#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gfs n GLN 4 N 0.00 2.53 -3.25 1.64 -0.06 -1.05 -4.73 117.38 112.46 1gfs n GLN 4 Ca 0.00 0.93 -0.43 0.00 -2.00 0.00 0.00 57.00 55.50 1gfs n GLN 4 Cb 0.00 -2.81 -0.08 0.00 -4.06 0.00 0.00 30.24 23.28 1gfs n GLN 4 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 1gfs s ARG 5 N 3.71 3.24 -0.17 3.69 0.52 -1.26 -0.50 118.95 128.19 1gfs s ARG 5 Ca 0.88 -0.55 -0.05 0.00 -0.52 0.00 0.00 55.73 55.50 1gfs s ARG 5 Cb -0.56 -3.93 -0.03 0.00 0.52 0.00 0.00 34.95 30.94 1gfs s ARG 5 CO 0.45 -0.85 -0.01 0.08 0.02 0.00 0.00 175.30 174.99 1gfs s VAL 6 N 2.36 4.14 -0.24 3.52 1.01 -0.44 -0.40 120.40 130.35 1gfs s VAL 6 Ca 0.16 -0.27 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 1gfs s VAL 6 Cb -0.16 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.35 1gfs s VAL 6 CO 0.15 0.48 0.09 0.12 0.00 0.00 0.00 175.10 175.94 1gfs s PHE 7 N 0.41 3.15 -0.36 5.22 5.36 -0.54 -0.57 117.98 130.65 1gfs s PHE 7 Ca -0.02 -0.18 -0.05 0.00 -0.96 0.00 0.00 56.93 55.73 1gfs s PHE 7 Cb -0.14 -2.22 0.07 0.00 -0.34 0.00 0.00 43.02 40.39 1gfs s PHE 7 CO 0.02 -0.18 0.14 0.42 -1.46 0.00 0.00 175.22 174.16 1gfs s ILE 8 N 1.30 3.52 0.17 3.12 1.01 -1.23 -1.14 121.20 127.95 1gfs s ILE 8 Ca 0.05 -1.52 -0.30 0.00 0.00 0.00 0.00 60.65 58.89 1gfs s ILE 8 Cb -0.15 -3.15 -0.07 0.00 0.01 0.00 0.00 42.46 39.10 1gfs s ILE 8 CO 0.04 -0.37 1.15 0.00 0.00 0.00 0.00 174.94 175.76 1gfs s ALA 9 N 1.29 3.40 -0.85 9.38 0.00 -0.63 -3.66 121.76 130.70 1gfs s ALA 9 Ca 0.01 0.87 -0.01 0.00 0.00 0.00 0.00 51.96 52.83 1gfs s ALA 9 Cb -0.21 -3.39 0.00 0.00 0.00 0.00 0.00 23.12 19.52 1gfs s ALA 9 CO -0.00 -0.30 0.71 0.41 0.00 0.00 0.00 175.76 176.58 1gfs n GLY 10 N 2.24 -0.10 0.04 0.00 0.00 -1.26 -2.37 105.19 103.74 1gfs n GLY 10 Ca 0.04 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.08 1gfs n GLY 10 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 1gfs n HIS 11 N -3.36 0.24 0.24 1.61 -0.00 -1.24 -2.69 115.22 110.03 1gfs n HIS 11 Ca -0.16 0.09 0.12 0.00 -0.00 0.00 0.00 57.72 57.77 1gfs n HIS 11 Cb 0.60 -0.65 0.04 0.00 -0.00 0.00 0.00 29.99 29.98 1gfs n HIS 11 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 1gfs n ARG 12 N -1.72 0.51 -0.97 -1.40 5.12 -1.26 -1.68 116.66 115.26 1gfs n ARG 12 Ca 0.03 0.10 -0.30 0.00 -1.93 0.00 0.00 57.85 55.75 1gfs n ARG 12 Cb 0.20 -1.77 0.24 0.00 -1.16 0.00 0.00 32.46 29.96 1gfs n ARG 12 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1gfs s GLY 13 N -4.15 1.55 0.08 -0.13 0.00 -1.09 -4.69 107.32 98.89 1gfs s GLY 13 Ca 0.01 -0.82 -0.28 0.00 0.00 0.00 0.00 44.72 43.63 1gfs s GLY 13 CO 0.78 0.04 1.68 1.98 0.00 0.00 0.00 173.10 177.58 1gfs h MET 14 N -2.61 -0.45 -0.09 2.90 4.05 -1.88 -1.11 114.93 115.74 1gfs h MET 14 Ca -0.47 0.03 -0.22 0.00 -0.28 0.00 0.00 59.70 58.76 1gfs h MET 14 Cb 1.31 0.10 0.01 0.00 -0.80 0.00 0.00 31.60 32.22 1gfs h MET 14 CO 0.37 -0.30 -0.82 -0.39 0.23 0.00 0.00 176.91 176.01 1gfs h VAL 15 N -0.46 1.30 -0.18 -5.77 -1.51 -1.91 -2.91 116.25 104.81 1gfs h VAL 15 Ca -0.05 -2.05 0.03 0.00 -1.23 0.00 0.00 66.70 63.41 1gfs h VAL 15 Cb 0.36 2.18 -0.03 0.00 -2.13 0.00 0.00 31.29 31.67 1gfs h VAL 15 CO 0.07 0.64 -0.01 1.23 -1.23 0.00 0.00 177.57 178.27 1gfs h GLY 16 N 0.39 0.16 1.75 5.19 0.00 -1.68 -1.67 103.07 107.20 1gfs h GLY 16 Ca -0.08 0.03 -0.04 0.00 0.00 0.00 0.00 47.33 47.24 1gfs h GLY 16 CO 0.16 -0.04 -0.07 1.48 0.00 0.00 0.00 176.54 178.07 1gfs h SER 17 N 0.04 0.29 -0.44 0.19 4.64 -0.27 -1.07 113.55 116.92 1gfs h SER 17 Ca 0.08 -0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.23 1gfs h SER 17 Cb 0.11 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1gfs h SER 17 CO -0.16 0.41 -0.20 0.00 -0.87 0.00 0.00 176.83 176.02 1gfs h ALA 18 N 1.63 0.75 -0.40 5.18 0.00 -1.23 0.12 119.26 125.31 1gfs h ALA 18 Ca 0.06 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.48 1gfs h ALA 18 Cb 0.33 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1gfs h ALA 18 CO 0.02 0.66 -0.19 0.82 0.00 0.00 0.00 179.25 180.56 1gfs h ILE 19 N 0.82 1.28 -0.23 0.00 2.04 -0.81 -3.00 117.51 117.62 1gfs h ILE 19 Ca 0.11 -1.32 -0.00 0.00 1.00 0.00 0.00 64.86 64.64 1gfs h ILE 19 Cb 0.76 1.29 -0.01 0.00 -0.74 0.00 0.00 36.82 38.11 1gfs h ILE 19 CO 0.06 0.44 0.13 -0.09 0.00 0.00 0.00 178.15 178.70 1gfs h ARG 20 N 0.64 0.32 -0.97 2.37 1.12 -1.02 -1.86 114.38 114.98 1gfs h ARG 20 Ca 0.09 -0.03 0.16 0.00 -1.11 0.00 0.00 59.98 59.08 1gfs h ARG 20 Cb 0.74 -0.06 -0.10 0.00 -0.01 0.00 0.00 29.97 30.54 1gfs h ARG 20 CO 0.06 0.27 0.58 0.00 -3.11 0.00 0.00 179.97 177.77 1gfs h ARG 21 N 0.27 0.79 0.00 0.20 3.08 -0.93 -0.41 114.38 117.38 1gfs h ARG 21 Ca 0.08 -0.05 -0.16 0.00 0.07 0.00 0.00 59.98 59.92 1gfs h ARG 21 Cb 0.04 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 1gfs h ARG 21 CO -0.01 0.52 -0.78 1.96 -1.07 0.00 0.00 179.97 180.59 1gfs h GLN 22 N 0.82 0.00 0.00 0.04 4.20 -1.33 -3.30 115.11 115.53 1gfs h GLN 22 Ca 0.53 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 59.11 1gfs h GLN 22 Cb 0.70 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.46 1gfs h GLN 22 CO -0.34 0.78 -0.88 -0.07 -0.67 0.00 0.00 178.83 177.65 1gfs h LEU 23 N 0.00 0.00 -1.70 1.46 3.38 -0.67 -3.22 115.31 114.56 1gfs h LEU 23 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 1gfs h LEU 23 Cb 1.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.32 1gfs h LEU 23 CO 0.10 0.51 -0.17 -0.08 0.09 0.00 0.00 178.44 178.89 1gfs h GLU 24 N 0.00 0.00 -1.77 1.13 4.81 -1.17 -3.06 114.58 114.51 1gfs h GLU 24 Ca -0.07 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 58.95 1gfs h GLU 24 Cb 1.45 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.74 1gfs h GLU 24 CO 0.06 0.17 0.20 1.04 -0.73 0.00 0.00 179.01 179.75 1gfs n GLN 25 N -3.70 1.59 -3.65 1.92 6.02 -1.22 -4.75 117.38 113.60 1gfs n GLN 25 Ca -0.02 -1.03 -0.02 0.00 -0.01 0.00 0.00 57.00 55.92 1gfs n GLN 25 Cb 0.29 -1.47 -0.06 0.00 1.02 0.00 0.00 30.24 30.01 1gfs n GLN 25 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 1gfs s ARG 26 N -0.94 0.32 0.00 -1.09 1.70 -1.16 -5.06 118.95 112.71 1gfs s ARG 26 Ca 0.25 0.53 0.30 0.00 -0.47 0.00 0.00 55.73 56.35 1gfs s ARG 26 Cb 0.18 0.07 1.47 0.00 -0.57 0.00 0.00 34.95 36.10 1gfs s ARG 26 CO -0.02 -0.06 1.99 0.41 -1.08 0.00 0.00 175.30 176.53 1gfs n GLY 27 N 3.48 -0.72 0.40 3.88 0.00 -1.26 -3.67 105.19 107.29 1gfs n GLY 27 Ca -0.18 -0.28 0.06 0.00 0.00 0.00 0.00 46.02 45.62 1gfs n GLY 27 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1gfs n ASP 28 N -0.68 1.18 -3.92 1.61 5.75 -1.26 -4.78 116.55 114.46 1gfs n ASP 28 Ca 0.20 -1.87 -0.17 0.00 -0.01 0.00 0.00 54.79 52.94 1gfs n ASP 28 Cb 0.23 -0.13 -0.15 0.00 -1.03 0.00 0.00 41.12 40.04 1gfs n ASP 28 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1gfs s VAL 29 N -1.75 0.37 -0.19 2.12 1.01 -1.24 -2.54 120.40 118.18 1gfs s VAL 29 Ca 0.20 -0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.06 1gfs s VAL 29 Cb 0.10 -0.35 0.02 0.00 0.00 0.00 0.00 36.38 36.15 1gfs s VAL 29 CO 0.15 0.13 -0.19 -0.70 0.00 0.00 0.00 175.10 174.49 1gfs s GLU 30 N 0.28 2.95 -0.00 2.72 2.12 0.34 -4.94 118.70 122.17 1gfs s GLU 30 Ca -0.03 -0.86 -0.25 0.00 0.36 0.00 0.00 54.97 54.20 1gfs s GLU 30 Cb -0.06 -2.60 -0.05 0.00 0.26 0.00 0.00 34.13 31.68 1gfs s GLU 30 CO -0.00 -0.23 0.75 -0.51 -0.54 0.00 0.00 175.26 174.73 1gfs s LEU 31 N 1.28 4.39 -0.27 2.70 1.43 -1.26 -1.33 118.68 125.62 1gfs s LEU 31 Ca 0.04 1.36 -0.04 0.00 -1.03 0.00 0.00 54.13 54.46 1gfs s LEU 31 Cb -0.13 -3.19 0.02 0.00 0.03 0.00 0.00 46.19 42.91 1gfs s LEU 31 CO -0.12 -0.05 0.01 -0.69 0.23 0.00 0.00 176.35 175.72 1gfs s VAL 32 N 0.35 3.44 0.02 -1.59 1.01 0.27 -4.94 120.40 118.96 1gfs s VAL 32 Ca 0.39 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.59 1gfs s VAL 32 Cb -0.19 -2.76 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1gfs s VAL 32 CO 0.21 0.14 -0.17 -0.76 0.00 0.00 0.00 175.10 174.52 1gfs s LEU 33 N 1.42 2.11 -0.01 3.92 1.43 -1.26 -3.51 118.68 122.77 1gfs s LEU 33 Ca 0.01 -0.41 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 1gfs s LEU 33 Cb -0.17 -0.83 0.00 0.00 0.03 0.00 0.00 46.19 45.22 1gfs s LEU 33 CO -0.01 0.15 -0.05 -0.13 0.23 0.00 0.00 176.35 176.54 1gfs s ARG 34 N -0.82 0.47 0.58 1.70 3.00 -1.26 -5.11 118.95 117.51 1gfs s ARG 34 Ca 0.06 -0.15 -0.06 0.00 0.00 0.00 0.00 55.73 55.57 1gfs s ARG 34 Cb -0.08 -0.48 -0.00 0.00 0.00 0.00 0.00 34.95 34.40 1gfs s ARG 34 CO 0.01 0.06 0.90 0.95 0.00 0.00 0.00 175.30 177.22 1gfs s THR 35 N 0.14 3.90 0.56 0.02 -4.23 -1.26 -4.74 115.64 110.03 1gfs s THR 35 Ca -0.01 0.12 0.25 0.00 -1.18 0.00 0.00 61.69 60.87 1gfs s THR 35 Cb -0.05 -3.54 0.35 0.00 1.34 0.00 0.00 72.50 70.59 1gfs s THR 35 CO -0.00 -0.58 2.11 0.08 -0.54 0.00 0.00 174.62 175.69 1gfs h ARG 36 N -0.16 0.00 0.07 3.99 -0.00 -2.02 0.20 114.38 116.47 1gfs h ARG 36 Ca -0.46 0.00 -0.26 0.00 -0.00 0.00 0.00 59.98 59.27 1gfs h ARG 36 Cb 1.24 0.00 0.01 0.00 -0.00 0.00 0.00 29.97 31.22 1gfs h ARG 36 CO 0.61 0.00 -1.11 0.38 -0.00 0.00 0.00 179.97 179.85 1gfs h ASP 37 N 0.00 0.53 0.39 0.08 3.04 -2.03 -3.32 116.42 115.12 1gfs h ASP 37 Ca 0.09 -0.49 -0.23 0.00 -3.24 0.00 0.00 57.03 53.16 1gfs h ASP 37 Cb 0.43 -0.17 0.00 0.00 -1.04 0.00 0.00 39.33 38.55 1gfs h ASP 37 CO -0.00 1.33 -0.95 -0.33 -2.04 0.00 0.00 179.24 177.24 1gfs h GLU 38 N 0.17 0.37 -3.08 4.15 5.08 -1.29 -3.43 114.58 116.54 1gfs h GLU 38 Ca -0.12 -0.41 -0.42 0.00 -1.00 0.00 0.00 59.36 57.41 1gfs h GLU 38 Cb 1.79 0.12 -0.40 0.00 0.50 0.00 0.00 28.75 30.76 1gfs h GLU 38 CO 0.19 1.09 -0.73 -1.17 -1.00 0.00 0.00 179.01 177.39 1gfs s LEU 39 N -7.64 0.24 -0.57 1.33 2.96 0.48 -4.91 118.68 110.57 1gfs s LEU 39 Ca -0.05 -0.38 -0.27 0.00 -0.22 0.00 0.00 54.13 53.21 1gfs s LEU 39 Cb 0.09 -0.15 0.03 0.00 0.50 0.00 0.00 46.19 46.66 1gfs s LEU 39 CO 0.86 -0.32 1.12 0.21 -1.32 0.00 0.00 176.35 176.90 1gfs s ASN 40 N 2.17 6.42 0.61 3.68 2.47 -1.25 -4.37 114.94 124.66 1gfs s ASN 40 Ca 0.03 -0.02 0.39 0.00 0.42 0.00 0.00 52.86 53.68 1gfs s ASN 40 Cb -0.15 -2.52 1.97 0.00 -1.45 0.00 0.00 41.25 39.10 1gfs s ASN 40 CO -0.08 -1.41 2.21 -0.07 -3.72 0.00 0.00 177.10 174.04 1gfs h LEU 41 N 11.65 0.00 -0.00 3.21 3.38 -1.95 -1.96 115.31 129.65 1gfs h LEU 41 Ca -0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1gfs h LEU 41 Cb 1.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1gfs h LEU 41 CO 1.16 0.01 0.00 0.18 0.09 0.00 0.00 178.44 179.88 1gfs n LEU 42 N -3.18 0.74 -4.52 1.67 4.77 -1.26 -4.43 117.00 110.80 1gfs n LEU 42 Ca -0.02 0.57 -0.43 0.00 -0.03 0.00 0.00 56.01 56.10 1gfs n LEU 42 Cb 0.16 -0.34 -0.06 0.00 -2.33 0.00 0.00 43.42 40.86 1gfs n LEU 42 CO 0.24 -0.17 0.47 -0.62 -1.33 0.00 0.00 177.39 175.98 1gfs s ASP 43 N -4.40 6.34 0.12 -1.43 -1.08 -0.74 -4.95 116.67 110.54 1gfs s ASP 43 Ca 0.11 -0.34 -0.26 0.00 -0.52 0.00 0.00 52.55 51.53 1gfs s ASP 43 Cb 0.13 -2.35 -0.07 0.00 -1.46 0.00 0.00 42.92 39.17 1gfs s ASP 43 CO 0.59 -0.88 1.64 0.28 0.52 0.00 0.00 175.17 177.32 1gfs h SER 44 N 8.97 -0.72 -0.61 -0.34 0.02 -1.85 -1.42 113.55 117.59 1gfs h SER 44 Ca -0.25 0.09 0.04 0.00 -0.84 0.00 0.00 61.79 60.83 1gfs h SER 44 Cb 1.09 0.29 -0.05 0.00 0.14 0.00 0.00 62.40 63.87 1gfs h SER 44 CO 0.94 -0.33 0.35 0.03 -1.14 0.00 0.00 176.83 176.68 1gfs h ARG 45 N -0.42 0.66 -0.44 3.45 -0.00 -1.95 -0.02 114.38 115.65 1gfs h ARG 45 Ca 0.04 -0.04 0.00 0.00 -0.50 0.00 0.00 59.98 59.49 1gfs h ARG 45 Cb 0.48 -0.15 -0.02 0.00 0.00 0.00 0.00 29.97 30.28 1gfs h ARG 45 CO -0.18 0.43 0.28 0.00 0.00 0.00 0.00 179.97 180.51 1gfs h ALA 46 N 1.30 0.55 -0.48 0.04 0.00 -1.82 0.74 119.26 119.59 1gfs h ALA 46 Ca 0.26 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1gfs h ALA 46 Cb 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1gfs h ALA 46 CO -0.14 0.02 0.08 0.28 0.00 0.00 0.00 179.25 179.49 1gfs h VAL 47 N 0.59 1.25 -0.58 0.00 2.07 -0.83 -1.37 116.25 117.38 1gfs h VAL 47 Ca 0.16 -0.91 -0.08 0.00 0.82 0.00 0.00 66.70 66.69 1gfs h VAL 47 Cb -0.05 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1gfs h VAL 47 CO -0.03 0.32 0.04 0.45 0.02 0.00 0.00 177.57 178.37 1gfs h HIS 48 N 0.67 1.07 -0.87 1.57 3.86 -0.76 -2.04 115.15 118.66 1gfs h HIS 48 Ca 0.15 -0.17 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1gfs h HIS 48 Cb 0.38 -0.29 -0.05 0.00 1.06 0.00 0.00 27.41 28.52 1gfs h HIS 48 CO 0.03 0.95 0.57 -0.44 0.86 0.00 0.00 177.93 179.90 1gfs h ASP 49 N 0.88 0.98 -0.24 2.45 5.19 -0.67 -0.67 116.42 124.34 1gfs h ASP 49 Ca 0.17 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.55 1gfs h ASP 49 Cb 0.49 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.75 1gfs h ASP 49 CO 0.02 0.70 0.11 0.15 -3.12 0.00 0.00 179.24 177.10 1gfs h PHE 50 N 1.15 0.35 0.00 4.55 3.57 -0.96 -0.78 116.94 124.82 1gfs h PHE 50 Ca 0.33 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.75 1gfs h PHE 50 Cb -0.09 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 1gfs h PHE 50 CO -0.01 0.35 -0.29 0.74 -2.23 0.00 0.00 178.31 176.87 1gfs h PHE 51 N 0.25 0.00 -0.04 0.41 0.04 -0.98 -0.75 116.94 115.87 1gfs h PHE 51 Ca 0.08 0.00 -0.20 0.00 2.80 0.00 0.00 57.97 60.65 1gfs h PHE 51 Cb 0.14 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.30 1gfs h PHE 51 CO -0.02 0.29 -0.77 0.00 -0.60 0.00 0.00 178.31 177.21 1gfs h ALA 52 N 1.71 0.15 -0.08 2.45 0.00 -0.86 -3.35 119.26 119.27 1gfs h ALA 52 Ca -0.00 -0.61 -0.15 0.00 0.00 0.00 0.00 54.91 54.15 1gfs h ALA 52 Cb 0.63 0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.45 1gfs h ALA 52 CO 0.04 0.53 -0.54 0.77 0.00 0.00 0.00 179.25 180.05 1gfs h SER 53 N 0.21 0.60 -3.41 0.00 0.02 -0.98 -3.46 113.55 106.54 1gfs h SER 53 Ca -0.09 -0.67 -0.49 0.00 -0.84 0.00 0.00 61.79 59.71 1gfs h SER 53 Cb 1.44 -0.18 0.03 0.00 0.14 0.00 0.00 62.40 63.83 1gfs h SER 53 CO 0.15 1.18 0.06 -1.61 -1.14 0.00 0.00 176.83 175.47 1gfs s GLU 54 N -3.57 3.43 -0.79 3.45 0.41 -0.30 -5.05 118.70 116.29 1gfs s GLU 54 Ca -0.13 0.05 -0.02 0.00 -0.41 0.00 0.00 54.97 54.47 1gfs s GLU 54 Cb 0.05 -2.42 0.20 0.00 -1.78 0.00 0.00 34.13 30.18 1gfs s GLU 54 CO 0.83 -0.21 0.64 -0.98 -0.49 0.00 0.00 175.26 175.05 1gfs s ARG 55 N -4.69 2.98 0.08 1.61 1.70 -1.26 -4.78 118.95 114.58 1gfs s ARG 55 Ca 0.47 -3.03 -0.24 0.00 -0.47 0.00 0.00 55.73 52.46 1gfs s ARG 55 Cb -0.10 -3.84 -0.06 0.00 -0.57 0.00 0.00 34.95 30.37 1gfs s ARG 55 CO 0.43 -1.24 0.73 0.42 -1.08 0.00 0.00 175.30 174.56 1gfs s ILE 56 N -0.92 4.65 -0.17 4.99 -1.09 -1.26 -4.70 121.20 122.70 1gfs s ILE 56 Ca 0.24 1.56 0.08 0.00 -2.23 0.00 0.00 60.65 60.29 1gfs s ILE 56 Cb -0.11 -4.08 -0.16 0.00 -1.58 0.00 0.00 42.46 36.53 1gfs s ILE 56 CO -0.10 0.44 -0.05 0.47 -1.23 0.00 0.00 174.94 174.47 1gfs n ASP 57 N 2.32 1.83 -4.01 3.58 8.00 0.46 -4.67 116.55 124.07 1gfs n ASP 57 Ca -0.05 -0.05 -0.10 0.00 0.71 0.00 0.00 54.79 55.31 1gfs n ASP 57 Cb 0.50 0.32 -0.11 0.00 -0.02 0.00 0.00 41.12 41.81 1gfs n ASP 57 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1gfs s GLN 58 N -2.38 0.38 -0.07 -1.24 -0.21 -1.08 -3.94 119.66 111.12 1gfs s GLN 58 Ca -0.16 -0.69 0.01 0.00 0.02 0.00 0.00 55.36 54.53 1gfs s GLN 58 Cb 0.06 0.05 0.02 0.00 1.00 0.00 0.00 33.01 34.13 1gfs s GLN 58 CO 0.54 -0.04 -0.07 0.08 -2.12 0.00 0.00 175.29 173.68 1gfs s VAL 59 N -1.68 0.81 -0.43 1.09 1.01 -0.77 -1.46 120.40 118.96 1gfs s VAL 59 Ca -0.13 -0.24 -0.10 0.00 0.00 0.00 0.00 61.98 61.51 1gfs s VAL 59 Cb -0.08 -0.81 0.09 0.00 0.00 0.00 0.00 36.38 35.58 1gfs s VAL 59 CO -0.02 0.30 0.28 -0.31 0.00 0.00 0.00 175.10 175.36 1gfs s TYR 60 N 1.10 3.35 -1.13 5.22 1.51 -0.29 0.06 117.35 127.15 1gfs s TYR 60 Ca -0.07 -1.55 -0.18 0.00 -1.01 0.00 0.00 57.07 54.26 1gfs s TYR 60 Cb -0.14 -3.07 0.11 0.00 -0.11 0.00 0.00 41.96 38.75 1gfs s TYR 60 CO -0.01 -0.87 1.45 -1.17 -1.11 0.00 0.00 175.55 173.84 1gfs s LEU 61 N 1.43 4.41 0.00 -1.29 2.96 0.71 -1.60 118.68 125.30 1gfs s LEU 61 Ca 0.04 -2.33 0.17 0.00 -0.22 0.00 0.00 54.13 51.79 1gfs s LEU 61 Cb -0.24 -2.48 0.21 0.00 0.50 0.00 0.00 46.19 44.18 1gfs s LEU 61 CO 0.02 -1.08 1.11 0.00 -1.32 0.00 0.00 176.35 175.08 1gfs n ALA 62 N 7.24 2.43 -2.09 5.97 0.00 -1.14 -2.56 120.51 130.36 1gfs n ALA 62 Ca 0.36 -0.76 -0.40 0.00 0.00 0.00 0.00 53.44 52.64 1gfs n ALA 62 Cb 0.47 -0.59 -0.05 0.00 0.00 0.00 0.00 19.45 19.27 1gfs n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gfs s ALA 63 N -1.32 3.32 0.01 0.00 0.00 -1.00 -4.63 121.76 118.14 1gfs s ALA 63 Ca 0.23 0.52 -0.28 0.00 0.00 0.00 0.00 51.96 52.43 1gfs s ALA 63 Cb 0.15 -3.18 0.10 0.00 0.00 0.00 0.00 23.12 20.19 1gfs s ALA 63 CO 0.22 0.10 0.84 0.00 0.00 0.00 0.00 175.76 176.92 1gfs s ALA 64 N -0.53 -1.80 -0.51 0.00 0.00 -1.26 -4.92 121.76 112.75 1gfs s ALA 64 Ca 0.42 0.99 -0.17 0.00 0.00 0.00 0.00 51.96 53.21 1gfs s ALA 64 Cb -0.24 0.38 0.09 0.00 0.00 0.00 0.00 23.12 23.35 1gfs s ALA 64 CO 0.29 -0.66 0.49 0.21 0.00 0.00 0.00 175.76 176.09 1gfs s LYS 65 N -2.98 3.01 0.27 0.00 2.47 -1.26 -5.05 119.74 116.21 1gfs s LYS 65 Ca 0.03 -1.36 0.10 0.00 -1.56 0.00 0.00 55.97 53.19 1gfs s LYS 65 Cb -0.01 -4.18 -0.05 0.00 -1.46 0.00 0.00 37.83 32.13 1gfs s LYS 65 CO -0.08 -1.19 -0.05 0.14 0.16 0.00 0.00 175.35 174.33 1gfs s VAL 66 N 1.91 3.16 -0.07 4.02 -7.23 -1.26 -4.93 120.40 116.00 1gfs s VAL 66 Ca 0.06 -2.04 -0.30 0.00 -1.81 0.00 0.00 61.98 57.90 1gfs s VAL 66 Cb -0.25 -2.71 0.10 0.00 0.56 0.00 0.00 36.38 34.08 1gfs s VAL 66 CO 0.07 -0.37 1.34 0.61 -0.31 0.00 0.00 175.10 176.44 1gfs n GLY 67 N -0.84 0.13 0.27 2.32 0.00 -1.26 -5.06 105.19 100.76 1gfs n GLY 67 Ca -0.06 -1.02 -0.02 0.00 0.00 0.00 0.00 46.02 44.92 1gfs n GLY 67 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gfs n GLY 68 N -0.97 0.44 0.22 -0.02 0.00 -1.26 -4.79 105.19 98.81 1gfs n GLY 68 Ca 0.06 -1.91 -0.00 0.00 0.00 0.00 0.00 46.02 44.17 1gfs n GLY 68 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1gfs h ILE 69 N -0.51 0.67 -0.04 -0.61 2.04 -1.93 -0.90 117.51 116.24 1gfs h ILE 69 Ca -0.02 -0.09 -0.00 0.00 1.00 0.00 0.00 64.86 65.74 1gfs h ILE 69 Cb 0.09 0.38 -0.00 0.00 -0.74 0.00 0.00 36.82 36.55 1gfs h ILE 69 CO 0.02 0.05 0.01 0.58 0.00 0.00 0.00 178.15 178.81 1gfs h VAL 70 N 0.27 1.21 -0.43 1.67 2.07 -1.94 -2.84 116.25 116.26 1gfs h VAL 70 Ca 0.30 -0.64 0.01 0.00 0.82 0.00 0.00 66.70 67.19 1gfs h VAL 70 Cb 0.42 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 1gfs h VAL 70 CO -0.37 0.17 0.27 0.00 0.02 0.00 0.00 177.57 177.66 1gfs h ALA 71 N 0.76 0.54 -0.07 1.67 0.00 -1.83 0.66 119.26 120.99 1gfs h ALA 71 Ca 0.01 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1gfs h ALA 71 Cb 0.27 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1gfs h ALA 71 CO 0.00 -0.03 -0.11 -0.91 0.00 0.00 0.00 179.25 178.20 1gfs h ASN 72 N 0.55 0.10 0.92 0.00 4.21 -1.19 0.65 115.58 120.82 1gfs h ASN 72 Ca 0.16 -0.01 -0.06 0.00 1.21 0.00 0.00 56.30 57.60 1gfs h ASN 72 Cb -0.04 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.13 1gfs h ASN 72 CO -0.05 0.23 -1.12 0.78 -1.29 0.00 0.00 177.43 175.97 1gfs h ASN 73 N 0.10 0.00 0.27 5.81 2.35 -1.22 -3.29 115.58 119.61 1gfs h ASN 73 Ca 0.02 0.00 -0.34 0.00 -0.55 0.00 0.00 56.30 55.44 1gfs h ASN 73 Cb 0.27 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 1gfs h ASN 73 CO 0.02 0.21 -1.80 0.74 -1.65 0.00 0.00 177.43 174.95 1gfs h THR 74 N 0.00 0.84 -1.89 2.81 2.02 -0.48 -3.40 112.91 112.80 1gfs h THR 74 Ca -0.06 -2.53 -0.57 0.00 0.77 0.00 0.00 66.41 64.01 1gfs h THR 74 Cb 1.22 2.60 -0.42 0.00 -1.74 0.00 0.00 68.15 69.80 1gfs h THR 74 CO 0.02 0.81 -0.74 -1.22 0.37 0.00 0.00 175.52 174.76 1gfs n TYR 75 N -3.42 3.45 -0.29 3.16 4.01 0.19 -4.91 117.16 119.34 1gfs n TYR 75 Ca -0.25 -3.56 0.02 0.00 -0.16 0.00 0.00 57.90 53.95 1gfs n TYR 75 Cb 1.05 -0.31 0.15 0.00 -0.31 0.00 0.00 39.34 39.93 1gfs n TYR 75 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 1gfs h PRO 76 N 2.81 0.80 -0.69 -0.72 0.13 -1.77 -2.56 132.00 130.01 1gfs h PRO 76 Ca 0.19 -0.05 0.01 0.00 -0.87 0.00 0.00 66.00 65.28 1gfs h PRO 76 Cb 0.74 -0.18 -0.03 0.00 0.13 0.00 0.00 31.00 31.65 1gfs h PRO 76 CO 0.80 0.53 0.45 0.00 -0.23 0.00 0.00 178.00 179.55 1gfs h ALA 77 N 1.43 0.87 -0.59 -0.56 0.00 -1.91 -2.02 119.26 116.47 1gfs h ALA 77 Ca 0.38 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 1gfs h ALA 77 Cb 0.29 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1gfs h ALA 77 CO -0.22 0.30 0.14 -0.44 0.00 0.00 0.00 179.25 179.03 1gfs h ASP 78 N 0.93 0.86 -0.35 0.00 3.32 -1.89 -0.95 116.42 118.34 1gfs h ASP 78 Ca 0.25 -0.16 -0.11 0.00 0.02 0.00 0.00 57.03 57.02 1gfs h ASP 78 Cb -0.10 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.21 1gfs h ASP 78 CO -0.05 0.84 -0.22 -0.26 -1.72 0.00 0.00 179.24 177.82 1gfs h PHE 79 N 0.88 0.89 0.01 4.55 -1.00 -1.09 -1.66 116.94 119.51 1gfs h PHE 79 Ca 0.19 -0.24 -0.08 0.00 2.81 0.00 0.00 57.97 60.65 1gfs h PHE 79 Cb 0.32 -0.20 0.01 0.00 3.61 0.00 0.00 35.95 39.69 1gfs h PHE 79 CO 0.02 0.99 -0.31 0.97 -1.61 0.00 0.00 178.31 178.37 1gfs h ILE 80 N 0.54 1.54 0.21 -0.55 2.10 -1.32 -3.14 117.51 116.90 1gfs h ILE 80 Ca 0.07 -2.02 -0.01 0.00 1.08 0.00 0.00 64.86 63.98 1gfs h ILE 80 Cb 0.78 2.81 0.00 0.00 -1.09 0.00 0.00 36.82 39.32 1gfs h ILE 80 CO 0.06 0.56 -0.10 0.22 -1.08 0.00 0.00 178.15 177.81 1gfs h TYR 81 N -0.48 -0.26 -0.78 2.19 3.20 -1.25 -1.29 116.97 118.31 1gfs h TYR 81 Ca -0.04 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.77 1gfs h TYR 81 Cb 1.08 0.08 -0.03 0.00 1.54 0.00 0.00 36.73 39.40 1gfs h TYR 81 CO 0.18 -0.10 0.28 1.96 -1.64 0.00 0.00 178.16 178.84 1gfs h GLN 82 N -0.35 1.18 -0.29 1.82 4.20 -1.46 -0.79 115.11 119.41 1gfs h GLN 82 Ca -0.03 -0.23 -0.13 0.00 0.06 0.00 0.00 58.65 58.32 1gfs h GLN 82 Cb 0.27 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 1gfs h GLN 82 CO 0.05 0.98 -0.36 -0.91 -0.67 0.00 0.00 178.83 177.92 1gfs h ASN 83 N 1.14 0.70 -0.37 1.46 2.35 -1.52 -1.52 115.58 117.81 1gfs h ASN 83 Ca 0.26 -0.30 -0.05 0.00 -0.55 0.00 0.00 56.30 55.66 1gfs h ASN 83 Cb 0.26 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1gfs h ASN 83 CO -0.02 0.99 0.04 0.24 -1.65 0.00 0.00 177.43 177.04 1gfs h MET 84 N 0.56 0.63 -0.20 0.81 2.86 -0.90 -1.95 114.93 116.73 1gfs h MET 84 Ca 0.06 -0.18 -0.02 0.00 -2.06 0.00 0.00 59.70 57.50 1gfs h MET 84 Cb 0.87 -0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.45 1gfs h MET 84 CO 0.08 0.70 0.05 0.52 1.06 0.00 0.00 176.91 179.31 1gfs h MET 85 N 0.46 0.33 -0.36 1.72 2.86 -1.09 -1.70 114.93 117.15 1gfs h MET 85 Ca 0.11 -0.08 0.03 0.00 -2.06 0.00 0.00 59.70 57.70 1gfs h MET 85 Cb 0.39 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.98 1gfs h MET 85 CO 0.01 0.46 0.18 0.82 1.06 0.00 0.00 176.91 179.44 1gfs h ILE 86 N 0.14 0.98 0.39 -1.22 2.04 -1.25 -0.29 117.51 118.31 1gfs h ILE 86 Ca 0.06 -0.13 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 1gfs h ILE 86 Cb 0.28 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.94 1gfs h ILE 86 CO 0.00 0.07 -0.20 -0.33 0.00 0.00 0.00 178.15 177.69 1gfs h GLU 87 N 0.37 -0.52 -0.42 2.37 5.08 -1.31 -2.60 114.58 117.54 1gfs h GLU 87 Ca 0.15 0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.57 1gfs h GLU 87 Cb 0.07 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 1gfs h GLU 87 CO -0.11 -0.35 0.24 0.77 -1.00 0.00 0.00 179.01 178.56 1gfs h SER 88 N -0.54 0.38 0.53 1.42 0.02 -1.19 -1.22 113.55 112.95 1gfs h SER 88 Ca -0.05 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.88 1gfs h SER 88 Cb 0.42 -0.07 0.01 0.00 0.14 0.00 0.00 62.40 62.89 1gfs h SER 88 CO 0.08 0.27 -0.26 0.78 -1.14 0.00 0.00 176.83 176.57 1gfs h ASN 89 N 0.48 -0.61 0.15 3.07 -0.26 -1.06 -1.79 115.58 115.56 1gfs h ASN 89 Ca 0.17 0.01 -0.01 0.00 -0.56 0.00 0.00 56.30 55.91 1gfs h ASN 89 Cb 0.03 0.16 0.00 0.00 -1.06 0.00 0.00 38.32 37.45 1gfs h ASN 89 CO -0.09 -0.41 -0.07 0.40 -1.06 0.00 0.00 177.43 176.20 1gfs h ILE 90 N -0.74 0.93 -0.79 2.81 2.04 -1.46 -0.54 117.51 119.76 1gfs h ILE 90 Ca -0.07 -0.31 0.01 0.00 1.00 0.00 0.00 64.86 65.49 1gfs h ILE 90 Cb 0.56 1.12 -0.04 0.00 -0.74 0.00 0.00 36.82 37.72 1gfs h ILE 90 CO 0.12 0.07 0.52 0.40 0.00 0.00 0.00 178.15 179.26 1gfs h ILE 91 N -0.34 1.20 -0.11 -0.67 2.04 -1.29 0.63 117.51 118.96 1gfs h ILE 91 Ca -0.02 -0.36 -0.11 0.00 1.00 0.00 0.00 64.86 65.36 1gfs h ILE 91 Cb 0.27 0.04 0.00 0.00 -0.74 0.00 0.00 36.82 36.40 1gfs h ILE 91 CO 0.03 0.19 -0.37 -0.74 0.00 0.00 0.00 178.15 177.26 1gfs h HIS 92 N 1.06 0.58 -0.65 1.37 2.76 -1.32 -2.63 115.15 116.32 1gfs h HIS 92 Ca 0.29 -0.24 -0.02 0.00 -2.20 0.00 0.00 60.37 58.20 1gfs h HIS 92 Cb -0.12 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 28.72 1gfs h HIS 92 CO -0.02 0.98 0.33 0.00 -1.30 0.00 0.00 177.93 177.92 1gfs h ALA 93 N 0.49 1.36 -0.08 5.26 0.00 -0.97 -0.56 119.26 124.77 1gfs h ALA 93 Ca -0.02 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1gfs h ALA 93 Cb 1.00 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1gfs h ALA 93 CO 0.08 0.51 0.04 0.00 0.00 0.00 0.00 179.25 179.88 1gfs h ALA 94 N 1.46 0.10 -0.41 0.00 0.00 -0.85 -2.21 119.26 117.35 1gfs h ALA 94 Ca 0.23 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 1gfs h ALA 94 Cb 0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1gfs h ALA 94 CO -0.03 -0.37 0.16 1.25 0.00 0.00 0.00 179.25 180.26 1gfs h HIS 95 N 0.04 0.63 -0.15 0.00 6.17 -1.11 -0.69 115.15 120.05 1gfs h HIS 95 Ca 0.03 -0.05 0.04 0.00 0.71 0.00 0.00 60.37 61.10 1gfs h HIS 95 Cb 0.07 -0.19 -0.01 0.00 2.52 0.00 0.00 27.41 29.80 1gfs h HIS 95 CO -0.05 0.56 0.15 1.96 0.71 0.00 0.00 177.93 181.26 1gfs h GLN 96 N 0.52 0.00 -0.35 5.26 1.08 -0.98 -2.47 115.11 118.16 1gfs h GLN 96 Ca 0.14 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.19 1gfs h GLN 96 Cb 0.20 0.00 -0.09 0.00 -0.05 0.00 0.00 27.48 27.54 1gfs h GLN 96 CO -0.01 0.00 -0.02 0.09 -0.95 0.00 0.00 178.83 177.94 1gfs n ASN 97 N -3.96 2.93 -2.17 1.46 4.13 -0.84 -4.99 115.26 111.81 1gfs n ASN 97 Ca 0.01 -3.55 -0.20 0.00 1.68 0.00 0.00 54.58 52.52 1gfs n ASN 97 Cb 0.27 -0.62 -0.03 0.00 -1.54 0.00 0.00 39.78 37.86 1gfs n ASN 97 CO 0.00 0.00 0.00 0.47 0.28 0.00 0.00 177.26 178.01 1gfs n ASP 98 N -0.96 -5.54 -4.61 6.41 8.00 -0.93 -4.96 116.55 113.96 1gfs n ASP 98 Ca 0.31 0.14 -0.43 0.00 0.71 0.00 0.00 54.79 55.53 1gfs n ASP 98 Cb 1.02 -4.70 -0.03 0.00 -0.02 0.00 0.00 41.12 37.39 1gfs n ASP 98 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1gfs s VAL 99 N -2.90 4.51 -0.18 2.53 1.01 -0.32 -4.89 120.40 120.16 1gfs s VAL 99 Ca 0.00 1.25 0.18 0.00 0.00 0.00 0.00 61.98 63.41 1gfs s VAL 99 Cb 0.00 -4.39 -0.03 0.00 0.00 0.00 0.00 36.38 31.96 1gfs s VAL 99 CO 0.00 -0.62 1.05 -1.13 0.00 0.00 0.00 175.10 174.40 1gfs h ASN 100 N 8.57 0.00 -3.38 3.32 -1.24 -1.87 -3.39 115.58 117.59 1gfs h ASN 100 Ca -0.23 0.00 -0.65 0.00 0.71 0.00 0.00 56.30 56.13 1gfs h ASN 100 Cb 1.07 0.00 -0.21 0.00 0.73 0.00 0.00 38.32 39.92 1gfs h ASN 100 CO 1.01 0.36 -0.67 -0.54 -1.29 0.00 0.00 177.43 176.31 1gfs s LYS 101 N -3.07 3.42 -0.17 6.67 1.02 -1.25 -1.36 119.74 125.00 1gfs s LYS 101 Ca -0.00 -0.52 -0.20 0.00 0.02 0.00 0.00 55.97 55.27 1gfs s LYS 101 Cb 0.08 -2.83 0.05 0.00 -0.52 0.00 0.00 37.83 34.62 1gfs s LYS 101 CO 0.78 0.37 0.54 -1.17 -0.92 0.00 0.00 175.35 174.96 1gfs s LEU 102 N 0.01 -0.08 -0.15 3.17 0.20 -1.05 -1.85 118.68 118.93 1gfs s LEU 102 Ca 0.00 0.95 0.01 0.00 0.69 0.00 0.00 54.13 55.78 1gfs s LEU 102 Cb -0.13 1.91 0.02 0.00 -0.43 0.00 0.00 46.19 47.56 1gfs s LEU 102 CO 0.03 -0.27 -0.16 -0.22 -0.29 0.00 0.00 176.35 175.43 1gfs s LEU 103 N -0.07 1.84 -0.25 -0.68 2.96 0.11 -0.52 118.68 122.07 1gfs s LEU 103 Ca -0.03 -0.54 -0.11 0.00 -0.22 0.00 0.00 54.13 53.24 1gfs s LEU 103 Cb -0.03 -1.28 -0.05 0.00 0.50 0.00 0.00 46.19 45.33 1gfs s LEU 103 CO 0.02 -0.02 0.16 0.12 -1.32 0.00 0.00 176.35 175.31 1gfs s PHE 104 N 1.34 3.30 -0.37 5.38 5.36 0.78 -0.21 117.98 133.57 1gfs s PHE 104 Ca 0.03 0.21 -0.17 0.00 -0.96 0.00 0.00 56.93 56.04 1gfs s PHE 104 Cb -0.13 -2.29 -0.00 0.00 -0.34 0.00 0.00 43.02 40.26 1gfs s PHE 104 CO -0.10 0.03 0.44 -0.51 -1.46 0.00 0.00 175.22 173.62 1gfs s LEU 105 N 1.17 4.50 0.00 6.12 1.02 -1.06 -1.01 118.68 129.42 1gfs s LEU 105 Ca 0.07 -0.26 0.00 0.00 0.02 0.00 0.00 54.13 53.96 1gfs s LEU 105 Cb -0.14 -2.45 0.00 0.00 0.02 0.00 0.00 46.19 43.62 1gfs s LEU 105 CO 0.05 -0.46 0.00 0.61 0.02 0.00 0.00 176.35 176.57 1gfs n GLY 106 N 4.94 1.20 3.73 -3.19 0.00 0.30 -4.91 105.19 107.26 1gfs n GLY 106 Ca -0.07 -0.99 -0.08 0.00 0.00 0.00 0.00 46.02 44.88 1gfs n GLY 106 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gfs s SER 107 N -1.00 -0.29 0.33 1.61 0.15 -1.26 -4.57 113.70 108.67 1gfs s SER 107 Ca 0.00 -0.54 0.23 0.00 0.70 0.00 0.00 55.95 56.34 1gfs s SER 107 Cb 0.00 0.68 0.30 0.00 -1.71 0.00 0.00 66.02 65.29 1gfs s SER 107 CO 0.00 -1.24 1.46 -1.28 1.20 0.00 0.00 173.24 173.38 1gfs h SER 108 N 2.05 0.00 0.32 5.45 0.87 -1.75 -3.32 113.55 117.17 1gfs h SER 108 Ca -0.23 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 1gfs h SER 108 Cb 1.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.22 1gfs h SER 108 CO 0.28 0.01 0.00 0.00 -0.53 0.00 0.00 176.83 176.59 1gfs h ILE 110 N 0.00 0.00 -3.90 0.00 3.07 -1.88 -3.45 117.51 111.34 1gfs h ILE 110 Ca 0.00 -0.17 -0.47 0.00 1.55 0.00 0.00 64.86 65.76 1gfs h ILE 110 Cb 0.16 0.87 -0.01 0.00 -0.27 0.00 0.00 36.82 37.57 1gfs h ILE 110 CO 0.00 0.00 0.22 -0.31 -1.05 0.00 0.00 178.15 177.01 1gfs s TYR 111 N -3.47 3.38 0.49 0.16 2.02 -1.12 -4.58 117.35 114.24 1gfs s TYR 111 Ca 0.01 1.35 -0.22 0.00 -0.37 0.00 0.00 57.07 57.84 1gfs s TYR 111 Cb 0.08 -2.66 -0.08 0.00 -0.40 0.00 0.00 41.96 38.90 1gfs s TYR 111 CO 0.35 -0.08 1.03 -2.30 -1.57 0.00 0.00 175.55 172.98 1gfs n PRO 112 N -0.79 1.27 -0.25 -1.71 -0.02 -1.26 -4.64 135.00 127.59 1gfs n PRO 112 Ca 0.05 0.46 -0.02 0.00 -2.02 0.00 0.00 63.50 61.97 1gfs n PRO 112 Cb 0.54 -2.14 0.10 0.00 -0.02 0.00 0.00 33.50 31.97 1gfs n PRO 112 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1gfs h LYS 113 N 1.22 0.80 -1.01 -0.52 3.64 -1.19 -2.95 116.57 116.56 1gfs h LYS 113 Ca -0.47 -0.05 -0.66 0.00 -1.27 0.00 0.00 60.65 58.20 1gfs h LYS 113 Cb 1.34 -0.18 -0.31 0.00 -0.41 0.00 0.00 32.23 32.67 1gfs h LYS 113 CO 0.55 0.53 0.61 1.28 -2.27 0.00 0.00 179.45 180.15 1gfs n LEU 114 N -4.70 7.25 -4.74 5.20 4.77 -1.26 -5.02 117.00 118.50 1gfs n LEU 114 Ca 0.09 -4.39 -0.31 0.00 -0.03 0.00 0.00 56.01 51.36 1gfs n LEU 114 Cb 0.13 -0.88 0.11 0.00 -2.33 0.00 0.00 43.42 40.45 1gfs n LEU 114 CO 0.31 1.59 0.70 0.00 -1.33 0.00 0.00 177.39 178.67 1gfs s ALA 115 N -3.80 2.03 0.23 -1.18 0.00 -1.12 -4.99 121.76 112.93 1gfs s ALA 115 Ca 0.62 0.43 -0.30 0.00 0.00 0.00 0.00 51.96 52.71 1gfs s ALA 115 Cb 0.49 -3.34 -0.09 0.00 0.00 0.00 0.00 23.12 20.18 1gfs s ALA 115 CO -0.02 -2.03 1.11 0.21 0.00 0.00 0.00 175.76 175.03 1gfs s LYS 116 N -4.70 4.60 -0.11 0.00 2.20 -1.26 -4.99 119.74 115.48 1gfs s LYS 116 Ca 0.64 1.78 -0.02 0.00 -0.36 0.00 0.00 55.97 58.01 1gfs s LYS 116 Cb -0.20 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 32.86 1gfs s LYS 116 CO 0.55 0.12 -0.03 -0.65 -0.36 0.00 0.00 175.35 174.97 1gfs s GLN 117 N -0.86 3.21 0.63 4.03 -1.52 -1.26 -3.06 119.66 120.83 1gfs s GLN 117 Ca 0.47 -0.49 -0.15 0.00 -1.95 0.00 0.00 55.36 53.25 1gfs s GLN 117 Cb -0.31 -2.79 -0.02 0.00 -0.22 0.00 0.00 33.01 29.67 1gfs s GLN 117 CO 0.38 0.50 1.07 -1.25 -0.25 0.00 0.00 175.29 175.74 1gfs s PRO 118 N -0.34 3.11 -0.45 2.91 0.04 -1.26 -5.10 135.00 133.91 1gfs s PRO 118 Ca 0.06 1.21 -0.27 0.00 0.04 0.00 0.00 61.00 62.04 1gfs s PRO 118 Cb -0.12 -2.00 0.03 0.00 0.04 0.00 0.00 34.50 32.44 1gfs s PRO 118 CO 0.02 -0.98 0.99 -1.64 0.04 0.00 0.00 177.00 175.44 1gfs s MET 119 N -4.25 3.64 0.61 4.56 -1.94 -0.31 -4.60 119.30 117.00 1gfs s MET 119 Ca 0.63 0.35 -0.08 0.00 -1.71 0.00 0.00 55.69 54.88 1gfs s MET 119 Cb -0.17 -3.90 -0.01 0.00 2.01 0.00 0.00 34.83 32.76 1gfs s MET 119 CO 0.41 -1.24 0.96 0.00 -0.01 0.00 0.00 175.02 175.15 1gfs s ALA 120 N 3.94 3.16 0.49 3.03 0.00 -1.26 -1.16 121.76 129.96 1gfs s ALA 120 Ca 0.41 -0.42 0.21 0.00 0.00 0.00 0.00 51.96 52.15 1gfs s ALA 120 Cb -0.09 -2.82 1.25 0.00 0.00 0.00 0.00 23.12 21.45 1gfs s ALA 120 CO 0.27 -0.78 1.96 0.93 0.00 0.00 0.00 175.76 178.14 1gfs h GLU 121 N -0.26 0.18 0.00 0.00 3.07 -1.92 -1.18 114.58 114.46 1gfs h GLU 121 Ca -0.45 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.40 1gfs h GLU 121 Cb 1.23 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 29.10 1gfs h GLU 121 CO 0.62 0.12 0.00 -1.13 -1.40 0.00 0.00 179.01 177.22 1gfs n SER 122 N -4.42 0.00 0.01 1.42 3.41 -1.26 -2.23 113.62 110.55 1gfs n SER 122 Ca 0.12 -0.65 0.13 0.00 -0.26 0.00 0.00 58.87 58.21 1gfs n SER 122 Cb 0.58 0.00 0.45 0.00 -0.26 0.00 0.00 64.21 64.98 1gfs n SER 122 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1gfs n GLU 123 N -0.94 0.04 -1.72 4.33 4.07 -0.45 -4.81 120.64 121.16 1gfs n GLU 123 Ca 0.12 0.02 -0.42 0.00 -0.06 0.00 0.00 57.16 56.82 1gfs n GLU 123 Cb 0.06 -1.54 -0.02 0.00 -0.06 0.00 0.00 31.44 29.87 1gfs n GLU 123 CO 0.00 0.00 0.00 -0.11 -0.06 0.00 0.00 177.13 176.96 1gfs n LEU 124 N -1.61 4.05 -1.03 4.31 7.94 -0.95 -2.22 117.00 127.49 1gfs n LEU 124 Ca 0.06 1.10 -0.13 0.00 -1.11 0.00 0.00 56.01 55.93 1gfs n LEU 124 Cb 0.35 -1.57 -0.06 0.00 0.53 0.00 0.00 43.42 42.68 1gfs n LEU 124 CO 0.31 0.11 -0.13 0.18 -1.11 0.00 0.00 177.39 176.75 1gfs n LEU 125 N 3.11 -0.82 -0.47 -1.96 4.77 -1.26 -4.89 117.00 115.47 1gfs n LEU 125 Ca 0.13 0.33 0.12 0.00 -0.03 0.00 0.00 56.01 56.57 1gfs n LEU 125 Cb 0.35 -2.35 0.49 0.00 -2.33 0.00 0.00 43.42 39.58 1gfs n LEU 125 CO 0.64 -0.86 0.84 0.00 -1.33 0.00 0.00 177.39 176.68 1gfs n GLN 126 N -1.97 1.63 -3.89 3.23 1.13 -0.94 -4.97 117.38 111.60 1gfs n GLN 126 Ca -0.13 -0.93 0.05 0.00 -1.94 0.00 0.00 57.00 54.04 1gfs n GLN 126 Cb 0.52 -1.44 0.01 0.00 0.11 0.00 0.00 30.24 29.44 1gfs n GLN 126 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1gfs s GLY 127 N -1.80 -0.31 0.45 1.08 0.00 -1.26 -5.03 107.32 100.44 1gfs s GLY 127 Ca 0.36 0.43 -0.24 0.00 0.00 0.00 0.00 44.72 45.27 1gfs s GLY 127 CO 0.30 4.86 1.22 -0.51 0.00 0.00 0.00 173.10 178.97 1gfs s THR 128 N -2.00 2.88 0.57 0.90 -4.23 -1.26 -4.53 115.64 107.97 1gfs s THR 128 Ca 0.27 0.70 -0.10 0.00 -1.18 0.00 0.00 61.69 61.38 1gfs s THR 128 Cb 0.03 -3.37 -0.04 0.00 1.34 0.00 0.00 72.50 70.45 1gfs s THR 128 CO -0.04 0.02 0.95 -0.76 -0.54 0.00 0.00 174.62 174.25 1gfs s LEU 129 N -2.90 3.39 -0.03 4.79 1.43 -1.26 -0.69 118.68 123.40 1gfs s LEU 129 Ca 0.62 1.27 -0.30 0.00 -1.03 0.00 0.00 54.13 54.70 1gfs s LEU 129 Cb -0.32 -4.28 -0.06 0.00 0.03 0.00 0.00 46.19 41.55 1gfs s LEU 129 CO 0.40 -0.75 1.64 -0.70 0.23 0.00 0.00 176.35 177.17 1gfs s GLU 130 N -4.95 4.19 0.26 1.70 2.56 -1.26 -4.72 118.70 116.48 1gfs s GLU 130 Ca 0.53 2.21 -0.02 0.00 0.00 0.00 0.00 54.97 57.69 1gfs s GLU 130 Cb -0.11 -3.89 0.57 0.00 2.00 0.00 0.00 34.13 32.70 1gfs s GLU 130 CO 0.49 -0.81 1.66 -1.35 -0.56 0.00 0.00 175.26 174.70 1gfs h PRO 131 N 9.23 0.21 -0.90 4.30 0.11 -2.00 -1.06 132.00 141.89 1gfs h PRO 131 Ca -0.40 -0.01 0.13 0.00 0.11 0.00 0.00 66.00 65.82 1gfs h PRO 131 Cb 1.18 -0.05 -0.09 0.00 0.11 0.00 0.00 31.00 32.16 1gfs h PRO 131 CO 0.95 0.14 0.52 1.15 -0.21 0.00 0.00 178.00 180.54 1gfs h THR 132 N 0.22 0.84 -0.10 -1.15 2.02 -1.95 -2.57 112.91 110.21 1gfs h THR 132 Ca 0.48 -0.27 0.00 0.00 0.77 0.00 0.00 66.41 67.39 1gfs h THR 132 Cb 0.89 -0.02 0.00 0.00 -1.74 0.00 0.00 68.15 67.28 1gfs h THR 132 CO -0.60 0.14 0.00 0.59 0.37 0.00 0.00 175.52 176.02 1gfs n ASN 133 N -4.75 2.89 -0.15 4.18 3.02 -0.63 -4.40 115.26 115.42 1gfs n ASN 133 Ca 0.17 -1.94 -0.07 0.00 -0.03 0.00 0.00 54.58 52.71 1gfs n ASN 133 Cb 0.37 -0.05 -0.02 0.00 -0.61 0.00 0.00 39.78 39.48 1gfs n ASN 133 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1gfs h GLU 134 N 4.34 -0.23 -0.30 3.52 4.81 -0.80 0.12 114.58 126.04 1gfs h GLU 134 Ca 0.00 0.02 0.01 0.00 -0.13 0.00 0.00 59.36 59.25 1gfs h GLU 134 Cb 0.93 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.34 1gfs h GLU 134 CO 0.00 -0.15 0.19 -1.35 -0.73 0.00 0.00 179.01 176.96 1gfs h PRO 135 N -0.24 0.37 -0.50 0.92 0.11 -1.84 -1.13 132.00 129.69 1gfs h PRO 135 Ca 0.18 -0.02 -0.02 0.00 0.11 0.00 0.00 66.00 66.26 1gfs h PRO 135 Cb 0.55 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 1gfs h PRO 135 CO -0.59 0.24 0.25 -0.92 -0.21 0.00 0.00 178.00 176.77 1gfs h TYR 136 N 0.38 0.71 -0.82 0.65 3.20 -1.74 -2.64 116.97 116.71 1gfs h TYR 136 Ca 0.11 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 1gfs h TYR 136 Cb -0.02 -0.22 -0.04 0.00 1.54 0.00 0.00 36.73 37.99 1gfs h TYR 136 CO -0.07 0.55 0.49 0.00 -1.64 0.00 0.00 178.16 177.49 1gfs h ALA 137 N 1.09 1.05 -0.79 1.82 0.00 -0.52 -1.61 119.26 120.31 1gfs h ALA 137 Ca 0.17 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1gfs h ALA 137 Cb 0.10 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1gfs h ALA 137 CO -0.02 0.51 0.31 0.82 0.00 0.00 0.00 179.25 180.87 1gfs h ILE 138 N 1.13 1.26 -0.56 0.00 1.08 -1.05 -0.99 117.51 118.38 1gfs h ILE 138 Ca 0.29 -0.83 -0.04 0.00 -0.39 0.00 0.00 64.86 63.90 1gfs h ILE 138 Cb -0.04 0.33 -0.02 0.00 -3.07 0.00 0.00 36.82 34.02 1gfs h ILE 138 CO -0.05 0.34 0.21 0.00 -0.69 0.00 0.00 178.15 177.95 1gfs h ALA 139 N 1.16 0.73 -0.44 1.87 0.00 -1.08 -1.43 119.26 120.07 1gfs h ALA 139 Ca 0.26 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1gfs h ALA 139 Cb 0.22 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1gfs h ALA 139 CO -0.02 0.36 0.12 0.87 0.00 0.00 0.00 179.25 180.58 1gfs h LYS 140 N 0.77 0.70 -0.68 0.00 1.79 -0.93 -1.49 116.57 116.74 1gfs h LYS 140 Ca 0.19 -0.16 -0.02 0.00 -2.18 0.00 0.00 60.65 58.47 1gfs h LYS 140 Cb 0.22 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.74 1gfs h LYS 140 CO -0.01 0.70 0.34 0.82 -1.08 0.00 0.00 179.45 180.21 1gfs h ILE 141 N 0.58 1.22 -0.34 1.86 2.04 -1.08 -1.65 117.51 120.15 1gfs h ILE 141 Ca 0.14 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 1gfs h ILE 141 Cb 0.30 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1gfs h ILE 141 CO -0.00 0.26 0.18 0.00 0.00 0.00 0.00 178.15 178.59 1gfs h ALA 142 N 1.16 1.68 -0.51 1.87 0.00 -0.94 -1.13 119.26 121.39 1gfs h ALA 142 Ca 0.23 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.04 1gfs h ALA 142 Cb 0.10 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1gfs h ALA 142 CO -0.03 0.27 0.15 0.78 0.00 0.00 0.00 179.25 180.42 1gfs h GLY 143 N 0.55 0.85 0.97 0.00 0.00 -0.37 -1.12 103.07 103.96 1gfs h GLY 143 Ca 0.12 -0.51 -0.05 0.00 0.00 0.00 0.00 47.33 46.89 1gfs h GLY 143 CO -0.02 0.48 0.10 -2.22 0.00 0.00 0.00 176.54 174.88 1gfs h ILE 144 N 0.69 1.24 0.00 2.60 2.04 -0.64 -2.64 117.51 120.81 1gfs h ILE 144 Ca 0.16 -0.87 -0.06 0.00 1.00 0.00 0.00 64.86 65.09 1gfs h ILE 144 Cb 0.28 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 1gfs h ILE 144 CO -0.00 0.31 -0.30 0.11 0.00 0.00 0.00 178.15 178.27 1gfs h LYS 145 N 0.66 0.00 -0.11 2.37 1.79 -1.09 -1.87 116.57 118.32 1gfs h LYS 145 Ca 0.15 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.59 1gfs h LYS 145 Cb 0.36 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.00 1gfs h LYS 145 CO 0.01 0.30 -0.03 -0.07 -1.08 0.00 0.00 179.45 178.58 1gfs h LEU 146 N 0.00 0.21 -0.08 2.94 3.38 -1.00 -1.37 115.31 119.39 1gfs h LEU 146 Ca -0.00 -0.37 0.03 0.00 0.09 0.00 0.00 57.88 57.64 1gfs h LEU 146 Cb 0.71 -0.06 -0.04 0.00 0.09 0.00 0.00 40.66 41.36 1gfs h LEU 146 CO 0.04 0.53 -0.15 0.00 0.09 0.00 0.00 178.44 178.95 1gfs h GLU 148 N -0.21 1.32 -0.33 0.00 5.08 -1.35 -0.91 114.58 118.17 1gfs h GLU 148 Ca 0.08 -0.09 -0.10 0.00 -1.00 0.00 0.00 59.36 58.25 1gfs h GLU 148 Cb 0.32 -0.29 -0.02 0.00 0.50 0.00 0.00 28.75 29.26 1gfs h GLU 148 CO -0.20 0.89 -0.20 0.77 -1.00 0.00 0.00 179.01 179.26 1gfs h SER 149 N 1.35 0.63 0.70 1.42 0.02 -0.77 -0.09 113.55 116.81 1gfs h SER 149 Ca 0.36 -0.21 -0.18 0.00 -0.84 0.00 0.00 61.79 60.92 1gfs h SER 149 Cb -0.13 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.22 1gfs h SER 149 CO -0.08 0.84 -0.84 1.88 -1.14 0.00 0.00 176.83 177.49 1gfs h TYR 150 N 0.56 0.14 -0.18 3.45 -1.99 -0.86 -1.26 116.97 116.83 1gfs h TYR 150 Ca 0.09 -0.08 -0.04 0.00 2.00 0.00 0.00 58.73 60.70 1gfs h TYR 150 Cb 0.66 -0.02 -0.01 0.00 2.00 0.00 0.00 36.73 39.37 1gfs h TYR 150 CO 0.03 0.89 -0.05 -0.91 -0.00 0.00 0.00 178.16 178.12 1gfs h ASN 151 N 0.05 0.36 0.35 3.88 -0.26 -0.79 -0.81 115.58 118.36 1gfs h ASN 151 Ca -0.03 -0.37 -0.02 0.00 -0.56 0.00 0.00 56.30 55.33 1gfs h ASN 151 Cb 1.46 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 38.63 1gfs h ASN 151 CO 0.12 0.65 -0.17 0.03 -1.06 0.00 0.00 177.43 177.00 1gfs h ARG 152 N 0.07 -0.46 -0.02 0.81 3.08 -1.03 -1.84 114.38 115.00 1gfs h ARG 152 Ca 0.05 0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1gfs h ARG 152 Cb 0.49 0.10 -0.00 0.00 0.08 0.00 0.00 29.97 30.65 1gfs h ARG 152 CO 0.02 -0.17 -0.02 0.37 -1.07 0.00 0.00 179.97 179.10 1gfs h GLN 153 N -0.74 0.04 -0.06 0.04 4.15 -1.32 -3.36 115.11 113.86 1gfs h GLN 153 Ca -0.05 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.35 1gfs h GLN 153 Cb 0.50 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.20 1gfs h GLN 153 CO 0.08 0.54 0.00 0.66 -1.93 0.00 0.00 178.83 178.18 1gfs n TYR 154 N -4.81 0.05 -2.32 3.99 4.01 -0.32 -4.97 117.16 112.79 1gfs n TYR 154 Ca -0.08 -0.03 -0.11 0.00 -0.16 0.00 0.00 57.90 57.53 1gfs n TYR 154 Cb 0.27 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 1gfs n TYR 154 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gfs n GLY 155 N 1.19 -0.02 3.87 2.72 0.00 -0.70 -4.99 105.19 107.27 1gfs n GLY 155 Ca 0.13 -0.42 -0.29 0.00 0.00 0.00 0.00 46.02 45.43 1gfs n GLY 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gfs s ARG 156 N -4.68 1.08 -0.53 1.61 1.81 -1.15 -4.97 118.95 112.13 1gfs s ARG 156 Ca 0.04 -0.08 0.07 0.00 -1.72 0.00 0.00 55.73 54.04 1gfs s ARG 156 Cb -0.02 -1.87 0.30 0.00 -0.45 0.00 0.00 34.95 32.91 1gfs s ARG 156 CO 0.05 -2.17 0.77 -3.47 -0.68 0.00 0.00 175.30 169.81 1gfs n ASP 157 N -3.67 2.93 -4.34 0.23 2.03 -0.46 -4.51 116.55 108.75 1gfs n ASP 157 Ca 0.11 -3.33 -0.45 0.00 0.52 0.00 0.00 54.79 51.64 1gfs n ASP 157 Cb 0.60 -0.62 -0.07 0.00 -0.72 0.00 0.00 41.12 40.31 1gfs n ASP 157 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 1gfs s TYR 158 N -2.58 3.26 0.36 -0.67 2.02 -1.26 -2.52 117.35 115.94 1gfs s TYR 158 Ca 0.42 -1.13 0.02 0.00 -0.37 0.00 0.00 57.07 56.01 1gfs s TYR 158 Cb 0.23 -3.44 -0.02 0.00 -0.40 0.00 0.00 41.96 38.33 1gfs s TYR 158 CO -0.08 -0.90 0.54 1.03 -1.57 0.00 0.00 175.55 174.56 1gfs s ARG 159 N 1.61 3.28 -0.06 -0.62 0.52 0.32 -4.61 118.95 119.37 1gfs s ARG 159 Ca 0.04 -0.59 -0.10 0.00 -0.52 0.00 0.00 55.73 54.55 1gfs s ARG 159 Cb -0.27 -2.70 0.02 0.00 0.52 0.00 0.00 34.95 32.52 1gfs s ARG 159 CO 0.05 0.06 0.26 -1.54 0.02 0.00 0.00 175.30 174.14 1gfs s SER 160 N -4.11 -0.21 -0.03 0.23 1.04 -1.26 -0.15 113.70 109.21 1gfs s SER 160 Ca 0.42 0.31 0.04 0.00 0.48 0.00 0.00 55.95 57.21 1gfs s SER 160 Cb -0.10 0.44 -0.00 0.00 0.10 0.00 0.00 66.02 66.46 1gfs s SER 160 CO 0.34 -0.22 -0.13 0.68 0.98 0.00 0.00 173.24 174.89 1gfs s VAL 161 N -0.45 1.12 -0.38 5.02 -7.23 -0.18 -1.64 120.40 116.67 1gfs s VAL 161 Ca -0.06 -0.56 -0.06 0.00 -1.81 0.00 0.00 61.98 59.50 1gfs s VAL 161 Cb -0.04 -0.96 0.07 0.00 0.56 0.00 0.00 36.38 36.02 1gfs s VAL 161 CO 0.01 0.33 0.16 -0.04 -0.31 0.00 0.00 175.10 175.25 1gfs s MET 162 N -0.01 2.42 0.50 4.82 -1.94 -0.03 -0.54 119.30 124.52 1gfs s MET 162 Ca -0.01 -1.45 -0.18 0.00 -1.71 0.00 0.00 55.69 52.34 1gfs s MET 162 Cb -0.09 -3.54 -0.08 0.00 2.01 0.00 0.00 34.83 33.12 1gfs s MET 162 CO 0.01 -0.86 0.98 -2.14 -0.01 0.00 0.00 175.02 173.00 1gfs s PRO 163 N 1.31 3.98 0.00 2.03 0.02 -1.26 -0.89 135.00 140.20 1gfs s PRO 163 Ca 0.02 1.02 0.00 0.00 0.02 0.00 0.00 61.00 62.06 1gfs s PRO 163 Cb -0.22 -2.14 0.00 0.00 0.02 0.00 0.00 34.50 32.16 1gfs s PRO 163 CO 0.00 -0.24 0.00 -2.37 -0.33 0.00 0.00 177.00 174.06 1gfs n THR 164 N -1.36 0.00 -1.82 0.99 5.66 -0.80 -2.24 114.28 114.71 1gfs n THR 164 Ca 0.07 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.65 1gfs n THR 164 Cb 0.54 -1.81 -0.03 0.00 -1.55 0.00 0.00 70.33 67.48 1gfs n THR 164 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 175.07 172.22 1gfs s ASN 165 N -1.00 6.47 0.27 1.09 0.01 -1.24 -4.76 114.94 115.79 1gfs s ASN 165 Ca 0.00 2.76 0.08 0.00 -0.71 0.00 0.00 52.86 54.99 1gfs s ASN 165 Cb 0.00 -2.60 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 1gfs s ASN 165 CO 0.00 -0.90 0.12 -0.76 -1.51 0.00 0.00 177.10 174.05 1gfs s LEU 166 N 1.12 3.50 0.22 0.60 1.43 -1.26 -0.72 118.68 123.57 1gfs s LEU 166 Ca 0.72 -0.48 -0.22 0.00 -1.03 0.00 0.00 54.13 53.12 1gfs s LEU 166 Cb -0.47 -2.03 0.04 0.00 0.03 0.00 0.00 46.19 43.77 1gfs s LEU 166 CO 0.32 -0.08 0.69 -0.72 0.23 0.00 0.00 176.35 176.79 1gfs s TYR 167 N -2.25 -0.33 -5.00 0.29 1.13 -1.01 -4.90 117.35 105.27 1gfs s TYR 167 Ca 0.33 -0.02 0.00 0.00 -1.41 0.00 0.00 57.07 55.98 1gfs s TYR 167 Cb -0.07 0.64 0.00 0.00 -1.10 0.00 0.00 41.96 41.44 1gfs s TYR 167 CO 0.23 -1.05 0.00 0.41 -2.51 0.00 0.00 175.55 172.63 1gfs n GLY 168 N -0.42 0.93 3.75 5.49 0.00 -1.26 -0.32 105.19 113.35 1gfs n GLY 168 Ca -0.09 -1.89 -0.37 0.00 0.00 0.00 0.00 46.02 43.67 1gfs n GLY 168 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1gfs s PRO 169 N -2.00 2.91 -0.10 1.61 0.04 -1.26 -3.14 135.00 133.06 1gfs s PRO 169 Ca 0.00 1.97 0.00 0.00 0.04 0.00 0.00 61.00 63.01 1gfs s PRO 169 Cb 0.00 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1gfs s PRO 169 CO 0.00 -1.29 0.00 0.72 0.04 0.00 0.00 177.00 176.47 1gfs n HIS 170 N -1.53 0.00 -1.62 0.56 8.25 -1.26 -4.86 115.22 114.76 1gfs n HIS 170 Ca 0.13 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.30 1gfs n HIS 170 Cb 0.48 -0.58 0.14 0.00 1.12 0.00 0.00 29.99 31.15 1gfs n HIS 170 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1gfs s ASP 171 N -2.20 3.44 -0.79 0.41 -1.08 -1.19 -4.24 116.67 111.02 1gfs s ASP 171 Ca 0.00 0.81 -0.21 0.00 -0.52 0.00 0.00 52.55 52.63 1gfs s ASP 171 Cb 0.00 -1.27 0.09 0.00 -1.46 0.00 0.00 42.92 40.28 1gfs s ASP 171 CO 0.00 -2.58 1.07 0.21 0.52 0.00 0.00 175.17 174.39 1gfs s ASN 172 N -4.23 6.37 0.00 -0.34 2.47 -1.26 -4.85 114.94 113.10 1gfs s ASN 172 Ca 0.65 -1.41 0.28 0.00 0.42 0.00 0.00 52.86 52.80 1gfs s ASN 172 Cb -0.12 -2.43 1.27 0.00 -1.45 0.00 0.00 41.25 38.52 1gfs s ASN 172 CO 0.53 -1.32 1.86 0.49 -3.72 0.00 0.00 177.10 174.94 1gfs n PHE 173 N 7.42 0.01 -1.36 0.43 3.01 -1.26 -4.68 117.46 121.03 1gfs n PHE 173 Ca 0.10 -0.01 -0.36 0.00 1.01 0.00 0.00 57.45 58.20 1gfs n PHE 173 Cb 0.47 0.00 0.09 0.00 -0.01 0.00 0.00 39.48 40.03 1gfs n PHE 173 CO 0.00 0.00 0.00 0.72 1.01 0.00 0.00 176.76 178.49 1gfs n HIS 174 N -0.16 0.77 0.31 1.38 -0.00 -1.26 -4.87 115.22 111.39 1gfs n HIS 174 Ca 0.20 0.40 0.18 0.00 -0.00 0.00 0.00 57.72 58.50 1gfs n HIS 174 Cb 0.28 -2.09 1.01 0.00 -0.00 0.00 0.00 29.99 29.19 1gfs n HIS 174 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1gfs h PRO 175 N -0.25 0.00 0.00 -0.41 0.13 -1.97 -2.50 132.00 127.00 1gfs h PRO 175 Ca -0.47 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.61 1gfs h PRO 175 Cb 1.33 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 1gfs h PRO 175 CO 0.47 0.02 -0.21 0.77 -0.23 0.00 0.00 178.00 178.81 1gfs h SER 176 N 0.00 0.00 -2.90 1.44 0.02 -1.95 -3.45 113.55 106.71 1gfs h SER 176 Ca -0.00 0.00 -0.54 0.00 -0.84 0.00 0.00 61.79 60.41 1gfs h SER 176 Cb 0.07 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.62 1gfs h SER 176 CO 0.00 0.21 0.83 0.21 -1.14 0.00 0.00 176.83 176.95 1gfs s ASN 177 N -6.18 6.80 0.09 3.07 2.47 -0.94 -4.90 114.94 115.35 1gfs s ASN 177 Ca 0.02 2.24 0.25 0.00 0.42 0.00 0.00 52.86 55.80 1gfs s ASN 177 Cb 0.09 -2.57 0.54 0.00 -1.45 0.00 0.00 41.25 37.85 1gfs s ASN 177 CO 0.65 -0.73 1.47 -1.54 -3.72 0.00 0.00 177.10 173.23 1gfs n SER 178 N 4.99 0.60 -4.70 -4.21 3.41 -1.26 -4.54 113.62 107.91 1gfs n SER 178 Ca 0.13 0.15 -0.42 0.00 -0.26 0.00 0.00 58.87 58.47 1gfs n SER 178 Cb 0.43 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.32 1gfs n SER 178 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 1gfs s HIS 179 N -3.10 2.44 0.23 7.33 3.76 -1.26 -4.90 115.29 119.78 1gfs s HIS 179 Ca 0.09 0.21 -0.08 0.00 -0.15 0.00 0.00 55.06 55.12 1gfs s HIS 179 Cb 0.15 -4.08 0.37 0.00 1.11 0.00 0.00 32.58 30.13 1gfs s HIS 179 CO 0.68 -4.32 1.66 -0.24 -0.85 0.00 0.00 174.74 171.67 1gfs h VAL 180 N 4.52 0.47 0.71 -0.90 3.04 -1.98 -1.93 116.25 120.18 1gfs h VAL 180 Ca -0.44 -0.05 -0.03 0.00 -1.01 0.00 0.00 66.70 65.16 1gfs h VAL 180 Cb 1.21 0.30 0.01 0.00 -2.01 0.00 0.00 31.29 30.79 1gfs h VAL 180 CO 0.94 0.03 -0.34 0.40 -1.01 0.00 0.00 177.57 177.59 1gfs h ILE 181 N 0.16 0.21 -0.16 3.17 2.04 -1.94 0.54 117.51 121.53 1gfs h ILE 181 Ca 0.37 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 66.01 1gfs h ILE 181 Cb 0.61 0.26 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1gfs h ILE 181 CO -0.55 0.02 -0.09 1.55 0.00 0.00 0.00 178.15 179.08 1gfs h PRO 182 N -1.09 0.24 -0.20 2.37 0.13 -1.89 0.42 132.00 131.97 1gfs h PRO 182 Ca -0.10 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.95 1gfs h PRO 182 Cb 0.76 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 1gfs h PRO 182 CO 0.16 0.34 -0.02 0.00 -0.23 0.00 0.00 178.00 178.25 1gfs h ALA 183 N 1.69 0.28 -0.20 -0.56 0.00 -1.29 -2.54 119.26 116.63 1gfs h ALA 183 Ca 0.05 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.57 1gfs h ALA 183 Cb 0.31 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1gfs h ALA 183 CO 0.02 0.02 -0.54 -0.07 0.00 0.00 0.00 179.25 178.68 1gfs h LEU 184 N 0.12 0.66 -0.87 0.00 3.38 -0.60 -1.98 115.31 116.00 1gfs h LEU 184 Ca 0.06 -0.35 0.02 0.00 0.09 0.00 0.00 57.88 57.70 1gfs h LEU 184 Cb 0.44 -0.19 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 1gfs h LEU 184 CO 0.01 1.07 0.57 -0.07 0.09 0.00 0.00 178.44 180.12 1gfs h LEU 185 N 0.46 0.98 -0.14 1.67 3.38 -0.91 -0.35 115.31 120.40 1gfs h LEU 185 Ca 0.01 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1gfs h LEU 185 Cb 1.09 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.60 1gfs h LEU 185 CO 0.10 0.70 -0.01 -0.09 0.09 0.00 0.00 178.44 179.23 1gfs h ARG 186 N 1.16 0.25 -0.49 1.13 9.65 -1.38 -2.09 114.38 122.61 1gfs h ARG 186 Ca 0.33 -0.09 -0.05 0.00 -1.10 0.00 0.00 59.98 59.07 1gfs h ARG 186 Cb -0.09 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.45 1gfs h ARG 186 CO -0.09 0.51 0.10 0.00 2.80 0.00 0.00 179.97 183.30 1gfs h ARG 187 N -0.03 0.79 -0.10 0.20 3.08 -1.11 -2.22 114.38 114.99 1gfs h ARG 187 Ca 0.04 -0.20 -0.10 0.00 0.07 0.00 0.00 59.98 59.79 1gfs h ARG 187 Cb 0.41 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 1gfs h ARG 187 CO 0.01 0.78 -0.37 0.74 -1.07 0.00 0.00 179.97 180.06 1gfs h PHE 188 N 0.67 0.24 -0.02 3.04 0.04 -1.10 -0.62 116.94 119.20 1gfs h PHE 188 Ca 0.15 -0.06 -0.00 0.00 2.80 0.00 0.00 57.97 60.86 1gfs h PHE 188 Cb 0.35 -0.06 -0.00 0.00 2.20 0.00 0.00 35.95 38.45 1gfs h PHE 188 CO 0.02 0.55 0.00 1.25 -0.60 0.00 0.00 178.31 179.54 1gfs h HIS 189 N 0.18 0.03 -0.32 -0.55 2.76 -1.18 -0.99 115.15 115.08 1gfs h HIS 189 Ca 0.02 -0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.04 1gfs h HIS 189 Cb 0.74 -0.01 -0.01 0.00 1.55 0.00 0.00 27.41 29.68 1gfs h HIS 189 CO 0.01 0.23 -0.38 0.93 -1.30 0.00 0.00 177.93 177.42 1gfs h GLU 190 N -0.18 0.76 -0.49 5.26 5.08 -1.31 -1.06 114.58 122.62 1gfs h GLU 190 Ca 0.01 -0.38 -0.05 0.00 -1.00 0.00 0.00 59.36 57.93 1gfs h GLU 190 Cb 0.21 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1gfs h GLU 190 CO -0.00 1.01 0.11 0.00 -1.00 0.00 0.00 179.01 179.13 1gfs h ALA 191 N 0.95 1.27 -0.21 3.43 0.00 -1.07 0.19 119.26 123.82 1gfs h ALA 191 Ca 0.05 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1gfs h ALA 191 Cb 0.93 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.51 1gfs h ALA 191 CO 0.08 0.51 -0.23 1.15 0.00 0.00 0.00 179.25 180.76 1gfs h THR 192 N 0.73 1.33 -0.62 0.00 2.02 -0.97 0.32 112.91 115.71 1gfs h THR 192 Ca 0.16 -1.40 -0.07 0.00 0.77 0.00 0.00 66.41 65.87 1gfs h THR 192 Cb 0.28 1.74 -0.03 0.00 -1.74 0.00 0.00 68.15 68.41 1gfs h THR 192 CO -0.00 0.43 0.10 0.00 0.37 0.00 0.00 175.52 176.42 1gfs h ALA 193 N 0.65 1.00 -0.01 6.16 0.00 -0.84 -2.55 119.26 123.67 1gfs h ALA 193 Ca 0.03 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1gfs h ALA 193 Cb 0.78 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1gfs h ALA 193 CO 0.06 0.63 -0.05 1.04 0.00 0.00 0.00 179.25 180.93 1gfs n GLN 194 N -4.22 1.42 -3.54 0.00 6.02 0.62 -4.95 117.38 112.73 1gfs n GLN 194 Ca 0.04 -0.76 -0.26 0.00 -0.01 0.00 0.00 57.00 56.01 1gfs n GLN 194 Cb 0.28 -1.48 0.03 0.00 1.02 0.00 0.00 30.24 30.09 1gfs n GLN 194 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 1gfs n ASN 195 N -0.13 -5.28 -4.75 1.08 4.05 -0.26 -4.93 115.26 105.04 1gfs n ASN 195 Ca 0.18 -0.54 -0.41 0.00 0.45 0.00 0.00 54.58 54.26 1gfs n ASN 195 Cb 0.33 -4.23 -0.02 0.00 1.23 0.00 0.00 39.78 37.08 1gfs n ASN 195 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1gfs s ALA 196 N -3.21 3.67 0.36 5.20 0.00 -0.06 -4.93 121.76 122.79 1gfs s ALA 196 Ca 0.52 1.42 0.04 0.00 0.00 0.00 0.00 51.96 53.93 1gfs s ALA 196 Cb -0.25 -3.59 0.68 0.00 0.00 0.00 0.00 23.12 19.96 1gfs s ALA 196 CO 0.64 -0.83 1.99 -1.00 0.00 0.00 0.00 175.76 176.56 1gfs h PRO 197 N 4.94 0.79 -3.65 0.00 0.13 -1.91 -3.41 132.00 128.89 1gfs h PRO 197 Ca -0.46 -0.05 -0.07 0.00 -0.87 0.00 0.00 66.00 64.55 1gfs h PRO 197 Cb 1.22 -0.18 -0.11 0.00 0.13 0.00 0.00 31.00 32.07 1gfs h PRO 197 CO 0.78 0.52 -0.15 0.16 -0.23 0.00 0.00 178.00 179.08 1gfs s ASP 198 N -6.37 -0.09 -0.13 1.44 1.47 -1.26 -0.94 116.67 110.79 1gfs s ASP 198 Ca -0.10 -0.80 -0.01 0.00 1.18 0.00 0.00 52.55 52.82 1gfs s ASP 198 Cb 0.18 0.53 0.04 0.00 -0.34 0.00 0.00 42.92 43.33 1gfs s ASP 198 CO 0.77 -1.03 -0.03 -0.69 0.68 0.00 0.00 175.17 174.87 1gfs s VAL 199 N -3.96 0.81 -0.19 2.11 1.01 -0.18 -4.90 120.40 115.10 1gfs s VAL 199 Ca 0.17 -0.34 -0.15 0.00 0.00 0.00 0.00 61.98 61.66 1gfs s VAL 199 Cb 0.01 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.35 1gfs s VAL 199 CO 0.03 0.17 0.37 -0.69 0.00 0.00 0.00 175.10 174.99 1gfs s VAL 200 N 1.77 5.22 -0.10 2.92 1.01 -1.26 -0.86 120.40 129.11 1gfs s VAL 200 Ca 0.03 0.68 0.01 0.00 0.00 0.00 0.00 61.98 62.70 1gfs s VAL 200 Cb -0.14 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.51 1gfs s VAL 200 CO -0.07 0.29 -0.14 -0.69 0.00 0.00 0.00 175.10 174.48 1gfs s VAL 201 N 1.09 3.02 0.36 2.92 1.01 0.90 -4.97 120.40 124.72 1gfs s VAL 201 Ca 0.19 -0.70 -0.27 0.00 0.00 0.00 0.00 61.98 61.19 1gfs s VAL 201 Cb -0.14 -2.23 -0.09 0.00 0.00 0.00 0.00 36.38 33.91 1gfs s VAL 201 CO 0.07 0.55 1.22 0.26 0.00 0.00 0.00 175.10 177.21 1gfs s TRP 202 N -0.05 3.11 0.00 5.22 0.23 -1.26 -0.83 118.94 125.35 1gfs s TRP 202 Ca -0.03 1.51 0.00 0.00 -2.03 0.00 0.00 56.10 55.55 1gfs s TRP 202 Cb -0.14 -3.51 0.00 0.00 0.03 0.00 0.00 33.47 29.85 1gfs s TRP 202 CO 0.04 -1.49 0.00 0.41 0.96 0.00 0.00 176.95 176.87 1gfs n GLY 203 N 0.79 -3.23 0.04 0.98 0.00 0.16 -4.75 105.19 99.18 1gfs n GLY 203 Ca 0.02 -2.15 0.11 0.00 0.00 0.00 0.00 46.02 44.00 1gfs n GLY 203 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1gfs n SER 204 N 0.00 0.60 0.00 1.61 3.41 -1.26 -2.67 113.62 115.31 1gfs n SER 204 Ca 0.00 -0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.48 1gfs n SER 204 Cb 0.00 0.80 0.00 0.00 -0.26 0.00 0.00 64.21 64.75 1gfs n SER 204 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gfs n GLY 205 N 1.34 1.45 0.12 5.00 0.00 -1.26 -4.91 105.19 106.93 1gfs n GLY 205 Ca 0.01 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 1gfs n GLY 205 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1gfs h THR 206 N 0.00 1.20 -4.02 2.61 1.35 -1.96 -0.78 112.91 111.31 1gfs h THR 206 Ca 0.00 -2.57 -0.55 0.00 -0.55 0.00 0.00 66.41 62.74 1gfs h THR 206 Cb 0.00 2.51 0.13 0.00 -1.73 0.00 0.00 68.15 69.06 1gfs h THR 206 CO 0.00 0.66 0.65 -2.16 -0.25 0.00 0.00 175.52 174.42 1gfs s PRO 207 N -2.97 3.45 -0.15 4.72 0.04 -1.26 -4.68 135.00 134.14 1gfs s PRO 207 Ca 0.02 2.32 -0.07 0.00 0.04 0.00 0.00 61.00 63.31 1gfs s PRO 207 Cb 0.09 -2.47 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 1gfs s PRO 207 CO 0.77 -0.97 0.10 -1.64 0.04 0.00 0.00 177.00 175.29 1gfs s MET 208 N -2.66 3.67 0.17 4.56 -1.94 0.13 -1.68 119.30 121.55 1gfs s MET 208 Ca 0.66 -0.24 0.03 0.00 -1.71 0.00 0.00 55.69 54.43 1gfs s MET 208 Cb -0.42 -3.19 -0.05 0.00 2.01 0.00 0.00 34.83 33.19 1gfs s MET 208 CO 0.52 0.54 -0.04 1.03 -0.01 0.00 0.00 175.02 177.06 1gfs s ARG 209 N -0.37 1.12 -0.04 2.03 1.81 -0.38 -1.72 118.95 121.40 1gfs s ARG 209 Ca 0.10 -1.52 0.06 0.00 -1.72 0.00 0.00 55.73 52.65 1gfs s ARG 209 Cb -0.12 -0.45 -0.02 0.00 -0.45 0.00 0.00 34.95 33.91 1gfs s ARG 209 CO 0.01 -0.05 -0.22 -2.00 -0.68 0.00 0.00 175.30 172.37 1gfs s GLU 210 N -3.84 2.37 0.01 3.54 2.12 -1.20 -1.74 118.70 119.96 1gfs s GLU 210 Ca 0.21 -0.84 0.03 0.00 0.36 0.00 0.00 54.97 54.73 1gfs s GLU 210 Cb 0.05 -2.19 -0.01 0.00 0.26 0.00 0.00 34.13 32.23 1gfs s GLU 210 CO 0.03 0.53 -0.10 -0.06 -0.54 0.00 0.00 175.26 175.13 1gfs s PHE 211 N -0.52 0.85 -0.04 5.30 0.08 -1.26 -3.59 117.98 118.80 1gfs s PHE 211 Ca 0.07 -0.24 0.02 0.00 0.12 0.00 0.00 56.93 56.90 1gfs s PHE 211 Cb -0.11 -0.53 0.01 0.00 -0.57 0.00 0.00 43.02 41.82 1gfs s PHE 211 CO 0.01 -0.01 -0.08 -1.17 -0.10 0.00 0.00 175.22 173.86 1gfs s LEU 212 N -0.61 1.65 0.32 -0.37 2.96 0.10 -4.67 118.68 118.07 1gfs s LEU 212 Ca 0.01 -0.18 -0.29 0.00 -0.22 0.00 0.00 54.13 53.45 1gfs s LEU 212 Cb -0.05 -0.55 -0.10 0.00 0.50 0.00 0.00 46.19 45.99 1gfs s LEU 212 CO 0.00 0.03 1.18 -2.28 -1.32 0.00 0.00 176.35 173.96 1gfs s HIS 213 N 0.44 3.32 0.60 5.38 5.65 -1.26 -2.41 115.29 127.00 1gfs s HIS 213 Ca -0.07 1.58 0.30 0.00 0.25 0.00 0.00 55.06 57.12 1gfs s HIS 213 Cb -0.11 -3.43 1.75 0.00 -1.18 0.00 0.00 32.58 29.61 1gfs s HIS 213 CO 0.01 -1.11 2.16 -0.24 -0.65 0.00 0.00 174.74 174.91 1gfs h VAL 214 N 2.96 0.45 -0.00 0.89 3.04 -1.05 -1.03 116.25 121.50 1gfs h VAL 214 Ca -0.48 0.00 -0.20 0.00 -1.01 0.00 0.00 66.70 65.02 1gfs h VAL 214 Cb 1.22 0.89 -0.01 0.00 -2.01 0.00 0.00 31.29 31.38 1gfs h VAL 214 CO 0.66 0.00 -0.86 0.44 -1.01 0.00 0.00 177.57 176.79 1gfs h ASP 215 N 0.00 0.27 -0.12 3.17 3.32 -1.91 -0.63 116.42 120.51 1gfs h ASP 215 Ca 0.05 -0.21 -0.15 0.00 0.02 0.00 0.00 57.03 56.74 1gfs h ASP 215 Cb 0.31 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1gfs h ASP 215 CO -0.00 1.01 -0.45 0.44 -1.72 0.00 0.00 179.24 178.52 1gfs h ASP 216 N 0.12 0.73 0.15 6.45 3.32 -1.60 -1.93 116.42 123.65 1gfs h ASP 216 Ca -0.04 -0.35 0.00 0.00 0.02 0.00 0.00 57.03 56.66 1gfs h ASP 216 Cb 1.48 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.82 1gfs h ASP 216 CO 0.13 1.07 -0.12 -0.03 -1.72 0.00 0.00 179.24 178.57 1gfs h MET 217 N 0.54 -0.27 -0.88 3.56 4.05 -1.05 -1.07 114.93 119.82 1gfs h MET 217 Ca 0.04 0.02 0.08 0.00 -0.28 0.00 0.00 59.70 59.55 1gfs h MET 217 Cb 0.99 0.06 -0.07 0.00 -0.80 0.00 0.00 31.60 31.78 1gfs h MET 217 CO 0.09 -0.18 0.54 0.00 0.23 0.00 0.00 176.91 177.59 1gfs h ALA 218 N 0.56 1.24 -0.35 0.39 0.00 -1.03 -0.47 119.26 119.60 1gfs h ALA 218 Ca -0.00 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 1gfs h ALA 218 Cb 0.25 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1gfs h ALA 218 CO -0.01 0.23 0.12 0.00 0.00 0.00 0.00 179.25 179.59 1gfs h ALA 219 N 1.44 0.46 -0.69 0.00 0.00 -0.96 -1.90 119.26 117.62 1gfs h ALA 219 Ca 0.40 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.11 1gfs h ALA 219 Cb 0.27 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1gfs h ALA 219 CO -0.21 0.09 0.24 0.00 0.00 0.00 0.00 179.25 179.38 1gfs h ALA 220 N 0.96 0.90 -0.10 0.00 0.00 -0.74 -1.62 119.26 118.65 1gfs h ALA 220 Ca 0.11 -0.20 0.02 0.00 0.00 0.00 0.00 54.91 54.85 1gfs h ALA 220 Cb 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1gfs h ALA 220 CO -0.01 0.55 -0.04 0.77 0.00 0.00 0.00 179.25 180.52 1gfs h SER 221 N 0.99 -0.14 -0.32 0.00 0.02 -0.82 -0.01 113.55 113.26 1gfs h SER 221 Ca 0.23 0.04 -0.07 0.00 -0.84 0.00 0.00 61.79 61.14 1gfs h SER 221 Cb 0.26 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 1gfs h SER 221 CO -0.01 -0.06 -0.04 0.40 -1.14 0.00 0.00 176.83 175.98 1gfs h ILE 222 N -0.03 1.24 0.36 3.27 2.04 -1.29 -0.51 117.51 122.60 1gfs h ILE 222 Ca 0.06 -1.01 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 1gfs h ILE 222 Cb 0.11 0.96 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 1gfs h ILE 222 CO -0.12 0.35 -0.18 -0.74 0.00 0.00 0.00 178.15 177.46 1gfs h HIS 223 N 0.65 -0.45 -0.79 1.37 2.76 -0.76 -0.26 115.15 117.67 1gfs h HIS 223 Ca 0.13 -0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.28 1gfs h HIS 223 Cb 0.47 0.15 -0.04 0.00 1.55 0.00 0.00 27.41 29.54 1gfs h HIS 223 CO 0.02 -0.21 0.48 0.28 -1.30 0.00 0.00 177.93 177.20 1gfs h VAL 224 N -0.61 1.22 -0.78 5.26 2.07 -0.92 -1.48 116.25 121.01 1gfs h VAL 224 Ca -0.05 -0.48 0.01 0.00 0.82 0.00 0.00 66.70 67.00 1gfs h VAL 224 Cb 0.45 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.28 1gfs h VAL 224 CO 0.08 0.23 0.52 -0.03 0.02 0.00 0.00 177.57 178.39 1gfs h MET 225 N 1.09 1.02 -0.00 1.57 -1.53 -0.92 -3.01 114.93 113.14 1gfs h MET 225 Ca 0.29 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.48 1gfs h MET 225 Cb -0.05 -0.23 0.00 0.00 -0.55 0.00 0.00 31.60 30.77 1gfs h MET 225 CO -0.05 0.67 -0.14 0.39 0.14 0.00 0.00 176.91 177.92 1gfs n GLU 226 N -4.55 0.72 -1.32 0.39 1.02 -0.12 -4.93 120.64 111.86 1gfs n GLU 226 Ca 0.08 -0.30 -0.35 0.00 -0.02 0.00 0.00 57.16 56.57 1gfs n GLU 226 Cb 0.03 -1.49 0.10 0.00 -0.02 0.00 0.00 31.44 30.06 1gfs n GLU 226 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1gfs n LEU 227 N -0.88 4.47 -4.75 -4.62 7.94 -0.61 -4.92 117.00 113.63 1gfs n LEU 227 Ca 0.14 0.66 -0.41 0.00 -1.11 0.00 0.00 56.01 55.29 1gfs n LEU 227 Cb 0.30 -1.49 -0.03 0.00 0.53 0.00 0.00 43.42 42.73 1gfs n LEU 227 CO 0.24 -1.66 1.01 0.00 -1.11 0.00 0.00 177.39 175.87 1gfs s ALA 228 N -1.87 3.54 0.29 1.96 0.00 -1.26 -4.86 121.76 119.56 1gfs s ALA 228 Ca 0.75 1.21 0.03 0.00 0.00 0.00 0.00 51.96 53.95 1gfs s ALA 228 Cb -0.33 -3.49 0.66 0.00 0.00 0.00 0.00 23.12 19.96 1gfs s ALA 228 CO 0.48 -0.61 1.76 1.25 0.00 0.00 0.00 175.76 178.64 1gfs h HIS 229 N 4.56 0.90 -0.32 0.00 2.76 -1.96 0.36 115.15 121.44 1gfs h HIS 229 Ca -0.47 0.04 -0.07 0.00 -2.20 0.00 0.00 60.37 57.67 1gfs h HIS 229 Cb 1.22 -0.26 -0.02 0.00 1.55 0.00 0.00 27.41 29.91 1gfs h HIS 229 CO 0.59 0.18 -0.09 0.93 -1.30 0.00 0.00 177.93 178.24 1gfs h GLU 230 N 0.66 0.54 -0.31 5.26 3.07 -1.99 -0.41 114.58 121.40 1gfs h GLU 230 Ca 0.53 -0.15 -0.13 0.00 -0.50 0.00 0.00 59.36 59.12 1gfs h GLU 230 Cb 0.83 -0.06 -0.00 0.00 -0.84 0.00 0.00 28.75 28.67 1gfs h GLU 230 CO -0.40 0.63 -0.30 0.28 -1.40 0.00 0.00 179.01 177.82 1gfs h VAL 231 N 0.50 1.29 -0.11 3.13 2.07 -1.35 -2.18 116.25 119.61 1gfs h VAL 231 Ca 0.10 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.13 1gfs h VAL 231 Cb 0.46 1.53 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1gfs h VAL 231 CO 0.02 0.48 0.02 -0.25 0.02 0.00 0.00 177.57 177.86 1gfs h TRP 232 N 0.51 0.19 -0.72 1.57 7.01 -0.90 -2.75 115.95 120.87 1gfs h TRP 232 Ca 0.05 -0.03 0.04 0.00 2.11 0.00 0.00 58.89 61.07 1gfs h TRP 232 Cb 0.88 -0.05 -0.04 0.00 -2.10 0.00 0.00 29.16 27.84 1gfs h TRP 232 CO 0.07 0.38 0.47 -0.07 -2.79 0.00 0.00 178.44 176.50 1gfs h LEU 233 N -0.05 0.72 -1.39 0.65 3.38 -1.11 -1.29 115.31 116.22 1gfs h LEU 233 Ca 0.03 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1gfs h LEU 233 Cb 0.29 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1gfs h LEU 233 CO 0.00 0.49 -0.30 -0.08 0.09 0.00 0.00 178.44 178.64 1gfs h GLU 234 N 0.83 0.00 -0.48 1.13 4.81 -1.24 -3.14 114.58 116.49 1gfs h GLU 234 Ca 0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1gfs h GLU 234 Cb 0.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1gfs h GLU 234 CO -0.09 0.30 0.00 0.09 -0.73 0.00 0.00 179.01 178.58 1gfs n ASN 235 N -3.92 3.73 -3.48 1.04 4.13 -0.53 -4.99 115.26 111.25 1gfs n ASN 235 Ca -0.02 -2.27 -0.16 0.00 1.68 0.00 0.00 54.58 53.81 1gfs n ASN 235 Cb 0.37 -0.41 -0.07 0.00 -1.54 0.00 0.00 39.78 38.13 1gfs n ASN 235 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1gfs s THR 236 N -1.50 0.00 0.11 3.41 -4.23 -0.97 -5.03 115.64 107.43 1gfs s THR 236 Ca 0.38 -1.83 0.09 0.00 -1.18 0.00 0.00 61.69 59.15 1gfs s THR 236 Cb 0.23 -2.54 -0.04 0.00 1.34 0.00 0.00 72.50 71.50 1gfs s THR 236 CO 0.20 0.00 -0.22 -1.10 -0.54 0.00 0.00 174.62 172.96 1gfs s GLN 237 N -3.44 1.19 0.42 3.99 -0.21 -1.09 -4.85 119.66 115.67 1gfs s GLN 237 Ca 0.36 -1.21 0.14 0.00 0.02 0.00 0.00 55.36 54.67 1gfs s GLN 237 Cb 0.02 -1.50 1.02 0.00 1.00 0.00 0.00 33.01 33.54 1gfs s GLN 237 CO 0.22 0.35 1.93 -1.35 -2.12 0.00 0.00 175.29 174.32 1gfs h PRO 238 N 4.01 0.44 -0.34 2.91 0.11 -1.99 -1.78 132.00 135.36 1gfs h PRO 238 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1gfs h PRO 238 Cb 1.18 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1gfs h PRO 238 CO 0.40 0.29 0.00 -1.33 -0.21 0.00 0.00 178.00 177.15 1gfs n MET 239 N -4.48 3.11 -2.87 1.05 2.81 -1.26 -4.50 117.12 110.98 1gfs n MET 239 Ca 0.13 -2.63 -0.12 0.00 -1.81 0.00 0.00 57.70 53.27 1gfs n MET 239 Cb 0.48 -1.70 0.04 0.00 -0.71 0.00 0.00 33.22 31.32 1gfs n MET 239 CO 0.00 0.00 0.00 -0.11 1.51 0.00 0.00 175.97 177.37 1gfs n LEU 240 N 0.03 -1.71 0.01 4.03 7.94 -0.72 -5.01 117.00 121.56 1gfs n LEU 240 Ca 0.19 -3.90 0.11 0.00 -1.11 0.00 0.00 56.01 51.30 1gfs n LEU 240 Cb 0.77 0.83 0.02 0.00 0.53 0.00 0.00 43.42 45.57 1gfs n LEU 240 CO 0.15 2.08 0.06 -1.54 -1.11 0.00 0.00 177.39 177.03 1gfs n SER 241 N 0.95 0.70 -4.78 1.96 3.41 -0.88 -2.65 113.62 112.33 1gfs n SER 241 Ca 0.12 -0.51 -0.32 0.00 -0.26 0.00 0.00 58.87 57.89 1gfs n SER 241 Cb 0.65 0.79 0.05 0.00 -0.26 0.00 0.00 64.21 65.44 1gfs n SER 241 CO 0.00 0.00 0.00 -1.38 -0.16 0.00 0.00 175.04 173.50 1gfs s HIS 242 N -3.09 2.68 -0.12 7.33 -3.43 -1.26 -4.58 115.29 112.82 1gfs s HIS 242 Ca 0.07 1.54 0.01 0.00 -0.80 0.00 0.00 55.06 55.87 1gfs s HIS 242 Cb 0.16 -3.10 0.02 0.00 -1.43 0.00 0.00 32.58 28.23 1gfs s HIS 242 CO 0.81 -1.62 -0.12 0.42 -2.00 0.00 0.00 174.74 172.23 1gfs s ILE 243 N -2.53 1.35 0.26 -5.38 1.01 -0.65 -4.95 121.20 110.31 1gfs s ILE 243 Ca 0.65 -0.52 -0.30 0.00 0.00 0.00 0.00 60.65 60.48 1gfs s ILE 243 Cb -0.19 -1.28 -0.10 0.00 0.01 0.00 0.00 42.46 40.90 1gfs s ILE 243 CO 0.45 0.42 1.38 0.20 0.00 0.00 0.00 174.94 177.39 1gfs s ASN 244 N 1.35 6.72 -0.14 3.58 0.01 -1.26 -0.85 114.94 124.36 1gfs s ASN 244 Ca 0.00 2.63 0.01 0.00 -0.71 0.00 0.00 52.86 54.79 1gfs s ASN 244 Cb -0.14 -2.63 0.02 0.00 0.41 0.00 0.00 41.25 38.92 1gfs s ASN 244 CO -0.06 -0.63 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.06 1gfs s VAL 245 N -0.30 1.62 0.00 1.60 1.01 -0.07 -4.52 120.40 119.74 1gfs s VAL 245 Ca 0.56 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1gfs s VAL 245 Cb -0.40 -1.50 0.00 0.00 0.00 0.00 0.00 36.38 34.47 1gfs s VAL 245 CO 0.45 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.63 1gfs n GLY 246 N 4.62 1.00 0.07 4.51 0.00 -1.26 -1.91 105.19 112.22 1gfs n GLY 246 Ca -0.18 -0.75 -0.03 0.00 0.00 0.00 0.00 46.02 45.06 1gfs n GLY 246 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gfs n THR 247 N 0.00 0.94 -0.95 2.61 -2.24 -1.26 -4.74 114.28 108.64 1gfs n THR 247 Ca 0.00 -0.74 0.00 0.00 -2.27 0.00 0.00 64.05 61.04 1gfs n THR 247 Cb 0.00 -0.31 0.00 0.00 -2.10 0.00 0.00 70.33 67.92 1gfs n THR 247 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gfs n GLY 248 N 1.59 0.94 3.62 3.38 0.00 -1.26 -4.99 105.19 108.46 1gfs n GLY 248 Ca -0.23 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.44 1gfs n GLY 248 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1gfs s VAL 249 N -3.75 4.56 0.24 1.61 1.01 -1.26 -4.98 120.40 117.83 1gfs s VAL 249 Ca 0.00 -0.12 0.10 0.00 0.00 0.00 0.00 61.98 61.95 1gfs s VAL 249 Cb 0.00 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 1gfs s VAL 249 CO 0.00 0.49 -0.07 1.51 0.00 0.00 0.00 175.10 177.03 1gfs s ASP 250 N 0.16 4.28 -0.01 3.32 1.47 -1.26 -4.47 116.67 120.16 1gfs s ASP 250 Ca 0.03 -0.68 -0.14 0.00 1.18 0.00 0.00 52.55 52.94 1gfs s ASP 250 Cb -0.13 -0.71 0.02 0.00 -0.34 0.00 0.00 42.92 41.76 1gfs s ASP 250 CO 0.01 0.05 0.29 0.00 0.68 0.00 0.00 175.17 176.20 1gfs s THR 252 N -1.36 3.26 0.41 0.00 -4.23 -1.26 -1.24 115.64 111.21 1gfs s THR 252 Ca -0.14 0.50 0.10 0.00 -1.18 0.00 0.00 61.69 60.97 1gfs s THR 252 Cb -0.05 -3.00 0.19 0.00 1.34 0.00 0.00 72.50 70.97 1gfs s THR 252 CO 0.04 -0.45 1.97 0.40 -0.54 0.00 0.00 174.62 176.04 1gfs h ILE 253 N -0.52 1.14 -0.28 2.99 1.08 -0.88 -1.54 117.51 119.50 1gfs h ILE 253 Ca -0.45 -0.59 -0.01 0.00 -0.39 0.00 0.00 64.86 63.41 1gfs h ILE 253 Cb 1.24 1.08 -0.01 0.00 -3.07 0.00 0.00 36.82 36.05 1gfs h ILE 253 CO 0.53 0.19 0.14 -0.09 -0.69 0.00 0.00 178.15 178.22 1gfs h ARG 254 N 0.25 0.41 -0.73 2.37 9.65 -1.45 0.14 114.38 125.02 1gfs h ARG 254 Ca 0.06 -0.06 -0.05 0.00 -1.10 0.00 0.00 59.98 58.82 1gfs h ARG 254 Cb 0.26 -0.07 -0.03 0.00 -1.39 0.00 0.00 29.97 28.73 1gfs h ARG 254 CO 0.01 0.39 0.26 1.49 2.80 0.00 0.00 179.97 184.92 1gfs h GLU 255 N 0.33 1.11 0.12 0.20 4.81 -1.68 -1.06 114.58 118.42 1gfs h GLU 255 Ca 0.10 -0.22 -0.01 0.00 -0.13 0.00 0.00 59.36 59.11 1gfs h GLU 255 Cb 0.12 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.33 1gfs h GLU 255 CO -0.01 0.93 -0.06 1.25 -0.73 0.00 0.00 179.01 180.38 1gfs h LEU 256 N 1.08 -0.14 -0.43 1.64 5.85 -0.91 -1.09 115.31 121.31 1gfs h LEU 256 Ca 0.24 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.86 1gfs h LEU 256 Cb 0.26 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 1gfs h LEU 256 CO -0.01 0.04 0.24 0.00 -0.34 0.00 0.00 178.44 178.36 1gfs h ALA 257 N 0.54 0.54 -0.69 1.25 0.00 -0.57 -0.77 119.26 119.57 1gfs h ALA 257 Ca -0.02 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1gfs h ALA 257 Cb 0.26 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1gfs h ALA 257 CO 0.03 -0.10 0.31 0.37 0.00 0.00 0.00 179.25 179.85 1gfs h GLN 258 N 0.48 0.99 -0.23 0.00 5.75 -1.18 -0.65 115.11 120.26 1gfs h GLN 258 Ca 0.18 -0.15 -0.18 0.00 -0.15 0.00 0.00 58.65 58.35 1gfs h GLN 258 Cb 0.04 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 28.42 1gfs h GLN 258 CO -0.10 0.78 -0.55 1.15 -2.65 0.00 0.00 178.83 177.46 1gfs h THR 259 N 0.98 1.29 -0.49 2.39 2.02 -0.74 -2.52 112.91 115.84 1gfs h THR 259 Ca 0.24 -1.75 -0.01 0.00 0.77 0.00 0.00 66.41 65.65 1gfs h THR 259 Cb 0.14 1.79 -0.02 0.00 -1.74 0.00 0.00 68.15 68.31 1gfs h THR 259 CO -0.03 0.56 0.27 0.40 0.37 0.00 0.00 175.52 177.09 1gfs h ILE 260 N 0.52 1.17 -0.59 3.11 2.04 -0.90 -1.19 117.51 121.67 1gfs h ILE 260 Ca -0.00 -0.43 0.09 0.00 1.00 0.00 0.00 64.86 65.51 1gfs h ILE 260 Cb 1.16 0.56 -0.07 0.00 -0.74 0.00 0.00 36.82 37.74 1gfs h ILE 260 CO 0.12 0.18 0.21 0.00 0.00 0.00 0.00 178.15 178.66 1gfs h ALA 261 N 1.11 0.74 -0.04 1.87 0.00 -1.05 -1.19 119.26 120.70 1gfs h ALA 261 Ca 0.17 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1gfs h ALA 261 Cb 0.05 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.90 1gfs h ALA 261 CO -0.03 -0.21 0.02 -0.22 0.00 0.00 0.00 179.25 178.81 1gfs h LYS 262 N 0.38 0.06 -0.90 0.00 3.64 -1.06 -0.33 116.57 118.35 1gfs h LYS 262 Ca 0.30 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.76 1gfs h LYS 262 Cb 0.37 -0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 32.11 1gfs h LYS 262 CO -0.31 0.19 0.58 0.28 -2.27 0.00 0.00 179.45 177.93 1gfs h VAL 263 N -0.09 0.99 0.00 2.00 2.07 -0.74 -2.13 116.25 118.35 1gfs h VAL 263 Ca 0.01 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1gfs h VAL 263 Cb 0.16 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 29.90 1gfs h VAL 263 CO -0.00 0.17 -0.28 0.58 0.02 0.00 0.00 177.57 178.06 1gfs h VAL 264 N 0.93 0.00 0.00 2.57 2.07 -1.16 -3.48 116.25 117.18 1gfs h VAL 264 Ca 0.41 -0.64 0.00 0.00 0.82 0.00 0.00 66.70 67.30 1gfs h VAL 264 Cb 0.37 1.47 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 1gfs h VAL 264 CO -0.18 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.02 1gfs n GLY 265 N 1.26 0.63 3.71 2.17 0.00 -0.76 -4.99 105.19 107.21 1gfs n GLY 265 Ca 0.04 -0.76 -0.42 0.00 0.00 0.00 0.00 46.02 44.88 1gfs n GLY 265 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1gfs s TYR 266 N -2.00 3.40 -1.31 1.61 5.04 -0.21 -4.94 117.35 118.94 1gfs s TYR 266 Ca 0.00 1.30 0.17 0.00 -2.44 0.00 0.00 57.07 56.10 1gfs s TYR 266 Cb 0.00 -3.41 -0.07 0.00 0.35 0.00 0.00 41.96 38.83 1gfs s TYR 266 CO 0.00 -1.24 0.84 1.63 -1.34 0.00 0.00 175.55 175.44 1gfs n LYS 267 N 4.16 1.55 0.00 4.97 4.76 -1.26 -4.69 118.16 127.65 1gfs n LYS 267 Ca 0.09 -0.55 0.00 0.00 -2.87 0.00 0.00 58.31 54.98 1gfs n LYS 267 Cb 0.47 -1.31 0.00 0.00 -1.84 0.00 0.00 35.03 32.35 1gfs n LYS 267 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1gfs n GLY 268 N 1.28 -1.64 3.77 0.72 0.00 -1.26 -5.05 105.19 103.00 1gfs n GLY 268 Ca 0.06 -1.53 -0.36 0.00 0.00 0.00 0.00 46.02 44.19 1gfs n GLY 268 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gfs s ARG 269 N -1.36 3.17 -0.28 1.61 0.52 -0.11 -4.97 118.95 117.52 1gfs s ARG 269 Ca 0.00 -0.30 -0.14 0.00 -0.52 0.00 0.00 55.73 54.77 1gfs s ARG 269 Cb 0.00 -2.95 -0.04 0.00 0.52 0.00 0.00 34.95 32.48 1gfs s ARG 269 CO 0.00 0.73 0.32 0.08 0.02 0.00 0.00 175.30 176.45 1gfs s VAL 270 N -0.96 5.21 -0.09 3.52 1.01 -1.26 -1.01 120.40 126.82 1gfs s VAL 270 Ca 0.15 0.43 0.04 0.00 0.00 0.00 0.00 61.98 62.60 1gfs s VAL 270 Cb -0.12 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.60 1gfs s VAL 270 CO 0.04 0.16 -0.24 -0.69 0.00 0.00 0.00 175.10 174.38 1gfs s VAL 271 N 1.98 2.13 -0.25 2.92 1.01 -0.04 -4.95 120.40 123.20 1gfs s VAL 271 Ca 0.13 -1.01 -0.08 0.00 0.00 0.00 0.00 61.98 61.01 1gfs s VAL 271 Cb -0.16 -1.80 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1gfs s VAL 271 CO 0.10 0.56 0.11 -0.36 0.00 0.00 0.00 175.10 175.51 1gfs s PHE 272 N 0.18 3.15 -0.67 5.22 0.40 -1.26 -0.07 117.98 124.93 1gfs s PHE 272 Ca -0.14 -0.19 -0.22 0.00 -0.60 0.00 0.00 56.93 55.78 1gfs s PHE 272 Cb -0.17 -2.26 0.08 0.00 0.51 0.00 0.00 43.02 41.18 1gfs s PHE 272 CO 0.07 -0.23 0.95 0.34 0.70 0.00 0.00 175.22 177.05 1gfs s ASP 273 N 1.50 6.19 0.00 1.36 -1.08 -0.01 -4.89 116.67 119.74 1gfs s ASP 273 Ca 0.06 -1.07 0.23 0.00 -0.52 0.00 0.00 52.55 51.25 1gfs s ASP 273 Cb -0.15 -2.41 1.35 0.00 -1.46 0.00 0.00 42.92 40.25 1gfs s ASP 273 CO 0.06 -1.40 1.74 0.00 0.52 0.00 0.00 175.17 176.08 1gfs n ALA 274 N 7.56 2.34 1.51 3.66 0.00 -1.18 -0.66 120.51 133.74 1gfs n ALA 274 Ca -0.03 -0.14 0.15 0.00 0.00 0.00 0.00 53.44 53.42 1gfs n ALA 274 Cb 0.45 -1.37 0.75 0.00 0.00 0.00 0.00 19.45 19.28 1gfs n ALA 274 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1gfs n SER 275 N -1.02 0.12 -4.81 0.00 3.41 -1.26 -4.75 113.62 105.31 1gfs n SER 275 Ca 0.17 -0.38 -0.33 0.00 -0.26 0.00 0.00 58.87 58.06 1gfs n SER 275 Cb 0.09 -0.19 -0.06 0.00 -0.26 0.00 0.00 64.21 63.78 1gfs n SER 275 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1gfs s LYS 276 N -2.46 3.16 0.57 4.33 -0.14 -1.09 -5.03 119.74 119.08 1gfs s LYS 276 Ca 0.32 -0.44 -0.18 0.00 -1.36 0.00 0.00 55.97 54.31 1gfs s LYS 276 Cb 0.20 -2.92 -0.05 0.00 -1.68 0.00 0.00 37.83 33.39 1gfs s LYS 276 CO 0.45 0.66 1.10 -1.25 -0.76 0.00 0.00 175.35 175.54 1gfs s PRO 277 N -1.77 3.30 0.45 -1.68 0.04 -1.26 -3.83 135.00 130.25 1gfs s PRO 277 Ca 0.24 1.45 0.06 0.00 0.04 0.00 0.00 61.00 62.78 1gfs s PRO 277 Cb -0.12 -2.01 0.01 0.00 0.04 0.00 0.00 34.50 32.42 1gfs s PRO 277 CO 0.15 -0.86 0.62 -0.51 0.04 0.00 0.00 177.00 176.43 1gfs s ASP 278 N -2.17 5.59 0.00 6.66 1.01 -1.26 -4.50 116.67 121.99 1gfs s ASP 278 Ca 0.69 -0.27 0.00 0.00 0.71 0.00 0.00 52.55 53.68 1gfs s ASP 278 Cb -0.20 -0.80 0.00 0.00 1.01 0.00 0.00 42.92 42.93 1gfs s ASP 278 CO 0.31 -0.83 0.00 0.61 0.21 0.00 0.00 175.17 175.47 1gfs n GLY 279 N -1.97 1.37 3.75 0.21 0.00 -1.26 -5.01 105.19 102.28 1gfs n GLY 279 Ca 0.07 -1.74 -0.37 0.00 0.00 0.00 0.00 46.02 43.98 1gfs n GLY 279 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gfs s THR 280 N 1.60 2.37 0.42 2.61 -4.23 -1.26 -4.90 115.64 112.25 1gfs s THR 280 Ca 0.00 0.26 0.08 0.00 -1.18 0.00 0.00 61.69 60.85 1gfs s THR 280 Cb 0.00 -3.12 0.27 0.00 1.34 0.00 0.00 72.50 70.99 1gfs s THR 280 CO 0.00 -0.02 2.06 -0.65 -0.54 0.00 0.00 174.62 175.47 1gfs h PRO 281 N 1.32 0.50 -2.67 3.99 0.11 -1.94 -3.43 132.00 129.87 1gfs h PRO 281 Ca -0.51 -0.03 -0.10 0.00 0.11 0.00 0.00 66.00 65.47 1gfs h PRO 281 Cb 1.30 -0.11 -0.21 0.00 0.11 0.00 0.00 31.00 32.08 1gfs h PRO 281 CO 0.57 0.33 -0.15 0.50 -0.21 0.00 0.00 178.00 179.04 1gfs s ARG 282 N -5.47 0.69 -0.30 1.05 3.52 -1.26 0.22 118.95 117.41 1gfs s ARG 282 Ca -0.08 0.23 -0.00 0.00 -0.13 0.00 0.00 55.73 55.75 1gfs s ARG 282 Cb 0.18 0.32 0.19 0.00 -1.56 0.00 0.00 34.95 34.08 1gfs s ARG 282 CO 0.73 -0.16 0.59 0.21 -0.81 0.00 0.00 175.30 175.86 1gfs s LYS 283 N -0.66 0.56 0.10 5.12 2.20 -0.70 -4.96 119.74 121.40 1gfs s LYS 283 Ca -0.08 0.95 -0.17 0.00 -0.36 0.00 0.00 55.97 56.32 1gfs s LYS 283 Cb -0.03 0.51 0.04 0.00 -1.51 0.00 0.00 37.83 36.83 1gfs s LYS 283 CO 0.04 -0.66 0.42 -0.48 -0.36 0.00 0.00 175.35 174.30 1gfs s LEU 284 N 2.85 0.34 0.22 5.43 2.34 -1.26 -3.27 118.68 125.33 1gfs s LEU 284 Ca 0.20 -0.20 -0.08 0.00 0.06 0.00 0.00 54.13 54.11 1gfs s LEU 284 Cb -0.15 1.86 -0.07 0.00 -0.56 0.00 0.00 46.19 47.28 1gfs s LEU 284 CO -0.21 -0.80 0.52 -0.76 -1.06 0.00 0.00 176.35 174.03 1gfs s LEU 285 N -2.55 4.17 -0.38 1.48 1.43 -1.26 -1.16 118.68 120.41 1gfs s LEU 285 Ca 0.00 0.83 -0.21 0.00 -1.03 0.00 0.00 54.13 53.73 1gfs s LEU 285 Cb 0.01 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.64 1gfs s LEU 285 CO -0.09 -0.07 0.66 -0.62 0.23 0.00 0.00 176.35 176.46 1gfs s ASP 286 N -2.47 6.42 -0.28 2.29 -1.08 -0.31 -4.39 116.67 116.84 1gfs s ASP 286 Ca 0.46 0.07 0.12 0.00 -0.52 0.00 0.00 52.55 52.67 1gfs s ASP 286 Cb -0.11 -2.33 0.71 0.00 -1.46 0.00 0.00 42.92 39.72 1gfs s ASP 286 CO 0.23 -0.65 1.71 1.33 0.52 0.00 0.00 175.17 178.30 1gfs n VAL 287 N 5.68 2.77 -0.06 1.11 0.24 -1.26 -4.67 118.33 122.14 1gfs n VAL 287 Ca -0.01 -1.74 -0.08 0.00 -2.04 0.00 0.00 64.34 60.48 1gfs n VAL 287 Cb 0.48 -0.32 -0.01 0.00 -1.47 0.00 0.00 33.84 32.52 1gfs n VAL 287 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 1gfs h THR 288 N 2.61 0.40 -0.82 3.34 2.02 -1.93 -0.57 112.91 117.97 1gfs h THR 288 Ca 0.17 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.46 1gfs h THR 288 Cb 2.07 0.40 -0.08 0.00 -1.74 0.00 0.00 68.15 68.80 1gfs h THR 288 CO 0.58 0.00 0.45 -0.09 0.37 0.00 0.00 175.52 176.84 1gfs h ARG 289 N -0.23 0.72 -0.37 6.66 2.43 -1.93 0.04 114.38 121.70 1gfs h ARG 289 Ca 0.15 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.18 1gfs h ARG 289 Cb 0.45 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1gfs h ARG 289 CO -0.40 0.48 -0.12 1.25 -1.51 0.00 0.00 179.97 179.67 1gfs h LEU 290 N 0.74 0.75 -0.84 3.80 5.85 -1.57 -2.41 115.31 121.63 1gfs h LEU 290 Ca 0.40 -0.38 -0.08 0.00 0.84 0.00 0.00 57.88 58.67 1gfs h LEU 290 Cb 0.42 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.22 1gfs h LEU 290 CO -0.27 0.96 0.01 0.45 -0.34 0.00 0.00 178.44 179.25 1gfs h HIS 291 N 0.54 0.93 0.00 1.25 3.86 -0.46 -1.74 115.15 119.53 1gfs h HIS 291 Ca 0.09 -0.14 -0.01 0.00 -1.16 0.00 0.00 60.37 59.16 1gfs h HIS 291 Cb 0.64 -0.25 -0.00 0.00 1.06 0.00 0.00 27.41 28.86 1gfs h HIS 291 CO 0.05 0.84 -0.05 1.96 0.86 0.00 0.00 177.93 181.60 1gfs h GLN 292 N 0.81 0.00 -0.14 2.45 4.20 -0.89 0.15 115.11 121.69 1gfs h GLN 292 Ca 0.16 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.87 1gfs h GLN 292 Cb 0.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.25 1gfs h GLN 292 CO 0.02 0.05 0.00 1.28 -0.67 0.00 0.00 178.83 179.51 1gfs n LEU 293 N -3.21 1.02 -0.18 1.46 4.77 -0.67 -4.91 117.00 115.27 1gfs n LEU 293 Ca -0.01 -0.46 -0.02 0.00 -0.03 0.00 0.00 56.01 55.49 1gfs n LEU 293 Cb 0.26 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.26 1gfs n LEU 293 CO 0.27 0.23 -0.02 0.61 -1.33 0.00 0.00 177.39 177.15 1gfs n GLY 294 N 0.92 0.43 3.32 -0.72 0.00 0.52 -5.05 105.19 104.60 1gfs n GLY 294 Ca 0.12 -0.91 -0.32 0.00 0.00 0.00 0.00 46.02 44.91 1gfs n GLY 294 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1gfs s TRP 295 N -2.09 2.50 0.00 1.61 -0.00 -1.09 -5.03 118.94 114.85 1gfs s TRP 295 Ca 0.00 -0.58 0.01 0.00 -0.00 0.00 0.00 56.10 55.54 1gfs s TRP 295 Cb 0.00 -1.61 -0.01 0.00 -0.00 0.00 0.00 33.47 31.85 1gfs s TRP 295 CO 0.00 -0.12 -0.04 0.71 -0.00 0.00 0.00 176.95 177.49 1gfs s TYR 296 N -0.28 0.39 0.61 5.86 1.51 -1.26 -3.92 117.35 120.25 1gfs s TYR 296 Ca 0.00 -0.12 -0.17 0.00 -1.01 0.00 0.00 57.07 55.77 1gfs s TYR 296 Cb -0.13 -0.25 -0.02 0.00 -0.11 0.00 0.00 41.96 41.45 1gfs s TYR 296 CO 0.03 -0.02 1.11 -3.38 -1.11 0.00 0.00 175.55 172.18 1gfs s HIS 297 N -0.26 2.67 -0.10 2.71 -3.43 -1.26 -5.00 115.29 110.63 1gfs s HIS 297 Ca -0.00 1.55 0.05 0.00 -0.80 0.00 0.00 55.06 55.85 1gfs s HIS 297 Cb -0.03 -3.20 -0.09 0.00 -1.43 0.00 0.00 32.58 27.83 1gfs s HIS 297 CO -0.00 -1.59 -0.02 0.39 -2.00 0.00 0.00 174.74 171.52 1gfs n GLU 298 N -1.98 1.66 -2.81 -0.38 1.02 -1.26 -4.99 120.64 111.91 1gfs n GLU 298 Ca 0.11 0.02 -0.42 0.00 -0.02 0.00 0.00 57.16 56.84 1gfs n GLU 298 Cb 0.52 -1.22 -0.04 0.00 -0.02 0.00 0.00 31.44 30.68 1gfs n GLU 298 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1gfs s ILE 299 N -2.22 4.63 0.63 -3.67 1.01 -1.26 -5.05 121.20 115.28 1gfs s ILE 299 Ca -0.09 1.29 -0.10 0.00 0.00 0.00 0.00 60.65 61.76 1gfs s ILE 299 Cb 0.03 -4.30 -0.02 0.00 0.01 0.00 0.00 42.46 38.18 1gfs s ILE 299 CO 0.32 -0.45 1.03 -0.94 0.00 0.00 0.00 174.94 174.89 1gfs s SER 300 N 1.76 5.95 0.11 3.58 1.04 -1.26 -4.75 113.70 120.14 1gfs s SER 300 Ca 0.38 1.25 -0.29 0.00 0.48 0.00 0.00 55.95 57.78 1gfs s SER 300 Cb -0.13 -2.24 -0.08 0.00 0.10 0.00 0.00 66.02 63.67 1gfs s SER 300 CO 0.16 -1.00 1.61 0.25 0.98 0.00 0.00 173.24 175.24 1gfs h LEU 301 N -0.38 -0.98 -0.53 2.42 5.85 -1.96 0.21 115.31 119.94 1gfs h LEU 301 Ca -0.45 0.11 0.07 0.00 0.84 0.00 0.00 57.88 58.45 1gfs h LEU 301 Cb 1.21 0.37 -0.06 0.00 0.37 0.00 0.00 40.66 42.56 1gfs h LEU 301 CO 0.62 -0.42 0.22 -0.33 -0.34 0.00 0.00 178.44 178.19 1gfs h GLU 302 N -0.56 0.41 -0.46 1.25 3.07 -1.98 0.12 114.58 116.44 1gfs h GLU 302 Ca 0.03 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 58.82 1gfs h GLU 302 Cb 0.59 -0.09 -0.02 0.00 -0.84 0.00 0.00 28.75 28.39 1gfs h GLU 302 CO -0.21 0.27 0.09 0.00 -1.40 0.00 0.00 179.01 177.77 1gfs h ALA 303 N 1.33 0.61 -0.32 3.43 0.00 -1.89 -1.93 119.26 120.49 1gfs h ALA 303 Ca 0.25 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.84 1gfs h ALA 303 Cb 0.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1gfs h ALA 303 CO -0.23 0.32 -0.24 0.78 0.00 0.00 0.00 179.25 179.89 1gfs h GLY 304 N 0.63 0.69 1.36 0.00 0.00 0.07 -2.44 103.07 103.37 1gfs h GLY 304 Ca 0.14 -0.57 -0.17 0.00 0.00 0.00 0.00 47.33 46.73 1gfs h GLY 304 CO 0.01 0.52 -0.56 1.41 0.00 0.00 0.00 176.54 177.91 1gfs h LEU 305 N 0.56 0.75 -0.06 3.11 3.38 -0.70 -1.57 115.31 120.78 1gfs h LEU 305 Ca 0.08 -0.41 -0.00 0.00 0.09 0.00 0.00 57.88 57.64 1gfs h LEU 305 Cb 0.70 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1gfs h LEU 305 CO 0.05 1.16 0.02 0.00 0.09 0.00 0.00 178.44 179.76 1gfs h ALA 306 N 0.86 0.07 -0.38 1.53 0.00 -1.23 0.37 119.26 120.47 1gfs h ALA 306 Ca 0.01 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1gfs h ALA 306 Cb 1.13 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1gfs h ALA 306 CO 0.11 -0.34 -0.21 0.66 0.00 0.00 0.00 179.25 179.47 1gfs h SER 307 N -0.07 0.76 -0.64 0.00 4.64 -1.48 -1.68 113.55 115.08 1gfs h SER 307 Ca 0.02 -0.27 -0.07 0.00 -0.47 0.00 0.00 61.79 61.00 1gfs h SER 307 Cb 0.17 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 1gfs h SER 307 CO -0.00 0.95 0.12 0.74 -0.87 0.00 0.00 176.83 177.77 1gfs h THR 308 N 0.66 1.26 -0.60 2.95 2.02 -1.15 -1.66 112.91 116.39 1gfs h THR 308 Ca 0.09 -1.00 -0.08 0.00 0.77 0.00 0.00 66.41 66.19 1gfs h THR 308 Cb 0.71 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 1gfs h THR 308 CO 0.05 0.38 0.05 0.22 0.37 0.00 0.00 175.52 176.59 1gfs h TYR 309 N 1.00 1.07 -0.75 3.16 3.20 -0.64 -1.11 116.97 122.90 1gfs h TYR 309 Ca 0.20 -0.16 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1gfs h TYR 309 Cb 0.41 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.35 1gfs h TYR 309 CO 0.03 0.93 0.47 0.37 -1.64 0.00 0.00 178.16 178.32 1gfs h GLN 310 N 0.93 1.00 -0.26 1.82 5.75 -0.99 -0.52 115.11 122.84 1gfs h GLN 310 Ca 0.18 -0.07 -0.02 0.00 -0.15 0.00 0.00 58.65 58.59 1gfs h GLN 310 Cb 0.47 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 28.79 1gfs h GLN 310 CO 0.02 0.68 0.09 2.35 -2.65 0.00 0.00 178.83 179.33 1gfs h TRP 311 N 1.01 0.40 -0.94 3.99 7.01 -0.89 -2.52 115.95 124.03 1gfs h TRP 311 Ca 0.27 -0.03 0.09 0.00 2.11 0.00 0.00 58.89 61.32 1gfs h TRP 311 Cb -0.08 -0.12 -0.07 0.00 -2.10 0.00 0.00 29.16 26.79 1gfs h TRP 311 CO -0.02 0.43 0.58 0.35 -2.79 0.00 0.00 178.44 177.00 1gfs h PHE 312 N 0.26 1.07 -0.17 2.65 3.57 -0.74 -2.30 116.94 121.28 1gfs h PHE 312 Ca 0.09 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 1gfs h PHE 312 Cb 0.20 -0.34 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 1gfs h PHE 312 CO -0.00 0.49 0.10 -0.07 -2.23 0.00 0.00 178.31 176.60 1gfs h LEU 313 N 1.00 0.21 0.00 0.59 3.38 -0.76 0.13 115.31 119.86 1gfs h LEU 313 Ca 0.43 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.35 1gfs h LEU 313 Cb 0.30 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1gfs h LEU 313 CO -0.21 0.20 0.00 -0.62 0.09 0.00 0.00 178.44 177.90 1gfs n GLU 314 N -4.94 0.32 -0.14 1.13 1.02 -0.98 -3.47 120.64 113.59 1gfs n GLU 314 Ca -0.04 0.08 0.01 0.00 -0.02 0.00 0.00 57.16 57.20 1gfs n GLU 314 Cb 0.05 -1.50 0.02 0.00 -0.02 0.00 0.00 31.44 29.99 1gfs n GLU 314 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1gfs n ASN 315 N -1.26 0.74 0.31 1.62 3.02 -0.90 -4.85 115.26 113.94 1gfs n ASN 315 Ca 0.10 -1.75 0.19 0.00 -0.03 0.00 0.00 54.58 53.08 1gfs n ASN 315 Cb 0.16 -0.11 1.05 0.00 -0.61 0.00 0.00 39.78 40.27 1gfs n ASN 315 CO 0.00 0.00 0.00 0.06 -2.62 0.00 0.00 177.26 174.70 1gfs h GLN 316 N 0.00 0.00 -3.13 3.52 3.07 -0.78 -3.16 115.11 114.62 1gfs h GLN 316 Ca 0.00 0.00 -0.72 0.00 0.09 0.00 0.00 58.65 58.02 1gfs h GLN 316 Cb 1.00 0.00 -0.07 0.00 0.08 0.00 0.00 27.48 28.48 1gfs h GLN 316 CO 0.00 0.00 2.85 -0.25 0.09 0.00 0.00 178.83 181.52 1gfs n ASP 317 N -3.51 6.94 0.00 0.06 8.00 -1.26 -2.17 116.55 124.61 1gfs n ASP 317 Ca -0.03 -2.93 0.00 0.00 0.71 0.00 0.00 54.79 52.54 1gfs n ASP 317 Cb 0.08 -1.49 0.00 0.00 -0.02 0.00 0.00 41.12 39.69 1gfs n ASP 317 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1gfs n ARG 318 N 3.39 0.38 0.00 -1.24 1.74 -1.20 -5.23 116.66 114.50 1gfs n ARG 318 Ca 0.60 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.68 1gfs n ARG 318 Cb 0.29 -0.03 0.00 0.00 -1.02 0.00 0.00 32.46 31.70 1gfs n ARG 318 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30