 274 Ca 0.24 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1x0x h ALA 274 Cb 0.06 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1x0x h ALA 274 CO -0.04 0.05 0.22 1.49 0.00 0.00 0.00 179.25 180.98 1x0x h GLU 275 N 0.64 0.54 -0.06 0.00 4.81 -1.04 -1.79 114.58 117.69 1x0x h GLU 275 Ca 0.17 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1x0x h GLU 275 Cb -0.07 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 1x0x h GLU 275 CO -0.04 0.43 -0.12 0.00 -0.73 0.00 0.00 179.01 178.55 1x0x h ALA 276 N 1.09 1.69 -0.65 2.92 0.00 -1.22 -0.70 119.26 122.40 1x0x h ALA 276 Ca 0.14 -0.15 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 1x0x h ALA 276 Cb 0.04 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 1x0x h ALA 276 CO -0.02 0.23 0.08 0.35 0.00 0.00 0.00 179.25 179.88 1x0x h PHE 277 N 0.08 1.16 -0.26 0.00 3.57 -0.38 0.87 116.94 121.98 1x0x h PHE 277 Ca 0.02 -0.17 -0.09 0.00 3.53 0.00 0.00 57.97 61.26 1x0x h PHE 277 Cb 0.27 -0.31 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 1x0x h PHE 277 CO 0.00 0.99 -0.23 0.00 -2.23 0.00 0.00 178.31 176.84 1x0x h ALA 278 N 1.06 1.13 0.11 2.41 0.00 -0.41 -2.53 119.26 121.03 1x0x h ALA 278 Ca 0.19 -0.33 -0.23 0.00 0.00 0.00 0.00 54.91 54.54 1x0x h ALA 278 Cb 0.47 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1x0x h ALA 278 CO 0.02 0.54 -1.14 0.00 0.00 0.00 0.00 179.25 178.67 1x0x h ARG 279 N 0.43 0.23 0.00 0.00 3.08 -0.74 -3.41 114.38 113.97 1x0x h ARG 279 Ca 0.07 -0.40 0.00 0.00 0.07 0.00 0.00 59.98 59.72 1x0x h ARG 279 Cb 0.63 0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1x0x h ARG 279 CO 0.05 1.19 -1.41 0.25 -1.07 0.00 0.00 179.97 178.98 1x0x n THR 280 N -4.05 0.25 -0.82 2.04 -2.24 0.26 -4.97 114.28 104.75 1x0x n THR 280 Ca -0.21 -0.45 0.00 0.00 -2.27 0.00 0.00 64.05 61.12 1x0x n THR 280 Cb 0.84 -0.04 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 1x0x n THR 280 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x0x n GLY 281 N 1.26 0.91 3.71 3.38 0.00 -0.95 -4.99 105.19 108.51 1x0x n GLY 281 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 1x0x n GLY 281 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x0x s LYS 282 N -0.20 0.98 0.52 1.61 1.02 -1.26 -4.99 119.74 117.42 1x0x s LYS 282 Ca 0.00 0.70 -0.19 0.00 0.02 0.00 0.00 55.97 56.49 1x0x s LYS 282 Cb 0.00 -1.79 -0.07 0.00 -0.52 0.00 0.00 37.83 35.46 1x0x s LYS 282 CO 0.00 -2.40 1.07 -1.54 -0.92 0.00 0.00 175.35 171.56 1x0x s SER 283 N -3.46 6.03 0.18 2.83 1.04 -1.26 -4.84 113.70 114.23 1x0x s SER 283 Ca 0.64 1.99 -0.12 0.00 0.48 0.00 0.00 55.95 58.94 1x0x s SER 283 Cb -0.18 -2.56 0.10 0.00 0.10 0.00 0.00 66.02 63.48 1x0x s SER 283 CO 0.57 -1.00 1.80 0.40 0.98 0.00 0.00 173.24 176.00 1x0x h ILE 284 N 1.25 1.20 -0.43 -1.02 2.04 -1.94 -0.78 117.51 117.82 1x0x h ILE 284 Ca -0.49 -0.48 0.06 0.00 1.00 0.00 0.00 64.86 64.95 1x0x h ILE 284 Cb 1.23 0.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.63 1x0x h ILE 284 CO 0.58 0.21 0.12 -0.08 0.00 0.00 0.00 178.15 178.98 1x0x h GLU 285 N 0.86 0.26 -0.73 2.37 4.81 -1.98 0.67 114.58 120.83 1x0x h GLU 285 Ca 0.22 -0.02 -0.04 0.00 -0.13 0.00 0.00 59.36 59.40 1x0x h GLU 285 Cb 0.03 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.31 1x0x h GLU 285 CO -0.04 0.17 0.32 0.37 -0.73 0.00 0.00 179.01 179.10 1x0x h GLN 286 N 0.27 1.08 -0.38 1.92 4.15 -1.84 -2.31 115.11 118.00 1x0x h GLN 286 Ca 0.21 -0.18 -0.08 0.00 0.77 0.00 0.00 58.65 59.37 1x0x h GLN 286 Cb 0.23 -0.18 -0.02 0.00 0.21 0.00 0.00 27.48 27.72 1x0x h GLN 286 CO -0.24 0.86 -0.09 -0.07 -1.93 0.00 0.00 178.83 177.36 1x0x h LEU 287 N 1.04 0.63 -0.49 -2.39 3.38 -0.42 0.43 115.31 117.49 1x0x h LEU 287 Ca 0.25 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1x0x h LEU 287 Cb 0.17 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1x0x h LEU 287 CO -0.03 0.76 0.27 -0.08 0.09 0.00 0.00 178.44 179.46 1x0x h GLU 288 N 0.60 0.69 -0.17 1.13 4.81 -0.45 0.12 114.58 121.32 1x0x h GLU 288 Ca 0.11 -0.08 -0.05 0.00 -0.13 0.00 0.00 59.36 59.21 1x0x h GLU 288 Cb 0.51 -0.14 -0.00 0.00 0.63 0.00 0.00 28.75 29.75 1x0x h GLU 288 CO 0.03 0.54 -0.09 -0.22 -0.73 0.00 0.00 179.01 178.54 1x0x h LYS 289 N 0.66 0.35 0.00 1.92 3.64 -1.07 -1.98 116.57 120.09 1x0x h LYS 289 Ca 0.17 -0.16 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 1x0x h LYS 289 Cb 0.05 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1x0x h LYS 289 CO -0.03 0.67 -0.46 0.93 -2.27 0.00 0.00 179.45 178.30 1x0x h GLU 290 N 0.02 0.00 0.00 1.90 5.08 -0.81 -3.38 114.58 117.40 1x0x h GLU 290 Ca 0.04 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.12 1x0x h GLU 290 Cb 0.57 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.77 1x0x h GLU 290 CO 0.03 0.46 -2.05 1.28 -1.00 0.00 0.00 179.01 177.72 1x0x n LEU 291 N -3.77 0.00 -1.83 1.33 4.77 0.41 -4.69 117.00 113.22 1x0x n LEU 291 Ca -0.01 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.05 1x0x n LEU 291 Cb 0.52 0.37 0.40 0.00 -2.33 0.00 0.00 43.42 42.37 1x0x n LEU 291 CO 0.39 0.37 0.86 0.18 -1.33 0.00 0.00 177.39 177.86 1x0x n LEU 292 N -2.56 5.52 -3.65 2.23 4.77 -0.75 -4.96 117.00 117.61 1x0x n LEU 292 Ca -0.25 -2.80 -0.23 0.00 -0.03 0.00 0.00 56.01 52.71 1x0x n LEU 292 Cb 0.99 -0.66 -0.06 0.00 -2.33 0.00 0.00 43.42 41.35 1x0x n LEU 292 CO 0.33 0.67 -0.26 -3.20 -1.33 0.00 0.00 177.39 173.60 1x0x n ASN 293 N 0.76 0.14 0.00 -1.43 4.05 -1.26 0.47 115.26 117.98 1x0x n ASN 293 Ca 0.27 -0.84 0.00 0.00 0.45 0.00 0.00 54.58 54.47 1x0x n ASN 293 Cb 1.13 -1.05 0.00 0.00 1.23 0.00 0.00 39.78 41.09 1x0x n ASN 293 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1x0x n GLY 294 N -1.73 2.93 3.78 8.20 0.00 -1.26 -4.91 105.19 112.20 1x0x n GLY 294 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1x0x n GLY 294 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x0x s GLN 295 N -0.91 2.04 0.11 1.61 -0.21 0.18 -5.04 119.66 117.44 1x0x s GLN 295 Ca 0.00 0.83 0.07 0.00 0.02 0.00 0.00 55.36 56.28 1x0x s GLN 295 Cb 0.00 -1.90 -0.04 0.00 1.00 0.00 0.00 33.01 32.07 1x0x s GLN 295 CO 0.00 -1.70 -0.08 0.15 -2.12 0.00 0.00 175.29 171.54 1x0x s LYS 296 N -5.04 2.20 0.16 2.91 -0.14 -1.26 -4.82 119.74 113.75 1x0x s LYS 296 Ca 0.61 -1.02 -0.05 0.00 -1.36 0.00 0.00 55.97 54.15 1x0x s LYS 296 Cb -0.16 -2.33 -0.06 0.00 -1.68 0.00 0.00 37.83 33.60 1x0x s LYS 296 CO 0.55 0.50 0.40 -0.51 -0.76 0.00 0.00 175.35 175.54 1x0x s LEU 297 N -2.32 4.25 0.00 3.17 1.43 -1.26 -4.98 118.68 118.97 1x0x s LEU 297 Ca 0.23 0.63 0.00 0.00 -1.03 0.00 0.00 54.13 53.96 1x0x s LEU 297 Cb -0.11 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 42.74 1x0x s LEU 297 CO 0.15 0.03 0.00 0.00 0.23 0.00 0.00 176.35 176.76 1x0x n GLN 298 N 0.02 2.68 -0.01 1.70 1.13 -1.26 -4.83 117.38 116.80 1x0x n GLN 298 Ca -0.02 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 54.91 1x0x n GLN 298 Cb 0.52 -0.84 -0.08 0.00 0.11 0.00 0.00 30.24 29.95 1x0x n GLN 298 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 1x0x h GLY 299 N 0.00 -0.88 0.86 1.08 0.00 -1.93 0.86 103.07 103.06 1x0x h GLY 299 Ca 0.00 0.60 -0.01 0.00 0.00 0.00 0.00 47.33 47.92 1x0x h GLY 299 CO 0.00 -0.21 0.05 -2.55 0.00 0.00 0.00 176.54 173.83 1x0x h PRO 300 N -0.53 0.26 -0.90 4.80 0.11 -1.90 -1.32 132.00 132.52 1x0x h PRO 300 Ca 0.06 -0.05 0.08 0.00 0.11 0.00 0.00 66.00 66.20 1x0x h PRO 300 Cb 0.66 -0.04 -0.06 0.00 0.11 0.00 0.00 31.00 31.67 1x0x h PRO 300 CO -0.42 0.37 0.58 1.49 -0.21 0.00 0.00 178.00 179.81 1x0x h GLU 301 N 0.09 0.92 -0.49 1.05 4.81 -1.86 -0.39 114.58 118.71 1x0x h GLU 301 Ca 0.05 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1x0x h GLU 301 Cb 0.22 -0.21 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 1x0x h GLU 301 CO -0.00 0.61 0.08 1.15 -0.73 0.00 0.00 179.01 180.11 1x0x h THR 302 N 0.95 1.25 -0.88 0.32 2.02 -0.57 -1.98 112.91 114.02 1x0x h THR 302 Ca 0.41 -0.93 0.02 0.00 0.77 0.00 0.00 66.41 66.67 1x0x h THR 302 Cb 0.32 0.91 -0.05 0.00 -1.74 0.00 0.00 68.15 67.59 1x0x h THR 302 CO -0.17 0.33 0.57 0.00 0.37 0.00 0.00 175.52 176.63 1x0x h ALA 303 N 0.96 1.13 -0.88 6.16 0.00 -0.01 0.95 119.26 127.57 1x0x h ALA 303 Ca 0.15 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1x0x h ALA 303 Cb 0.40 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.80 1x0x h ALA 303 CO 0.01 0.47 0.57 -0.09 0.00 0.00 0.00 179.25 180.20 1x0x h ARG 304 N 1.15 1.06 -0.42 0.00 2.43 -0.78 0.15 114.38 117.96 1x0x h ARG 304 Ca 0.33 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.41 1x0x h ARG 304 Cb -0.07 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 29.22 1x0x h ARG 304 CO -0.09 0.70 0.16 0.93 -1.51 0.00 0.00 179.97 180.15 1x0x h GLU 305 N 1.09 0.64 -0.32 0.20 4.39 -0.51 -1.60 114.58 118.46 1x0x h GLU 305 Ca 0.36 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.93 1x0x h GLU 305 Cb 0.04 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 1x0x h GLU 305 CO -0.13 0.61 0.21 -0.07 -1.16 0.00 0.00 179.01 178.47 1x0x h LEU 306 N 0.54 0.38 -0.48 1.33 3.38 -0.05 -0.08 115.31 120.33 1x0x h LEU 306 Ca 0.14 -0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.18 1x0x h LEU 306 Cb 0.22 -0.09 -0.08 0.00 0.09 0.00 0.00 40.66 40.80 1x0x h LEU 306 CO -0.01 0.29 0.00 0.22 0.09 0.00 0.00 178.44 179.03 1x0x h TYR 307 N 0.43 -0.02 -0.26 1.13 3.20 -0.45 0.25 116.97 121.25 1x0x h TYR 307 Ca 0.12 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 1x0x h TYR 307 Cb -0.03 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.31 1x0x h TYR 307 CO -0.05 -0.10 0.14 1.03 -1.64 0.00 0.00 178.16 177.54 1x0x h SER 308 N 0.12 0.33 -0.12 -2.11 0.87 -0.73 0.12 113.55 112.02 1x0x h SER 308 Ca 0.24 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1x0x h SER 308 Cb 0.36 -0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 1x0x h SER 308 CO -0.40 0.32 0.07 0.40 -0.53 0.00 0.00 176.83 176.69 1x0x h ILE 309 N 0.31 1.01 -0.54 2.23 2.04 -0.28 -2.30 117.51 119.99 1x0x h ILE 309 Ca 0.09 -0.05 -0.06 0.00 1.00 0.00 0.00 64.86 65.84 1x0x h ILE 309 Cb 0.07 0.85 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 1x0x h ILE 309 CO -0.01 0.03 0.08 -0.07 0.00 0.00 0.00 178.15 178.17 1x0x h LEU 310 N 0.15 0.82 -0.61 1.44 3.38 -0.37 -2.97 115.31 117.14 1x0x h LEU 310 Ca 0.05 -0.17 -0.15 0.00 0.09 0.00 0.00 57.88 57.69 1x0x h LEU 310 Cb -0.00 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1x0x h LEU 310 CO -0.02 0.84 -0.65 0.06 0.09 0.00 0.00 178.44 178.76 1x0x h GLN 311 N 0.82 0.21 0.00 1.13 3.07 -0.65 0.14 115.11 119.83 1x0x h GLN 311 Ca 0.17 -0.15 0.00 0.00 0.09 0.00 0.00 58.65 58.76 1x0x h GLN 311 Cb 0.38 0.03 0.00 0.00 0.08 0.00 0.00 27.48 27.97 1x0x h GLN 311 CO 0.01 0.78 0.00 0.72 0.09 0.00 0.00 178.83 180.43 1x0x n HIS 312 N -3.83 0.00 -1.68 0.06 8.25 -0.87 -0.83 115.22 116.31 1x0x n HIS 312 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1x0x n HIS 312 Cb 0.65 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.76 1x0x n HIS 312 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1x0x n LYS 313 N -0.82 0.11 -4.32 -0.41 5.02 -0.87 -5.00 118.16 111.86 1x0x n LYS 313 Ca 0.06 -0.97 -0.38 0.00 -2.02 0.00 0.00 58.31 55.00 1x0x n LYS 313 Cb 0.03 -0.56 -0.04 0.00 -0.02 0.00 0.00 35.03 34.44 1x0x n LYS 313 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1x0x n GLY 314 N -0.08 -0.42 0.49 0.72 0.00 -0.01 -4.84 105.19 101.06 1x0x n GLY 314 Ca 0.01 0.12 0.09 0.00 0.00 0.00 0.00 46.02 46.24 1x0x n GLY 314 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x0x n LEU 315 N -4.29 3.13 -0.36 0.99 4.77 0.42 -4.72 117.00 116.94 1x0x n LEU 315 Ca 0.07 -3.05 -0.00 0.00 -0.03 0.00 0.00 56.01 52.99 1x0x n LEU 315 Cb 0.49 -0.49 0.14 0.00 -2.33 0.00 0.00 43.42 41.23 1x0x n LEU 315 CO 0.89 0.69 1.27 0.58 -1.33 0.00 0.00 177.39 179.49 1x0x h VAL 316 N 0.92 1.16 0.00 4.08 2.07 -1.88 -1.03 116.25 121.57 1x0x h VAL 316 Ca 0.00 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.10 1x0x h VAL 316 Cb 1.23 -0.17 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1x0x h VAL 316 CO 0.11 0.22 0.00 -0.90 0.02 0.00 0.00 177.57 177.03 1x0x n ASP 317 N -4.47 0.13 0.11 0.57 3.85 -1.26 -2.95 116.55 112.53 1x0x n ASP 317 Ca 0.13 0.55 0.12 0.00 -0.71 0.00 0.00 54.79 54.88 1x0x n ASP 317 Cb 0.10 -0.57 0.23 0.00 -1.35 0.00 0.00 41.12 39.53 1x0x n ASP 317 CO 0.00 0.00 0.00 0.11 -1.01 0.00 0.00 177.20 176.30 1x0x h LYS 318 N 0.00 0.00 -2.13 0.11 1.79 -1.55 -3.40 116.57 111.39 1x0x h LYS 318 Ca 0.00 0.00 -0.58 0.00 -2.18 0.00 0.00 60.65 57.89 1x0x h LYS 318 Cb 0.13 0.00 -0.41 0.00 -1.58 0.00 0.00 32.23 30.37 1x0x h LYS 318 CO 0.00 0.00 -0.79 1.19 -1.08 0.00 0.00 179.45 178.77 1x0x n PHE 319 N -2.39 2.07 -0.29 -1.35 3.01 -1.15 -4.98 117.46 112.38 1x0x n PHE 319 Ca 0.04 -3.92 -0.09 0.00 1.01 0.00 0.00 57.45 54.48 1x0x n PHE 319 Cb 0.46 -0.47 -0.06 0.00 -0.01 0.00 0.00 39.48 39.41 1x0x n PHE 319 CO 0.00 0.00 0.00 -1.35 1.01 0.00 0.00 176.76 176.42 1x0x h PRO 320 N 4.14 -0.14 -0.08 -1.08 0.11 -1.79 0.29 132.00 133.44 1x0x h PRO 320 Ca 0.15 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.27 1x0x h PRO 320 Cb 0.75 0.03 -0.00 0.00 0.11 0.00 0.00 31.00 31.89 1x0x h PRO 320 CO 0.69 -0.10 0.03 1.25 -0.21 0.00 0.00 178.00 179.67 1x0x h LEU 321 N -0.15 0.10 0.30 2.35 7.12 -1.94 0.40 115.31 123.50 1x0x h LEU 321 Ca 0.18 -0.14 -0.01 0.00 0.13 0.00 0.00 57.88 58.04 1x0x h LEU 321 Cb 0.52 -0.03 -0.01 0.00 -0.53 0.00 0.00 40.66 40.62 1x0x h LEU 321 CO -0.80 0.22 -0.22 -0.26 -0.13 0.00 0.00 178.44 177.24 1x0x h PHE 322 N -0.01 -0.58 0.00 1.25 0.05 -1.86 -2.04 116.94 113.74 1x0x h PHE 322 Ca 0.03 -0.00 -0.02 0.00 3.82 0.00 0.00 57.97 61.79 1x0x h PHE 322 Cb 0.14 0.21 -0.00 0.00 2.00 0.00 0.00 35.95 38.30 1x0x h PHE 322 CO -0.02 -0.34 -0.10 0.52 -0.18 0.00 0.00 178.31 178.19 1x0x h MET 323 N -0.52 0.00 -0.19 1.51 2.86 -0.34 -1.31 114.93 116.94 1x0x h MET 323 Ca -0.02 0.00 -0.09 0.00 -2.06 0.00 0.00 59.70 57.52 1x0x h MET 323 Cb 0.45 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1x0x h MET 323 CO 0.00 0.10 -0.30 0.00 1.06 0.00 0.00 176.91 177.77 1x0x h ALA 324 N 1.90 1.15 -0.23 6.32 0.00 0.26 0.14 119.26 128.80 1x0x h ALA 324 Ca -0.00 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.46 1x0x h ALA 324 Cb 0.17 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1x0x h ALA 324 CO 0.01 0.54 -0.22 0.28 0.00 0.00 0.00 179.25 179.86 1x0x h VAL 325 N 0.32 1.32 -0.40 0.00 2.07 -0.57 -2.19 116.25 116.80 1x0x h VAL 325 Ca 0.04 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.17 1x0x h VAL 325 Cb 0.69 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1x0x h VAL 325 CO 0.05 0.43 0.22 0.22 0.02 0.00 0.00 177.57 178.51 1x0x h TYR 326 N 0.25 0.55 -0.35 1.57 3.20 -0.84 -1.65 116.97 119.69 1x0x h TYR 326 Ca 0.04 -0.01 -0.10 0.00 3.14 0.00 0.00 58.73 61.79 1x0x h TYR 326 Cb 0.77 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.85 1x0x h TYR 326 CO 0.08 0.42 -0.21 0.87 -1.64 0.00 0.00 178.16 177.67 1x0x h LYS 327 N 0.52 0.67 -0.34 1.82 1.57 -0.73 0.17 116.57 120.25 1x0x h LYS 327 Ca 0.14 -0.25 -0.13 0.00 -1.87 0.00 0.00 60.65 58.53 1x0x h LYS 327 Cb 0.05 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1x0x h LYS 327 CO -0.02 0.83 -0.33 0.28 -0.57 0.00 0.00 179.45 179.63 1x0x h VAL 328 N 0.59 1.28 -0.08 0.50 2.07 -1.20 0.63 116.25 120.03 1x0x h VAL 328 Ca 0.09 -1.48 -0.23 0.00 0.82 0.00 0.00 66.70 65.90 1x0x h VAL 328 Cb 0.68 1.37 0.01 0.00 -1.52 0.00 0.00 31.29 31.83 1x0x h VAL 328 CO 0.05 0.49 -0.85 0.00 0.02 0.00 0.00 177.57 177.27 1x0x n TYR 330 N -3.87 0.00 0.41 0.00 4.02 0.03 -4.76 117.16 112.99 1x0x n TYR 330 Ca -0.07 0.00 0.12 0.00 -0.01 0.00 0.00 57.90 57.93 1x0x n TYR 330 Cb 0.78 -0.16 0.05 0.00 -0.02 0.00 0.00 39.34 39.99 1x0x n TYR 330 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1x0x n GLU 331 N -2.02 0.40 -0.41 -0.72 1.02 0.15 -4.96 120.64 114.09 1x0x n GLU 331 Ca -0.05 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1x0x n GLU 331 Cb 0.50 -1.69 0.00 0.00 -0.02 0.00 0.00 31.44 30.23 1x0x n GLU 331 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1x0x n GLY 332 N 1.30 0.75 3.71 0.62 0.00 -0.80 -5.03 105.19 105.75 1x0x n GLY 332 Ca 0.01 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.21 1x0x n GLY 332 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1x0x s GLN 333 N -0.80 4.33 0.18 1.61 0.74 -1.10 -4.93 119.66 119.69 1x0x s GLN 333 Ca 0.00 2.04 -0.33 0.00 0.05 0.00 0.00 55.36 57.11 1x0x s GLN 333 Cb 0.00 -3.28 -0.14 0.00 1.10 0.00 0.00 33.01 30.69 1x0x s GLN 333 CO 0.00 -0.43 1.48 -2.30 -0.55 0.00 0.00 175.29 173.50 1x0x n PRO 334 N 4.05 1.97 -0.19 1.67 -0.02 -1.26 -4.44 135.00 136.78 1x0x n PRO 334 Ca 0.11 0.71 0.06 0.00 -2.02 0.00 0.00 63.50 62.36 1x0x n PRO 334 Cb 0.43 -2.42 0.34 0.00 -0.02 0.00 0.00 33.50 31.83 1x0x n PRO 334 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 1x0x h VAL 335 N 3.38 1.04 0.00 -1.45 3.04 -1.92 -0.78 116.25 119.56 1x0x h VAL 335 Ca -0.45 -0.27 0.00 0.00 -1.01 0.00 0.00 66.70 64.97 1x0x h VAL 335 Cb 1.27 0.18 0.00 0.00 -2.01 0.00 0.00 31.29 30.74 1x0x h VAL 335 CO 0.83 0.14 0.10 0.61 -1.01 0.00 0.00 177.57 178.24 1x0x n GLY 336 N -1.44 -0.59 0.26 3.17 0.00 -1.26 0.31 105.19 105.64 1x0x n GLY 336 Ca 0.10 0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.34 1x0x n GLY 336 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x0x n GLU 337 N -1.79 1.00 -0.16 1.61 1.02 -0.30 -4.12 120.64 117.90 1x0x n GLU 337 Ca -0.01 -0.51 -0.07 0.00 -0.02 0.00 0.00 57.16 56.55 1x0x n GLU 337 Cb 0.11 -1.49 0.02 0.00 -0.02 0.00 0.00 31.44 30.07 1x0x n GLU 337 CO 0.00 0.00 0.00 0.35 1.18 0.00 0.00 177.13 178.66 1x0x h PHE 338 N 1.25 0.58 -0.85 -0.32 3.57 -0.30 -2.37 116.94 118.50 1x0x h PHE 338 Ca 0.00 0.02 0.20 0.00 3.53 0.00 0.00 57.97 61.71 1x0x h PHE 338 Cb 0.44 -0.19 -0.06 0.00 2.79 0.00 0.00 35.95 38.93 1x0x h PHE 338 CO 0.00 0.35 0.57 0.82 -2.23 0.00 0.00 178.31 177.83 1x0x h ILE 339 N 0.62 0.69 -0.59 1.41 1.08 -1.79 -0.29 117.51 118.64 1x0x h ILE 339 Ca 0.18 -0.12 0.03 0.00 -0.39 0.00 0.00 64.86 64.57 1x0x h ILE 339 Cb -0.04 0.32 -0.03 0.00 -3.07 0.00 0.00 36.82 34.00 1x0x h ILE 339 CO -0.06 0.06 0.39 -0.74 -0.69 0.00 0.00 178.15 177.11 1x0x h HIS 340 N 0.34 0.68 0.00 1.37 2.76 -1.70 -0.21 115.15 118.38 1x0x h HIS 340 Ca 0.43 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.62 1x0x h HIS 340 Cb 1.16 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.90 1x0x h HIS 340 CO -0.00 0.40 0.00 0.00 -1.30 0.00 0.00 177.93 177.03 1x0x n LEU 342 N -1.57 2.52 0.27 0.00 4.77 -0.19 -2.82 117.00 119.97 1x0x n LEU 342 Ca 0.05 0.24 0.12 0.00 -0.03 0.00 0.00 56.01 56.39 1x0x n LEU 342 Cb 0.24 -1.09 0.75 0.00 -2.33 0.00 0.00 43.42 40.99 1x0x n LEU 342 CO 0.19 0.76 1.01 1.56 -1.33 0.00 0.00 177.39 179.59 1x0x h GLN 343 N -0.11 0.00 -0.00 3.23 4.20 -1.08 -2.71 115.11 118.64 1x0x h GLN 343 Ca -0.42 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.29 1x0x h GLN 343 Cb 1.92 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.70 1x0x h GLN 343 CO 0.04 0.09 -0.58 0.09 -0.67 0.00 0.00 178.83 177.80 1x0x n ASN 344 N -3.80 0.95 -4.59 1.46 3.02 -0.93 -5.02 115.26 106.34 1x0x n ASN 344 Ca -0.02 -0.98 -0.50 0.00 -0.03 0.00 0.00 54.58 53.06 1x0x n ASN 344 Cb 0.19 0.84 -0.05 0.00 -0.61 0.00 0.00 39.78 40.16 1x0x n ASN 344 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 1x0x n HIS 345 N -0.99 1.46 -1.62 3.10 -0.00 -1.02 -4.86 115.22 111.30 1x0x n HIS 345 Ca 0.04 0.63 -0.40 0.00 0.46 0.00 0.00 57.72 58.45 1x0x n HIS 345 Cb 0.26 -2.32 0.02 0.00 -0.12 0.00 0.00 29.99 27.83 1x0x n HIS 345 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 1x0x n PRO 346 N 2.11 1.25 0.22 1.57 -0.04 -1.26 -4.87 135.00 133.98 1x0x n PRO 346 Ca 0.16 0.46 0.10 0.00 -0.04 0.00 0.00 63.50 64.18 1x0x n PRO 346 Cb 0.23 -2.11 0.42 0.00 -0.04 0.00 0.00 33.50 32.01 1x0x n PRO 346 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1x0x h GLU 347 N 1.24 0.00 -3.78 0.54 5.08 -2.00 -3.45 114.58 112.20 1x0x h GLU 347 Ca -0.46 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 57.81 1x0x h GLU 347 Cb 1.34 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.46 1x0x h GLU 347 CO 0.55 0.22 -0.32 -1.01 -1.00 0.00 0.00 179.01 177.44 1x0x s HIS 348 N -3.57 0.18 0.00 4.33 3.76 -1.26 -5.18 115.29 113.55 1x0x s HIS 348 Ca 0.01 -0.58 0.00 0.00 -0.15 0.00 0.00 55.06 54.34 1x0x s HIS 348 Cb 0.10 -0.02 0.00 0.00 1.11 0.00 0.00 32.58 33.76 1x0x s HIS 348 CO 0.64 -0.61 0.00 -1.33 -0.85 0.00 0.00 174.74 172.59