#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fui n LYS 2 N 0.00 -1.61 -2.22 0.03 5.02 -1.26 -4.73 118.16 113.39 1fui n LYS 2 Ca 0.00 1.21 -0.20 0.00 -2.02 0.00 0.00 58.31 57.29 1fui n LYS 2 Cb 0.00 -1.39 -0.03 0.00 -0.02 0.00 0.00 35.03 33.60 1fui n LYS 2 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1fui n LYS 3 N -1.13 -1.66 -1.50 1.97 4.01 -1.26 -4.74 118.16 113.86 1fui n LYS 3 Ca 0.00 1.04 -0.12 0.00 -0.51 0.00 0.00 58.31 58.72 1fui n LYS 3 Cb 0.03 -5.64 -0.10 0.00 -0.51 0.00 0.00 35.03 28.81 1fui n LYS 3 CO 0.00 0.00 0.00 0.44 -1.11 0.00 0.00 177.40 176.73 1fui n ILE 4 N -3.60 0.00 -2.52 -0.18 -0.00 -1.26 -4.01 119.36 107.79 1fui n ILE 4 Ca -0.23 -0.15 -0.13 0.00 -0.00 0.00 0.00 62.75 62.24 1fui n ILE 4 Cb 0.68 -1.68 0.01 0.00 -0.00 0.00 0.00 39.64 38.65 1fui n ILE 4 CO 0.00 0.00 0.00 -1.20 -0.00 0.00 0.00 176.55 175.35 1fui n SER 5 N 17.51 -4.13 -4.78 7.28 7.64 -1.26 -4.89 113.62 130.99 1fui n SER 5 Ca 0.37 0.09 -0.35 0.00 1.01 0.00 0.00 58.87 59.99 1fui n SER 5 Cb 0.46 -1.08 -0.01 0.00 -1.01 0.00 0.00 64.21 62.57 1fui n SER 5 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1fui s LEU 6 N -1.16 3.77 0.54 -3.43 1.43 -1.26 -4.99 118.68 113.59 1fui s LEU 6 Ca 0.13 2.10 -0.20 0.00 -1.03 0.00 0.00 54.13 55.13 1fui s LEU 6 Cb -0.01 -4.57 -0.06 0.00 0.03 0.00 0.00 46.19 41.57 1fui s LEU 6 CO 0.29 -1.09 1.13 -2.16 0.23 0.00 0.00 176.35 174.75 1fui s PRO 7 N -3.28 3.36 0.34 1.29 0.04 -1.26 -4.97 135.00 130.52 1fui s PRO 7 Ca 0.71 1.62 0.09 0.00 0.04 0.00 0.00 61.00 63.45 1fui s PRO 7 Cb -0.21 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.26 1fui s PRO 7 CO 0.25 -0.84 0.06 0.15 0.04 0.00 0.00 177.00 176.65 1fui s LYS 8 N -3.27 2.18 -0.22 4.56 1.02 -0.54 -4.72 119.74 118.75 1fui s LYS 8 Ca 0.73 -1.67 -0.08 0.00 0.02 0.00 0.00 55.97 54.97 1fui s LYS 8 Cb -0.24 -2.02 -0.04 0.00 -0.52 0.00 0.00 37.83 35.02 1fui s LYS 8 CO 0.27 0.13 0.08 0.42 -0.92 0.00 0.00 175.35 175.33 1fui s ILE 9 N -2.48 4.65 -0.17 2.17 1.01 -0.74 -0.77 121.20 124.87 1fui s ILE 9 Ca 0.36 -0.07 -0.13 0.00 0.00 0.00 0.00 60.65 60.81 1fui s ILE 9 Cb -0.01 -3.14 -0.05 0.00 0.01 0.00 0.00 42.46 39.28 1fui s ILE 9 CO 0.20 0.39 0.24 -0.83 0.00 0.00 0.00 174.94 174.94 1fui s GLY 10 N 0.99 2.15 -0.19 6.18 0.00 -0.48 -0.41 107.32 115.56 1fui s GLY 10 Ca 0.04 -0.53 -0.04 0.00 0.00 0.00 0.00 44.72 44.19 1fui s GLY 10 CO 0.03 0.33 -0.03 -0.42 0.00 0.00 0.00 173.10 173.01 1fui s ILE 11 N 0.43 3.69 -0.39 0.90 1.01 0.64 -1.07 121.20 126.41 1fui s ILE 11 Ca 0.14 -0.41 -0.02 0.00 0.00 0.00 0.00 60.65 60.36 1fui s ILE 11 Cb -0.12 -2.65 0.11 0.00 0.01 0.00 0.00 42.46 39.81 1fui s ILE 11 CO 0.02 0.45 0.17 -0.13 0.00 0.00 0.00 174.94 175.45 1fui s ARG 12 N 0.91 1.94 -0.25 2.79 0.52 0.17 -2.43 118.95 122.60 1fui s ARG 12 Ca -0.00 -1.80 -0.29 0.00 -0.52 0.00 0.00 55.73 53.12 1fui s ARG 12 Cb -0.15 -3.51 0.01 0.00 0.52 0.00 0.00 34.95 31.83 1fui s ARG 12 CO 0.01 -1.03 1.04 -1.25 0.02 0.00 0.00 175.30 174.09 1fui s PRO 13 N 1.11 4.22 0.06 3.54 0.04 -1.26 -1.23 135.00 141.47 1fui s PRO 13 Ca 0.08 1.28 0.03 0.00 0.04 0.00 0.00 61.00 62.43 1fui s PRO 13 Cb -0.22 -3.66 -0.04 0.00 0.04 0.00 0.00 34.50 30.62 1fui s PRO 13 CO -0.05 -0.68 0.06 0.08 0.04 0.00 0.00 177.00 176.45 1fui s VAL 14 N 3.28 4.44 0.12 -0.36 1.01 -0.57 0.33 120.40 128.64 1fui s VAL 14 Ca 0.44 -0.72 -0.14 0.00 0.00 0.00 0.00 61.98 61.56 1fui s VAL 14 Cb -0.14 -3.10 0.02 0.00 0.00 0.00 0.00 36.38 33.16 1fui s VAL 14 CO 0.08 0.20 0.34 -0.51 0.00 0.00 0.00 175.10 175.20 1fui s ILE 15 N -1.30 0.09 0.16 2.22 2.07 0.24 -4.58 121.20 120.09 1fui s ILE 15 Ca 0.26 -0.75 -0.31 0.00 -1.41 0.00 0.00 60.65 58.44 1fui s ILE 15 Cb -0.12 -1.22 -0.09 0.00 0.13 0.00 0.00 42.46 41.16 1fui s ILE 15 CO 0.19 -0.41 1.51 -0.62 -1.91 0.00 0.00 174.94 173.69 1fui s ASP 16 N -2.82 6.66 0.42 4.50 -1.08 -1.20 -4.20 116.67 118.95 1fui s ASP 16 Ca 0.04 2.53 0.26 0.00 -0.52 0.00 0.00 52.55 54.86 1fui s ASP 16 Cb 0.03 -2.59 0.67 0.00 -1.46 0.00 0.00 42.92 39.56 1fui s ASP 16 CO -0.12 -0.77 1.72 1.23 0.52 0.00 0.00 175.17 177.76 1fui h GLY 17 N 6.68 0.00 -2.85 2.66 0.00 -1.88 -3.40 103.07 104.28 1fui h GLY 17 Ca -0.43 0.00 -0.50 0.00 0.00 0.00 0.00 47.33 46.41 1fui h GLY 17 CO 0.89 0.00 0.46 1.09 0.00 0.00 0.00 176.54 178.98 1fui s ARG 18 N -3.29 4.00 0.00 4.80 1.70 -1.26 -4.86 118.95 120.04 1fui s ARG 18 Ca 0.06 1.68 0.00 0.00 -0.47 0.00 0.00 55.73 57.00 1fui s ARG 18 Cb 0.07 -2.54 0.00 0.00 -0.57 0.00 0.00 34.95 31.92 1fui s ARG 18 CO 0.62 -0.32 0.00 0.54 -1.08 0.00 0.00 175.30 175.06 1fui n ARG 19 N -0.16 0.00 -2.10 3.89 5.12 -1.26 -0.71 116.66 121.44 1fui n ARG 19 Ca 0.06 0.00 -0.19 0.00 -1.93 0.00 0.00 57.85 55.79 1fui n ARG 19 Cb 0.48 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 31.75 1fui n ARG 19 CO 0.00 0.00 0.00 -0.12 -1.93 0.00 0.00 177.63 175.58 1fui n MET 20 N 0.00 -1.67 0.00 5.56 1.56 -1.26 -1.29 117.12 120.02 1fui n MET 20 Ca 0.00 0.99 0.00 0.00 -0.27 0.00 0.00 57.70 58.42 1fui n MET 20 Cb 0.00 -5.54 0.00 0.00 2.15 0.00 0.00 33.22 29.83 1fui n MET 20 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1fui n GLY 21 N -0.75 2.45 0.00 -5.12 0.00 -1.26 -5.00 105.19 95.51 1fui n GLY 21 Ca -0.21 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1fui n GLY 21 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1fui n VAL 22 N 0.00 0.00 -0.19 1.61 0.31 -0.41 -1.23 118.33 118.42 1fui n VAL 22 Ca 0.00 1.34 0.00 0.00 -0.01 0.00 0.00 64.34 65.67 1fui n VAL 22 Cb 0.00 -2.19 0.09 0.00 -0.91 0.00 0.00 33.84 30.83 1fui n VAL 22 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1fui h ARG 23 N 0.00 0.13 0.00 5.55 2.43 -1.09 -1.21 114.38 120.19 1fui h ARG 23 Ca 0.00 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1fui h ARG 23 Cb 0.00 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 29.52 1fui h ARG 23 CO 0.00 0.09 -0.05 1.05 -1.51 0.00 0.00 179.97 179.54 1fui h GLU 24 N 0.13 0.00 0.00 0.20 9.09 -1.82 -0.10 114.58 122.09 1fui h GLU 24 Ca 0.30 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.71 1fui h GLU 24 Cb 0.48 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.58 1fui h GLU 24 CO -0.49 0.05 -0.09 0.66 0.05 0.00 0.00 179.01 179.19 1fui h SER 25 N 0.00 0.00 0.06 3.06 4.64 0.09 -3.31 113.55 118.09 1fui h SER 25 Ca -0.00 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.26 1fui h SER 25 Cb 0.13 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 1fui h SER 25 CO 0.01 0.01 -1.98 0.18 -0.87 0.00 0.00 176.83 174.18 1fui n LEU 26 N -2.53 0.06 -0.22 5.97 4.32 -0.18 -4.65 117.00 119.77 1fui n LEU 26 Ca 0.05 0.02 -0.03 0.00 -0.02 0.00 0.00 56.01 56.03 1fui n LEU 26 Cb 0.47 0.05 0.04 0.00 -1.62 0.00 0.00 43.42 42.35 1fui n LEU 26 CO 0.32 0.04 0.67 -0.33 -1.22 0.00 0.00 177.39 176.87 1fui h GLU 27 N 0.00 -0.09 0.05 3.23 4.39 -1.30 -2.03 114.58 118.83 1fui h GLU 27 Ca -0.06 0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.64 1fui h GLU 27 Cb 1.14 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1fui h GLU 27 CO 0.00 -0.06 -0.02 1.49 -1.16 0.00 0.00 179.01 179.26 1fui h GLU 28 N -0.09 -0.07 -0.74 2.33 4.81 -1.82 -2.44 114.58 116.55 1fui h GLU 28 Ca 0.28 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.56 1fui h GLU 28 Cb 0.54 0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.88 1fui h GLU 28 CO -0.70 0.12 0.45 0.37 -0.73 0.00 0.00 179.01 178.51 1fui h GLN 29 N -0.24 0.83 -0.08 1.92 4.15 -1.80 -0.70 115.11 119.20 1fui h GLN 29 Ca -0.01 -0.05 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 1fui h GLN 29 Cb 0.21 -0.19 -0.00 0.00 0.21 0.00 0.00 27.48 27.71 1fui h GLN 29 CO 0.01 0.55 0.05 1.15 -1.93 0.00 0.00 178.83 178.66 1fui h THR 30 N 0.86 1.06 0.00 2.39 2.02 -1.36 -0.42 112.91 117.45 1fui h THR 30 Ca 0.31 -0.16 -0.07 0.00 0.77 0.00 0.00 66.41 67.27 1fui h THR 30 Cb 0.10 1.02 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 1fui h THR 30 CO -0.14 0.05 -0.31 0.24 0.37 0.00 0.00 175.52 175.73 1fui h MET 31 N 0.06 0.00 -0.42 6.66 2.86 -1.18 -1.57 114.93 121.35 1fui h MET 31 Ca 0.03 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.57 1fui h MET 31 Cb 0.04 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.69 1fui h MET 31 CO -0.01 0.31 -0.12 -0.91 1.06 0.00 0.00 176.91 177.24 1fui h ASN 32 N 0.00 0.84 -0.29 1.22 2.35 -0.76 0.84 115.58 119.77 1fui h ASN 32 Ca -0.00 -0.37 0.03 0.00 -0.55 0.00 0.00 56.30 55.41 1fui h ASN 32 Cb 0.57 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.68 1fui h ASN 32 CO 0.04 1.02 0.11 -0.03 -1.65 0.00 0.00 177.43 176.92 1fui h MET 33 N 0.65 0.24 -0.67 0.81 4.05 -0.72 0.41 114.93 119.70 1fui h MET 33 Ca 0.10 -0.01 -0.01 0.00 -0.28 0.00 0.00 59.70 59.50 1fui h MET 33 Cb 0.66 -0.05 -0.03 0.00 -0.80 0.00 0.00 31.60 31.37 1fui h MET 33 CO 0.05 0.16 0.39 0.00 0.23 0.00 0.00 176.91 177.73 1fui h ALA 34 N 1.18 0.86 -0.50 0.39 0.00 -0.97 -1.36 119.26 118.85 1fui h ALA 34 Ca 0.13 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.83 1fui h ALA 34 Cb 0.09 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 1fui h ALA 34 CO -0.12 0.35 -0.14 0.87 0.00 0.00 0.00 179.25 180.21 1fui h LYS 35 N 0.92 0.98 -0.70 0.00 1.57 -0.30 -2.31 116.57 116.73 1fui h LYS 35 Ca 0.24 -0.39 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 1fui h LYS 35 Cb 0.01 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 1fui h LYS 35 CO -0.04 1.06 0.40 0.00 -0.57 0.00 0.00 179.45 180.29 1fui h ALA 36 N 0.89 0.89 -0.56 3.86 0.00 0.16 -1.22 119.26 123.29 1fui h ALA 36 Ca 0.12 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1fui h ALA 36 Cb 0.71 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1fui h ALA 36 CO 0.05 0.39 0.23 1.15 0.00 0.00 0.00 179.25 181.07 1fui h THR 37 N 0.96 1.22 -0.63 0.00 2.02 -1.15 -2.07 112.91 113.27 1fui h THR 37 Ca 0.25 -0.69 -0.07 0.00 0.77 0.00 0.00 66.41 66.66 1fui h THR 37 Cb 0.02 0.63 -0.02 0.00 -1.74 0.00 0.00 68.15 67.03 1fui h THR 37 CO -0.04 0.27 0.10 0.00 0.37 0.00 0.00 175.52 176.22 1fui h ALA 38 N 1.07 0.83 -0.30 6.16 0.00 -1.12 -2.09 119.26 123.81 1fui h ALA 38 Ca 0.19 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1fui h ALA 38 Cb 0.20 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1fui h ALA 38 CO -0.02 0.59 0.19 0.00 0.00 0.00 0.00 179.25 180.02 1fui h ALA 39 N 1.03 0.38 -0.32 0.00 0.00 -1.06 -1.53 119.26 117.77 1fui h ALA 39 Ca 0.19 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1fui h ALA 39 Cb 0.43 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1fui h ALA 39 CO 0.01 -0.13 0.18 1.25 0.00 0.00 0.00 179.25 180.56 1fui h LEU 40 N 0.40 0.39 -0.18 0.00 5.85 -1.24 -2.24 115.31 118.29 1fui h LEU 40 Ca 0.11 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1fui h LEU 40 Cb -0.02 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1fui h LEU 40 CO -0.02 0.36 0.06 -0.07 -0.34 0.00 0.00 178.44 178.42 1fui h LEU 41 N 0.40 0.26 -1.60 2.25 3.38 -1.15 -0.44 115.31 118.41 1fui h LEU 41 Ca 0.11 -0.20 -0.04 0.00 0.09 0.00 0.00 57.88 57.85 1fui h LEU 41 Cb 0.05 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1fui h LEU 41 CO -0.02 0.39 -0.17 0.71 0.09 0.00 0.00 178.44 179.43 1fui h THR 42 N 0.12 0.61 0.07 0.22 1.35 -1.29 -0.08 112.91 113.90 1fui h THR 42 Ca 0.06 -0.79 -0.13 0.00 -0.55 0.00 0.00 66.41 64.99 1fui h THR 42 Cb 0.22 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.15 1fui h THR 42 CO -0.00 0.17 -0.65 -0.08 -0.25 0.00 0.00 175.52 174.71 1fui h GLU 43 N 0.00 0.15 0.00 4.72 4.81 -1.20 -3.39 114.58 119.67 1fui h GLU 43 Ca -0.00 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1fui h GLU 43 Cb 0.50 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1fui h GLU 43 CO 0.02 1.12 -0.66 0.87 -0.73 0.00 0.00 179.01 179.63 1fui h LYS 44 N -0.67 0.00 -6.41 1.92 1.79 -1.05 -3.48 116.57 108.67 1fui h LYS 44 Ca -0.14 0.00 -0.66 0.00 -2.18 0.00 0.00 60.65 57.67 1fui h LYS 44 Cb 1.38 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.89 1fui h LYS 44 CO 0.04 0.00 -0.70 -0.51 -1.08 0.00 0.00 179.45 177.20 1fui s LEU 45 N -4.66 3.24 0.02 2.94 1.43 -0.05 -5.07 118.68 116.52 1fui s LEU 45 Ca 0.05 -0.25 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 1fui s LEU 45 Cb 0.12 -1.97 -0.02 0.00 0.03 0.00 0.00 46.19 44.35 1fui s LEU 45 CO 0.73 0.20 -0.04 -0.13 0.23 0.00 0.00 176.35 177.34 1fui s ARG 46 N -2.06 0.33 0.79 1.70 1.81 -1.26 -3.72 118.95 116.55 1fui s ARG 46 Ca 0.22 -0.52 -0.11 0.00 -1.72 0.00 0.00 55.73 53.60 1fui s ARG 46 Cb -0.11 -0.07 0.07 0.00 -0.45 0.00 0.00 34.95 34.39 1fui s ARG 46 CO 0.14 0.00 1.09 -1.01 -0.68 0.00 0.00 175.30 174.84 1fui s HIS 47 N -1.09 2.50 0.52 -0.53 3.76 0.19 -4.89 115.29 115.74 1fui s HIS 47 Ca -0.10 1.55 0.29 0.00 -0.15 0.00 0.00 55.06 56.65 1fui s HIS 47 Cb -0.08 -3.07 1.68 0.00 1.11 0.00 0.00 32.58 32.22 1fui s HIS 47 CO -0.00 -1.91 2.18 0.00 -0.85 0.00 0.00 174.74 174.16 1fui h ALA 48 N -1.21 1.40 0.00 -1.40 0.00 -1.88 -0.56 119.26 115.62 1fui h ALA 48 Ca -0.44 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1fui h ALA 48 Cb 1.24 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1fui h ALA 48 CO 0.51 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.82 1fui n GLY 50 N 1.22 2.04 3.72 0.00 0.00 -0.22 -4.89 105.19 107.06 1fui n GLY 50 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 1fui n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fui s ALA 51 N -2.12 2.03 0.54 4.61 0.00 -1.26 -4.66 121.76 120.90 1fui s ALA 51 Ca 0.00 0.83 -0.17 0.00 0.00 0.00 0.00 51.96 52.62 1fui s ALA 51 Cb 0.00 -3.46 -0.06 0.00 0.00 0.00 0.00 23.12 19.59 1fui s ALA 51 CO 0.00 -2.01 1.02 0.00 0.00 0.00 0.00 175.76 174.77 1fui s ALA 52 N -2.10 2.92 -0.06 0.00 0.00 -1.26 -0.64 121.76 120.62 1fui s ALA 52 Ca 0.73 0.31 -0.19 0.00 0.00 0.00 0.00 51.96 52.81 1fui s ALA 52 Cb -0.28 -3.18 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 1fui s ALA 52 CO 0.47 -0.46 0.54 0.08 0.00 0.00 0.00 175.76 176.39 1fui s VAL 53 N -2.49 5.06 -0.10 0.00 1.01 -1.24 -4.73 120.40 117.91 1fui s VAL 53 Ca 0.62 1.11 -0.05 0.00 0.00 0.00 0.00 61.98 63.66 1fui s VAL 53 Cb -0.13 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.34 1fui s VAL 53 CO 0.32 0.37 0.08 -1.61 0.00 0.00 0.00 175.10 174.27 1fui s GLU 54 N 0.21 3.24 0.12 2.72 2.02 -1.26 -4.40 118.70 121.35 1fui s GLU 54 Ca 0.29 -0.26 0.08 0.00 0.02 0.00 0.00 54.97 55.10 1fui s GLU 54 Cb -0.17 -3.02 -0.04 0.00 0.10 0.00 0.00 34.13 31.01 1fui s GLU 54 CO 0.14 0.74 -0.11 0.00 0.02 0.00 0.00 175.26 176.05 1fui s VAL 56 N -1.30 1.59 0.03 0.00 1.01 0.45 -4.91 120.40 117.27 1fui s VAL 56 Ca 0.22 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1fui s VAL 56 Cb -0.11 -1.46 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 1fui s VAL 56 CO 0.13 0.46 0.12 -0.63 0.00 0.00 0.00 175.10 175.18 1fui s ILE 57 N 1.09 4.90 0.48 2.22 1.01 -1.26 -0.26 121.20 129.38 1fui s ILE 57 Ca -0.04 -0.45 -0.24 0.00 0.00 0.00 0.00 60.65 59.92 1fui s ILE 57 Cb -0.14 -3.30 -0.07 0.00 0.01 0.00 0.00 42.46 38.95 1fui s ILE 57 CO -0.04 0.26 1.39 -0.24 0.00 0.00 0.00 174.94 176.31 1fui n SER 58 N 0.83 3.02 0.28 3.58 2.88 -1.02 -4.88 113.62 118.30 1fui n SER 58 Ca -0.10 1.07 0.12 0.00 -1.33 0.00 0.00 58.87 58.63 1fui n SER 58 Cb 0.52 -1.58 0.77 0.00 -0.75 0.00 0.00 64.21 63.17 1fui n SER 58 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 1fui h ASP 59 N 1.99 0.00 -5.54 -3.46 3.32 -1.95 -3.44 116.42 107.34 1fui h ASP 59 Ca -0.50 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.33 1fui h ASP 59 Cb 1.28 0.00 -0.14 0.00 0.22 0.00 0.00 39.33 40.69 1fui h ASP 59 CO 0.60 0.01 -0.56 0.42 -1.72 0.00 0.00 179.24 177.99 1fui s THR 60 N -4.82 0.01 0.53 0.35 -4.23 -1.26 -5.14 115.64 101.07 1fui s THR 60 Ca -0.05 -1.92 -0.20 0.00 -1.18 0.00 0.00 61.69 58.35 1fui s THR 60 Cb 0.16 -2.44 -0.07 0.00 1.34 0.00 0.00 72.50 71.50 1fui s THR 60 CO 0.61 -0.02 1.09 0.00 -0.54 0.00 0.00 174.62 175.76 1fui s ILE 62 N -1.88 4.55 -0.09 0.00 1.01 0.15 -4.92 121.20 120.02 1fui s ILE 62 Ca 0.70 -0.13 0.02 0.00 0.00 0.00 0.00 60.65 61.24 1fui s ILE 62 Cb -0.21 -3.16 -0.02 0.00 0.01 0.00 0.00 42.46 39.08 1fui s ILE 62 CO 0.25 0.29 0.09 0.00 0.00 0.00 0.00 174.94 175.57 1fui n ALA 63 N 4.96 2.25 -3.00 9.38 0.00 -1.26 -0.59 120.51 132.24 1fui n ALA 63 Ca -0.15 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1fui n ALA 63 Cb 0.51 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.90 1fui n ALA 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fui n GLY 64 N 1.02 2.17 0.26 0.00 0.00 -1.26 -4.51 105.19 102.87 1fui n GLY 64 Ca 0.00 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.09 1fui n GLY 64 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1fui h MET 65 N 0.00 0.78 0.07 1.61 0.00 -1.97 -1.18 114.93 114.25 1fui h MET 65 Ca 0.00 -0.35 -0.00 0.00 0.00 0.00 0.00 59.70 59.34 1fui h MET 65 Cb 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 31.60 31.59 1fui h MET 65 CO 0.00 0.98 -0.04 0.00 0.00 0.00 0.00 176.91 177.85 1fui h ALA 66 N 1.00 -0.10 -0.66 6.32 0.00 -1.97 0.25 119.26 124.10 1fui h ALA 66 Ca 0.08 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1fui h ALA 66 Cb 0.83 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1fui h ALA 66 CO 0.07 -0.51 0.15 0.93 0.00 0.00 0.00 179.25 179.89 1fui h GLU 67 N -0.19 1.06 -0.78 0.00 5.08 -1.92 -1.85 114.58 115.99 1fui h GLU 67 Ca -0.01 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1fui h GLU 67 Cb 0.16 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1fui h GLU 67 CO 0.02 0.95 0.47 0.00 -1.00 0.00 0.00 179.01 179.45 1fui h ALA 68 N 1.06 0.99 -0.69 3.43 0.00 -1.01 -1.31 119.26 121.73 1fui h ALA 68 Ca 0.21 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1fui h ALA 68 Cb 0.38 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1fui h ALA 68 CO 0.00 0.45 0.20 0.00 0.00 0.00 0.00 179.25 179.90 1fui h ALA 69 N 1.25 0.91 -0.19 0.00 0.00 -0.65 -0.36 119.26 120.22 1fui h ALA 69 Ca 0.28 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1fui h ALA 69 Cb -0.05 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.46 1fui h ALA 69 CO -0.05 0.60 0.11 0.00 0.00 0.00 0.00 179.25 179.91 1fui h ALA 70 N 1.09 0.24 -0.62 0.00 0.00 -0.80 -1.18 119.26 117.99 1fui h ALA 70 Ca 0.22 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 55.16 1fui h ALA 70 Cb 0.32 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 1fui h ALA 70 CO -0.00 -0.25 0.32 0.00 0.00 0.00 0.00 179.25 179.31 1fui h GLU 72 N 0.58 1.24 -0.61 0.00 4.57 -0.65 -0.51 114.58 119.20 1fui h GLU 72 Ca 0.29 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.34 1fui h GLU 72 Cb 0.23 -0.26 -0.03 0.00 -0.16 0.00 0.00 28.75 28.53 1fui h GLU 72 CO -0.21 0.86 0.31 1.49 -1.18 0.00 0.00 179.01 180.29 1fui h GLU 73 N 1.26 0.87 -0.35 1.92 4.81 -0.30 -1.49 114.58 121.30 1fui h GLU 73 Ca 0.33 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1fui h GLU 73 Cb -0.07 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.13 1fui h GLU 73 CO -0.06 0.68 0.12 -0.22 -0.73 0.00 0.00 179.01 178.79 1fui h LYS 74 N 0.84 0.54 -0.39 1.92 3.64 -0.67 -3.22 116.57 119.22 1fui h LYS 74 Ca 0.21 -0.11 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 1fui h LYS 74 Cb 0.08 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 1fui h LYS 74 CO -0.03 0.56 0.15 0.74 -2.27 0.00 0.00 179.45 178.60 1fui h PHE 75 N 0.41 0.60 0.00 1.91 -1.00 -0.86 -3.10 116.94 114.90 1fui h PHE 75 Ca 0.11 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.84 1fui h PHE 75 Cb 0.24 -0.18 -0.00 0.00 3.61 0.00 0.00 35.95 39.62 1fui h PHE 75 CO 0.01 0.54 -0.03 0.66 -1.61 0.00 0.00 178.31 177.87 1fui h SER 76 N 0.49 0.00 0.23 2.17 4.64 -1.29 -0.57 113.55 119.21 1fui h SER 76 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1fui h SER 76 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1fui h SER 76 CO -0.01 0.03 -0.61 -1.54 -0.87 0.00 0.00 176.83 173.83 1fui n SER 77 N -3.43 0.96 -1.03 4.97 3.41 -1.19 -4.02 113.62 113.29 1fui n SER 77 Ca -0.02 -0.77 0.10 0.00 -0.26 0.00 0.00 58.87 57.92 1fui n SER 77 Cb 0.14 0.50 0.21 0.00 -0.26 0.00 0.00 64.21 64.80 1fui n SER 77 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fui n GLN 78 N -1.15 2.43 -3.60 4.33 1.13 -0.24 -5.00 117.38 115.28 1fui n GLN 78 Ca 0.07 -2.22 -0.22 0.00 -1.94 0.00 0.00 57.00 52.69 1fui n GLN 78 Cb 0.35 -1.45 0.07 0.00 0.11 0.00 0.00 30.24 29.32 1fui n GLN 78 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1fui n ASN 79 N 1.26 -4.30 -4.71 1.08 4.05 -1.08 -4.57 115.26 106.99 1fui n ASN 79 Ca 0.18 -0.63 -0.42 0.00 0.45 0.00 0.00 54.58 54.16 1fui n ASN 79 Cb 0.54 -4.81 -0.03 0.00 1.23 0.00 0.00 39.78 36.71 1fui n ASN 79 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1fui s VAL 80 N -3.37 4.75 -0.81 3.44 -7.23 -1.20 -1.47 120.40 114.51 1fui s VAL 80 Ca 0.36 2.03 0.21 0.00 -1.81 0.00 0.00 61.98 62.77 1fui s VAL 80 Cb -0.16 -4.30 -0.25 0.00 0.56 0.00 0.00 36.38 32.22 1fui s VAL 80 CO 0.75 0.19 0.82 0.61 -0.31 0.00 0.00 175.10 177.17 1fui n GLY 81 N 2.76 -1.00 3.40 2.32 0.00 0.05 -4.82 105.19 107.90 1fui n GLY 81 Ca 0.05 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.36 1fui n GLY 81 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1fui s LEU 82 N -3.30 -0.26 0.09 0.99 -0.00 -1.25 -3.97 118.68 110.99 1fui s LEU 82 Ca 0.05 0.09 0.05 0.00 -0.00 0.00 0.00 54.13 54.31 1fui s LEU 82 Cb 0.16 2.31 -0.03 0.00 -0.00 0.00 0.00 46.19 48.62 1fui s LEU 82 CO 0.88 -0.83 -0.12 0.42 -0.00 0.00 0.00 176.35 176.70 1fui s THR 83 N -3.04 1.06 -0.11 5.48 -4.23 -0.79 -1.39 115.64 112.62 1fui s THR 83 Ca -0.02 -1.53 -0.01 0.00 -1.18 0.00 0.00 61.69 58.95 1fui s THR 83 Cb -0.00 -1.27 0.03 0.00 1.34 0.00 0.00 72.50 72.59 1fui s THR 83 CO -0.07 -0.42 -0.06 -0.63 -0.54 0.00 0.00 174.62 172.90 1fui s ILE 84 N -1.98 0.95 -0.18 2.99 1.01 -0.23 -1.39 121.20 122.37 1fui s ILE 84 Ca 0.03 -0.27 -0.10 0.00 0.00 0.00 0.00 60.65 60.31 1fui s ILE 84 Cb -0.06 -1.00 -0.05 0.00 0.01 0.00 0.00 42.46 41.36 1fui s ILE 84 CO 0.01 0.33 0.17 -0.89 0.00 0.00 0.00 174.94 174.56 1fui s THR 85 N 1.74 5.40 0.08 2.92 2.01 0.08 -0.66 115.64 127.21 1fui s THR 85 Ca 0.05 0.28 0.07 0.00 0.31 0.00 0.00 61.69 62.39 1fui s THR 85 Cb -0.13 -3.50 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 1fui s THR 85 CO -0.08 0.46 -0.19 0.68 -0.69 0.00 0.00 174.62 174.80 1fui s VAL 86 N 0.17 1.55 -0.16 3.82 -7.23 -0.37 -0.25 120.40 117.95 1fui s VAL 86 Ca 0.11 -1.41 -0.30 0.00 -1.81 0.00 0.00 61.98 58.57 1fui s VAL 86 Cb -0.12 -1.41 0.12 0.00 0.56 0.00 0.00 36.38 35.53 1fui s VAL 86 CO 0.00 -0.05 0.95 0.28 -0.31 0.00 0.00 175.10 175.98 1fui s THR 87 N -1.11 0.00 -0.71 5.32 -1.32 -0.95 -1.52 115.64 115.36 1fui s THR 87 Ca 0.05 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 60.63 1fui s THR 87 Cb -0.10 -1.00 0.29 0.00 -1.51 0.00 0.00 72.50 70.18 1fui s THR 87 CO 0.03 0.00 1.24 -0.81 -2.21 0.00 0.00 174.62 172.87 1fui n PRO 88 N 0.91 2.87 -3.83 7.08 -0.04 -1.26 -1.23 135.00 139.51 1fui n PRO 88 Ca -0.12 -2.07 -0.14 0.00 -0.04 0.00 0.00 63.50 61.14 1fui n PRO 88 Cb 0.58 -1.30 -0.03 0.00 -0.04 0.00 0.00 33.50 32.71 1fui n PRO 88 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fui s TRP 90 N -3.06 3.63 0.18 0.00 -0.11 -1.26 -4.35 118.94 113.97 1fui s TRP 90 Ca 0.27 1.73 -0.01 0.00 1.22 0.00 0.00 56.10 59.31 1fui s TRP 90 Cb -0.01 -3.24 -0.04 0.00 -1.50 0.00 0.00 33.47 28.69 1fui s TRP 90 CO 0.20 -0.41 0.12 0.00 -4.62 0.00 0.00 176.95 172.23 1fui s TYR 92 N -4.11 2.95 0.00 0.00 2.02 -1.26 -4.92 117.35 112.02 1fui s TYR 92 Ca 0.33 -1.52 0.00 0.00 -0.37 0.00 0.00 57.07 55.51 1fui s TYR 92 Cb 0.07 -4.56 0.00 0.00 -0.40 0.00 0.00 41.96 37.07 1fui s TYR 92 CO 0.08 -1.69 0.00 0.41 -1.57 0.00 0.00 175.55 172.78 1fui n GLY 93 N 5.47 0.00 0.30 0.71 0.00 -1.26 -1.08 105.19 109.32 1fui n GLY 93 Ca 0.38 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.60 1fui n GLY 93 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1fui h SER 94 N 0.00 0.00 1.82 1.61 4.64 -1.93 -1.83 113.55 117.86 1fui h SER 94 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1fui h SER 94 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1fui h SER 94 CO 0.00 0.00 -0.05 -0.33 -0.87 0.00 0.00 176.83 175.58 1fui h GLU 95 N 0.00 0.00 0.00 4.77 5.08 -1.50 -3.37 114.58 119.56 1fui h GLU 95 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1fui h GLU 95 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1fui h GLU 95 CO 0.00 0.00 -0.67 0.25 -1.00 0.00 0.00 179.01 177.59 1fui n THR 96 N -2.87 0.00 -1.65 1.13 -2.24 -0.73 -3.49 114.28 104.44 1fui n THR 96 Ca 0.04 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.23 1fui n THR 96 Cb 0.51 0.75 0.05 0.00 -2.10 0.00 0.00 70.33 69.54 1fui n THR 96 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1fui s ILE 97 N -1.88 3.42 -0.24 2.28 -4.36 -0.97 -4.97 121.20 114.47 1fui s ILE 97 Ca 0.00 0.59 -0.29 0.00 -0.26 0.00 0.00 60.65 60.69 1fui s ILE 97 Cb 0.04 -3.12 0.01 0.00 1.25 0.00 0.00 42.46 40.64 1fui s ILE 97 CO 0.24 -0.48 1.11 -0.62 0.24 0.00 0.00 174.94 175.43 1fui s ASP 98 N -2.93 7.01 0.00 4.36 -1.08 -1.26 -4.92 116.67 117.85 1fui s ASP 98 Ca 0.64 1.37 0.27 0.00 -0.52 0.00 0.00 52.55 54.31 1fui s ASP 98 Cb -0.18 -2.54 0.83 0.00 -1.46 0.00 0.00 42.92 39.57 1fui s ASP 98 CO 0.46 -0.75 1.61 0.23 0.52 0.00 0.00 175.17 177.24 1fui n MET 99 N 6.55 1.19 -1.73 4.34 2.81 -1.26 -4.92 117.12 124.09 1fui n MET 99 Ca 0.13 -0.72 -0.42 0.00 -1.81 0.00 0.00 57.70 54.88 1fui n MET 99 Cb 0.46 -1.49 -0.03 0.00 -0.71 0.00 0.00 33.22 31.46 1fui n MET 99 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1fui s ASP 100 N -2.30 6.48 0.53 7.83 -1.08 -1.26 -4.88 116.67 121.98 1fui s ASP 100 Ca 0.29 2.62 0.32 0.00 -0.52 0.00 0.00 52.55 55.26 1fui s ASP 100 Cb 0.20 -2.53 1.24 0.00 -1.46 0.00 0.00 42.92 40.36 1fui s ASP 100 CO 0.45 -1.03 1.94 1.55 0.52 0.00 0.00 175.17 178.60 1fui h PRO 101 N 10.21 0.00 0.00 4.34 0.13 -1.98 -3.36 132.00 141.34 1fui h PRO 101 Ca -0.48 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.30 1fui h PRO 101 Cb 1.23 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.29 1fui h PRO 101 CO 0.94 0.02 -2.33 0.25 -0.23 0.00 0.00 178.00 176.66 1fui n THR 102 N -3.12 1.33 -2.48 1.56 -2.24 -1.26 -4.97 114.28 103.10 1fui n THR 102 Ca 0.01 -0.73 -0.38 0.00 -2.27 0.00 0.00 64.05 60.68 1fui n THR 102 Cb 0.34 -0.73 -0.04 0.00 -2.10 0.00 0.00 70.33 67.80 1fui n THR 102 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fui s ARG 103 N -2.47 4.26 0.33 -0.78 1.70 -1.26 -4.98 118.95 115.76 1fui s ARG 103 Ca -0.16 1.65 -0.29 0.00 -0.47 0.00 0.00 55.73 56.46 1fui s ARG 103 Cb 0.06 -2.73 -0.10 0.00 -0.57 0.00 0.00 34.95 31.61 1fui s ARG 103 CO 0.72 -0.09 1.40 -2.14 -1.08 0.00 0.00 175.30 174.11 1fui s PRO 104 N -2.19 4.26 0.02 3.89 0.02 -1.25 -4.89 135.00 134.85 1fui s PRO 104 Ca 0.54 2.35 0.02 0.00 0.02 0.00 0.00 61.00 63.94 1fui s PRO 104 Cb -0.26 -3.05 -0.01 0.00 0.02 0.00 0.00 34.50 31.20 1fui s PRO 104 CO 0.33 -0.35 -0.07 0.15 -0.33 0.00 0.00 177.00 176.73 1fui s LYS 105 N -1.57 0.51 0.05 5.54 1.02 -1.26 -1.88 119.74 122.14 1fui s LYS 105 Ca 0.52 -0.50 0.01 0.00 0.02 0.00 0.00 55.97 56.02 1fui s LYS 105 Cb -0.42 -0.39 -0.03 0.00 -0.52 0.00 0.00 37.83 36.47 1fui s LYS 105 CO 0.54 0.09 -0.05 0.00 -0.92 0.00 0.00 175.35 175.01 1fui s ALA 106 N -0.78 0.49 -0.06 5.17 0.00 -0.48 -1.14 121.76 124.96 1fui s ALA 106 Ca -0.04 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.02 1fui s ALA 106 Cb -0.06 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.23 1fui s ALA 106 CO 0.00 -0.18 -0.06 0.42 0.00 0.00 0.00 175.76 175.94 1fui s ILE 107 N -2.37 0.72 -0.24 0.00 1.01 -0.76 -0.74 121.20 118.81 1fui s ILE 107 Ca -0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 60.65 60.40 1fui s ILE 107 Cb -0.03 -0.73 0.02 0.00 0.01 0.00 0.00 42.46 41.73 1fui s ILE 107 CO -0.03 0.28 -0.07 0.86 0.00 0.00 0.00 174.94 175.97 1fui s TRP 108 N 1.08 3.04 -0.23 3.97 -0.00 0.66 -1.40 118.94 126.07 1fui s TRP 108 Ca -0.08 -1.55 -0.07 0.00 -0.00 0.00 0.00 56.10 54.40 1fui s TRP 108 Cb -0.14 -2.05 -0.03 0.00 -0.00 0.00 0.00 33.47 31.25 1fui s TRP 108 CO -0.01 -0.73 0.05 0.20 -0.00 0.00 0.00 176.95 176.46 1fui s GLY 109 N 1.32 1.76 0.24 5.86 0.00 -1.14 -2.23 107.32 113.14 1fui s GLY 109 Ca 0.01 -1.05 -0.31 0.00 0.00 0.00 0.00 44.72 43.36 1fui s GLY 109 CO -0.05 0.40 1.56 0.33 0.00 0.00 0.00 173.10 175.34 1fui n PHE 110 N 4.58 2.56 -3.02 1.90 7.35 -0.36 -4.36 117.46 126.11 1fui n PHE 110 Ca -0.16 0.27 -0.44 0.00 -0.76 0.00 0.00 57.45 56.35 1fui n PHE 110 Cb 0.52 -2.57 -0.01 0.00 0.35 0.00 0.00 39.48 37.77 1fui n PHE 110 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1fui s ASN 111 N 0.62 6.96 0.31 -2.13 3.84 -1.26 -2.50 114.94 120.78 1fui s ASN 111 Ca 0.69 -2.79 0.03 0.00 0.21 0.00 0.00 52.86 51.00 1fui s ASN 111 Cb -0.57 -2.36 -0.04 0.00 -0.55 0.00 0.00 41.25 37.73 1fui s ASN 111 CO 0.44 -0.76 0.12 -0.83 -2.79 0.00 0.00 177.10 173.28 1fui s GLY 112 N 2.81 2.04 -0.26 1.21 0.00 -1.04 -0.83 107.32 111.25 1fui s GLY 112 Ca 0.37 -1.76 -0.16 0.00 0.00 0.00 0.00 44.72 43.17 1fui s GLY 112 CO -0.04 -1.65 -0.19 -1.30 0.00 0.00 0.00 173.10 169.92 1fui n THR 113 N -0.61 1.53 0.24 0.90 -2.24 -1.26 -3.77 114.28 109.07 1fui n THR 113 Ca -0.01 -0.28 0.13 0.00 -2.27 0.00 0.00 64.05 61.62 1fui n THR 113 Cb 0.66 -1.93 0.44 0.00 -2.10 0.00 0.00 70.33 67.40 1fui n THR 113 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1fui h GLU 114 N -1.00 0.00 -3.11 -0.78 3.07 -1.96 -3.32 114.58 107.49 1fui h GLU 114 Ca -0.60 0.00 -0.67 0.00 -0.50 0.00 0.00 59.36 57.59 1fui h GLU 114 Cb 1.53 0.00 -0.38 0.00 -0.84 0.00 0.00 28.75 29.06 1fui h GLU 114 CO -0.36 0.10 -0.25 0.54 -1.40 0.00 0.00 179.01 177.64 1fui n ARG 115 N -3.19 2.46 -0.82 2.33 5.12 -1.26 -5.00 116.66 116.30 1fui n ARG 115 Ca 0.01 -4.51 -0.16 0.00 -1.93 0.00 0.00 57.85 51.26 1fui n ARG 115 Cb 0.43 -2.36 -0.09 0.00 -1.16 0.00 0.00 32.46 29.28 1fui n ARG 115 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1fui n PRO 116 N 1.99 1.94 0.23 5.56 -0.04 -1.21 -2.50 135.00 140.97 1fui n PRO 116 Ca 0.22 -1.12 0.08 0.00 -0.04 0.00 0.00 63.50 62.64 1fui n PRO 116 Cb 0.37 -2.14 0.55 0.00 -0.04 0.00 0.00 33.50 32.24 1fui n PRO 116 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1fui h GLY 117 N 6.22 0.00 2.00 0.55 0.00 -1.53 -2.34 103.07 107.97 1fui h GLY 117 Ca 0.33 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.57 1fui h GLY 117 CO 0.78 0.00 -0.43 0.00 0.00 0.00 0.00 176.54 176.89 1fui h ALA 118 N 1.79 1.14 -0.48 3.60 0.00 -1.69 -2.20 119.26 121.42 1fui h ALA 118 Ca -0.00 -0.39 -0.11 0.00 0.00 0.00 0.00 54.91 54.41 1fui h ALA 118 Cb 0.44 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1fui h ALA 118 CO 0.03 0.54 -0.14 0.28 0.00 0.00 0.00 179.25 179.95 1fui h VAL 119 N 0.00 1.27 -0.25 0.00 2.07 -1.76 -1.77 116.25 115.82 1fui h VAL 119 Ca -0.00 -1.27 -0.04 0.00 0.82 0.00 0.00 66.70 66.21 1fui h VAL 119 Cb 0.84 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1fui h VAL 119 CO 0.06 0.44 0.00 0.22 0.02 0.00 0.00 177.57 178.31 1fui h TYR 120 N 0.81 0.47 -0.52 1.57 3.20 -1.53 -2.44 116.97 118.53 1fui h TYR 120 Ca 0.12 -0.08 0.09 0.00 3.14 0.00 0.00 58.73 62.00 1fui h TYR 120 Cb 0.68 -0.12 -0.10 0.00 1.54 0.00 0.00 36.73 38.72 1fui h TYR 120 CO 0.04 0.60 -0.37 1.25 -1.64 0.00 0.00 178.16 178.03 1fui h LEU 121 N 0.21 -1.28 -0.99 2.82 6.46 -1.08 0.61 115.31 122.06 1fui h LEU 121 Ca 0.07 0.22 -0.02 0.00 -0.12 0.00 0.00 57.88 58.03 1fui h LEU 121 Cb 0.41 0.60 -0.04 0.00 -0.73 0.00 0.00 40.66 40.90 1fui h LEU 121 CO 0.01 -0.33 0.41 0.00 -0.62 0.00 0.00 178.44 177.92 1fui h ALA 122 N 0.76 1.22 -0.26 1.25 0.00 -1.28 -0.68 119.26 120.26 1fui h ALA 122 Ca 0.19 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 1fui h ALA 122 Cb 0.56 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1fui h ALA 122 CO -0.64 0.61 -0.58 0.00 0.00 0.00 0.00 179.25 178.65 1fui h ALA 123 N 1.32 0.47 -0.41 0.00 0.00 -0.65 -2.29 119.26 117.70 1fui h ALA 123 Ca 0.28 -0.53 -0.11 0.00 0.00 0.00 0.00 54.91 54.55 1fui h ALA 123 Cb 0.07 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1fui h ALA 123 CO -0.04 0.68 -0.17 0.00 0.00 0.00 0.00 179.25 179.72 1fui h ALA 124 N 0.70 0.58 -0.77 0.00 0.00 0.38 -2.20 119.26 117.95 1fui h ALA 124 Ca 0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.51 1fui h ALA 124 Cb 1.19 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1fui h ALA 124 CO 0.13 0.51 0.28 -0.07 0.00 0.00 0.00 179.25 180.10 1fui h LEU 125 N 0.66 1.08 -0.85 0.00 3.38 -1.13 -0.31 115.31 118.14 1fui h LEU 125 Ca 0.10 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1fui h LEU 125 Cb 0.72 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1fui h LEU 125 CO 0.05 0.97 0.55 0.00 0.09 0.00 0.00 178.44 180.11 1fui h ALA 126 N 1.17 1.08 -0.62 1.53 0.00 -1.16 -0.66 119.26 120.61 1fui h ALA 126 Ca 0.25 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 1fui h ALA 126 Cb 0.25 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1fui h ALA 126 CO -0.02 0.51 0.01 0.00 0.00 0.00 0.00 179.25 179.76 1fui h ALA 127 N 1.30 0.83 -0.11 0.00 0.00 -0.81 -0.01 119.26 120.46 1fui h ALA 127 Ca 0.31 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fui h ALA 127 Cb -0.11 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.45 1fui h ALA 127 CO -0.06 0.67 0.07 0.45 0.00 0.00 0.00 179.25 180.37 1fui h HIS 128 N 0.99 0.14 -0.49 0.00 -0.00 -0.32 -1.26 115.15 114.20 1fui h HIS 128 Ca 0.18 0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.46 1fui h HIS 128 Cb 0.55 -0.05 -0.02 0.00 -0.00 0.00 0.00 27.41 27.89 1fui h HIS 128 CO 0.04 0.12 -0.05 0.77 -0.00 0.00 0.00 177.93 178.81 1fui h SER 129 N 0.12 0.85 0.29 2.45 0.02 -1.01 -0.38 113.55 115.88 1fui h SER 129 Ca 0.04 -0.24 -0.08 0.00 -0.84 0.00 0.00 61.79 60.68 1fui h SER 129 Cb 0.02 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.32 1fui h SER 129 CO -0.01 0.94 -0.34 -0.61 -1.14 0.00 0.00 176.83 175.68 1fui h GLN 130 N 0.79 0.08 -0.39 3.45 4.15 -0.80 -2.86 115.11 119.53 1fui h GLN 130 Ca 0.14 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.53 1fui h GLN 130 Cb 0.55 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 28.23 1fui h GLN 130 CO 0.03 0.41 0.00 1.63 -1.93 0.00 0.00 178.83 178.97 1fui n LYS 131 N -4.12 2.32 -1.70 1.69 5.02 -0.49 -4.97 118.16 115.91 1fui n LYS 131 Ca -0.02 -2.00 -0.10 0.00 -2.02 0.00 0.00 58.31 54.17 1fui n LYS 131 Cb 0.39 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.90 1fui n LYS 131 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1fui n GLY 132 N 1.42 0.63 2.77 0.72 0.00 -0.74 -4.99 105.19 105.00 1fui n GLY 132 Ca 0.19 -0.51 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 1fui n GLY 132 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1fui s ILE 133 N -2.44 2.07 0.45 -0.61 -4.36 -0.23 -5.03 121.20 111.05 1fui s ILE 133 Ca 0.00 -3.56 -0.24 0.00 -0.26 0.00 0.00 60.65 56.60 1fui s ILE 133 Cb 0.00 -2.39 -0.09 0.00 1.25 0.00 0.00 42.46 41.23 1fui s ILE 133 CO 0.00 -1.02 1.06 -2.65 0.24 0.00 0.00 174.94 172.58 1fui n PRO 134 N 2.53 1.41 -3.99 0.37 -0.02 -1.26 -4.49 135.00 129.55 1fui n PRO 134 Ca 0.19 0.51 -0.09 0.00 -2.02 0.00 0.00 63.50 62.09 1fui n PRO 134 Cb 0.37 -2.14 -0.11 0.00 -0.02 0.00 0.00 33.50 31.61 1fui n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fui s ALA 135 N -1.29 0.16 0.35 3.55 0.00 -1.26 -4.66 121.76 118.60 1fui s ALA 135 Ca 0.65 -0.68 -0.20 0.00 0.00 0.00 0.00 51.96 51.73 1fui s ALA 135 Cb -0.52 0.18 -0.10 0.00 0.00 0.00 0.00 23.12 22.67 1fui s ALA 135 CO 0.56 -0.21 0.85 -0.06 0.00 0.00 0.00 175.76 176.89 1fui s PHE 136 N -1.98 3.43 -0.13 0.00 0.40 -0.29 -0.82 117.98 118.58 1fui s PHE 136 Ca -0.11 1.48 -0.03 0.00 -0.60 0.00 0.00 56.93 57.67 1fui s PHE 136 Cb -0.06 -2.73 -0.03 0.00 0.51 0.00 0.00 43.02 40.71 1fui s PHE 136 CO -0.03 0.06 -0.04 0.45 0.70 0.00 0.00 175.22 176.37 1fui s SER 137 N -2.05 4.82 -0.36 1.36 0.15 -1.26 -1.83 113.70 114.52 1fui s SER 137 Ca 0.55 -0.08 0.03 0.00 0.70 0.00 0.00 55.95 57.15 1fui s SER 137 Cb -0.12 -1.65 0.11 0.00 -1.71 0.00 0.00 66.02 62.64 1fui s SER 137 CO 0.17 0.22 0.10 -0.63 1.20 0.00 0.00 173.24 174.30 1fui s ILE 138 N 0.04 1.95 -0.13 6.45 1.01 -0.49 -4.95 121.20 125.08 1fui s ILE 138 Ca 0.00 -2.29 0.01 0.00 0.00 0.00 0.00 60.65 58.38 1fui s ILE 138 Cb -0.13 -2.43 0.02 0.00 0.01 0.00 0.00 42.46 39.92 1fui s ILE 138 CO 0.03 -0.66 -0.16 -0.47 0.00 0.00 0.00 174.94 173.67 1fui s TYR 139 N 0.86 2.22 0.59 3.97 5.04 -1.26 -2.91 117.35 125.86 1fui s TYR 139 Ca 0.12 -1.15 -0.15 0.00 -2.44 0.00 0.00 57.07 53.44 1fui s TYR 139 Cb -0.20 -1.59 -0.04 0.00 0.35 0.00 0.00 41.96 40.48 1fui s TYR 139 CO -0.10 -0.59 1.04 0.20 -1.34 0.00 0.00 175.55 174.76 1fui s GLY 140 N 1.15 2.07 -0.03 8.97 0.00 -1.26 -4.90 107.32 113.31 1fui s GLY 140 Ca -0.02 0.32 -0.26 0.00 0.00 0.00 0.00 44.72 44.76 1fui s GLY 140 CO -0.06 0.62 1.21 0.45 0.00 0.00 0.00 173.10 175.33 1fui h HIS 141 N 0.42 0.03 -2.86 1.90 3.86 -1.99 -3.46 115.15 113.06 1fui h HIS 141 Ca -0.47 -0.01 -0.67 0.00 -1.16 0.00 0.00 60.37 58.07 1fui h HIS 141 Cb 1.21 -0.01 -0.09 0.00 1.06 0.00 0.00 27.41 29.59 1fui h HIS 141 CO 0.60 0.57 -0.52 -0.51 0.86 0.00 0.00 177.93 178.93 1fui s ASP 142 N -5.79 6.05 0.32 2.45 1.01 -1.26 -5.08 116.67 114.37 1fui s ASP 142 Ca -0.16 0.35 -0.29 0.00 0.71 0.00 0.00 52.55 53.16 1fui s ASP 142 Cb 0.01 -1.88 -0.11 0.00 1.01 0.00 0.00 42.92 41.95 1fui s ASP 142 CO 0.68 0.38 1.50 -0.69 0.21 0.00 0.00 175.17 177.25 1fui s VAL 143 N -1.04 2.20 0.15 -1.27 1.01 -1.26 -4.87 120.40 115.32 1fui s VAL 143 Ca 0.16 0.19 0.08 0.00 0.00 0.00 0.00 61.98 62.41 1fui s VAL 143 Cb -0.12 -3.12 -0.04 0.00 0.00 0.00 0.00 36.38 33.10 1fui s VAL 143 CO 0.06 0.04 -0.08 -1.10 0.00 0.00 0.00 175.10 174.01 1fui s GLN 144 N -1.23 2.14 0.52 2.72 -0.21 -0.01 -5.02 119.66 118.58 1fui s GLN 144 Ca 0.57 -1.14 -0.18 0.00 0.02 0.00 0.00 55.36 54.63 1fui s GLN 144 Cb -0.46 -2.25 -0.07 0.00 1.00 0.00 0.00 33.01 31.23 1fui s GLN 144 CO 0.54 0.47 1.04 -0.51 -2.12 0.00 0.00 175.29 174.70 1fui s ASP 145 N -2.57 6.20 0.58 5.90 1.01 -1.26 -4.44 116.67 122.09 1fui s ASP 145 Ca 0.24 1.85 0.28 0.00 0.71 0.00 0.00 52.55 55.63 1fui s ASP 145 Cb -0.10 -2.55 1.61 0.00 1.01 0.00 0.00 42.92 42.90 1fui s ASP 145 CO 0.15 -0.88 2.07 0.00 0.21 0.00 0.00 175.17 176.72 1fui h ALA 146 N 1.14 1.88 -0.01 5.23 0.00 -1.99 -1.20 119.26 124.31 1fui h ALA 146 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1fui h ALA 146 Cb 1.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1fui h ALA 146 CO 0.59 -0.35 -0.41 -0.40 0.00 0.00 0.00 179.25 178.67 1fui n ASP 147 N -3.84 1.30 -4.69 0.00 5.68 -1.26 -4.91 116.55 108.83 1fui n ASP 147 Ca 0.03 -1.04 -0.42 0.00 -0.50 0.00 0.00 54.79 52.86 1fui n ASP 147 Cb 0.37 0.33 -0.03 0.00 -1.14 0.00 0.00 41.12 40.65 1fui n ASP 147 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1fui s ASP 148 N -2.58 6.97 0.00 -1.12 -1.08 -0.46 -4.91 116.67 113.49 1fui s ASP 148 Ca 0.20 1.97 0.09 0.00 -0.52 0.00 0.00 52.55 54.28 1fui s ASP 148 Cb 0.18 -2.56 0.09 0.00 -1.46 0.00 0.00 42.92 39.17 1fui s ASP 148 CO 0.58 -0.62 0.83 0.35 0.52 0.00 0.00 175.17 176.83 1fui n THR 149 N 4.52 0.09 -2.20 1.71 -2.24 -1.26 -4.90 114.28 109.99 1fui n THR 149 Ca 0.11 -0.54 -0.32 0.00 -2.27 0.00 0.00 64.05 61.03 1fui n THR 149 Cb 0.45 1.13 -0.01 0.00 -2.10 0.00 0.00 70.33 69.80 1fui n THR 149 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1fui s SER 150 N -0.78 6.36 -0.32 3.42 1.04 -1.26 -5.03 113.70 117.13 1fui s SER 150 Ca 0.11 1.58 -0.11 0.00 0.48 0.00 0.00 55.95 58.01 1fui s SER 150 Cb 0.08 -2.50 -0.01 0.00 0.10 0.00 0.00 66.02 63.68 1fui s SER 150 CO 0.12 -0.77 0.18 -0.63 0.98 0.00 0.00 173.24 173.12 1fui s ILE 151 N -2.73 4.86 0.71 -1.02 1.01 -1.26 -5.08 121.20 117.68 1fui s ILE 151 Ca 0.59 -0.31 -0.16 0.00 0.00 0.00 0.00 60.65 60.77 1fui s ILE 151 Cb -0.11 -3.47 0.02 0.00 0.01 0.00 0.00 42.46 38.91 1fui s ILE 151 CO 0.38 0.06 1.20 -2.65 0.00 0.00 0.00 174.94 173.93 1fui n PRO 152 N 5.03 0.71 -0.33 2.79 -0.02 -1.26 -4.74 135.00 137.18 1fui n PRO 152 Ca -0.14 0.31 0.03 0.00 -2.02 0.00 0.00 63.50 61.68 1fui n PRO 152 Cb 0.50 -2.43 0.17 0.00 -0.02 0.00 0.00 33.50 31.71 1fui n PRO 152 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fui h ALA 153 N -0.05 1.29 -0.45 3.55 0.00 -1.98 0.53 119.26 122.15 1fui h ALA 153 Ca -0.49 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.33 1fui h ALA 153 Cb 1.33 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1fui h ALA 153 CO 0.50 0.25 -0.13 0.38 0.00 0.00 0.00 179.25 180.24 1fui h ASP 154 N 0.96 0.82 -0.39 0.00 2.03 -2.00 -1.49 116.42 116.36 1fui h ASP 154 Ca 0.42 -0.26 -0.12 0.00 -0.73 0.00 0.00 57.03 56.33 1fui h ASP 154 Cb 0.29 -0.22 -0.01 0.00 -0.83 0.00 0.00 39.33 38.56 1fui h ASP 154 CO -0.21 0.96 -0.24 0.58 -1.03 0.00 0.00 179.24 179.30 1fui h VAL 155 N 0.74 1.28 -0.61 4.15 2.07 -1.68 -2.72 116.25 119.48 1fui h VAL 155 Ca 0.12 -1.39 -0.00 0.00 0.82 0.00 0.00 66.70 66.24 1fui h VAL 155 Cb 0.63 1.33 -0.03 0.00 -1.52 0.00 0.00 31.29 31.70 1fui h VAL 155 CO 0.04 0.46 0.37 -0.08 0.02 0.00 0.00 177.57 178.38 1fui h GLU 156 N 0.66 0.83 -0.29 1.57 4.81 -0.76 -1.39 114.58 120.01 1fui h GLU 156 Ca 0.08 -0.08 0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1fui h GLU 156 Cb 0.81 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.00 1fui h GLU 156 CO 0.07 0.60 0.18 1.49 -0.73 0.00 0.00 179.01 180.61 1fui h GLU 157 N 0.82 0.35 -0.64 1.92 4.81 -1.15 -0.83 114.58 119.87 1fui h GLU 157 Ca 0.22 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.36 1fui h GLU 157 Cb -0.02 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 1fui h GLU 157 CO -0.04 0.23 0.15 0.87 -0.73 0.00 0.00 179.01 179.50 1fui h LYS 158 N 0.36 1.02 -0.31 1.92 1.57 -1.30 -0.32 116.57 119.51 1fui h LYS 158 Ca 0.11 -0.25 0.01 0.00 -1.87 0.00 0.00 60.65 58.65 1fui h LYS 158 Cb -0.02 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.14 1fui h LYS 158 CO -0.04 0.92 0.20 -0.07 -0.57 0.00 0.00 179.45 179.89 1fui h LEU 159 N 0.94 0.34 -0.54 2.94 3.38 -1.00 0.14 115.31 121.50 1fui h LEU 159 Ca 0.20 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 58.04 1fui h LEU 159 Cb 0.36 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1fui h LEU 159 CO 0.00 0.25 -0.15 -0.07 0.09 0.00 0.00 178.44 178.56 1fui h LEU 160 N 0.41 1.04 -0.45 1.67 3.38 -0.97 -1.03 115.31 119.35 1fui h LEU 160 Ca 0.12 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.67 1fui h LEU 160 Cb -0.03 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.41 1fui h LEU 160 CO -0.03 1.17 0.09 -0.09 0.09 0.00 0.00 178.44 179.66 1fui h ARG 161 N 0.91 0.74 -0.24 1.13 2.43 -0.80 -0.02 114.38 118.52 1fui h ARG 161 Ca 0.13 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1fui h ARG 161 Cb 0.72 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.17 1fui h ARG 161 CO 0.06 0.75 0.12 0.35 -1.51 0.00 0.00 179.97 179.73 1fui h PHE 162 N 0.61 0.34 -0.48 2.20 3.57 -0.86 -2.31 116.94 120.00 1fui h PHE 162 Ca 0.14 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.56 1fui h PHE 162 Cb 0.35 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 1fui h PHE 162 CO 0.02 0.32 0.03 0.00 -2.23 0.00 0.00 178.31 176.45 1fui h ALA 163 N 0.99 0.65 -0.11 2.41 0.00 -1.02 0.87 119.26 123.04 1fui h ALA 163 Ca 0.08 -0.26 0.01 0.00 0.00 0.00 0.00 54.91 54.74 1fui h ALA 163 Cb 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1fui h ALA 163 CO -0.01 0.42 0.03 -0.09 0.00 0.00 0.00 179.25 179.60 1fui h ARG 164 N 0.69 0.08 -0.25 0.00 2.43 -0.96 0.27 114.38 116.64 1fui h ARG 164 Ca 0.14 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.28 1fui h ARG 164 Cb 0.46 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1fui h ARG 164 CO 0.02 0.05 0.05 0.00 -1.51 0.00 0.00 179.97 178.58 1fui h ALA 165 N 1.07 0.33 -0.79 2.80 0.00 -1.39 -2.22 119.26 119.07 1fui h ALA 165 Ca 0.05 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.84 1fui h ALA 165 Cb 0.03 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 1fui h ALA 165 CO -0.06 0.00 0.48 0.78 0.00 0.00 0.00 179.25 180.46 1fui h GLY 166 N 0.22 1.18 1.13 0.00 0.00 -0.55 -1.32 103.07 103.73 1fui h GLY 166 Ca 0.08 -0.35 -0.09 0.00 0.00 0.00 0.00 47.33 46.96 1fui h GLY 166 CO 0.00 0.24 0.01 1.41 0.00 0.00 0.00 176.54 178.20 1fui h LEU 167 N 0.89 1.02 -0.43 3.11 3.38 -0.32 -1.53 115.31 121.44 1fui h LEU 167 Ca 0.34 -0.28 0.04 0.00 0.09 0.00 0.00 57.88 58.07 1fui h LEU 167 Cb 0.15 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.59 1fui h LEU 167 CO -0.16 1.07 0.20 0.00 0.09 0.00 0.00 178.44 179.63 1fui h ALA 168 N 1.04 0.53 0.22 1.53 0.00 -0.71 0.96 119.26 122.83 1fui h ALA 168 Ca 0.17 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 1fui h ALA 168 Cb 0.54 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1fui h ALA 168 CO 0.03 -0.16 -0.17 0.28 0.00 0.00 0.00 179.25 179.22 1fui h VAL 169 N 0.40 0.62 -0.06 0.00 2.07 -0.97 -2.67 116.25 115.65 1fui h VAL 169 Ca 0.19 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.70 1fui h VAL 169 Cb 0.11 0.62 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1fui h VAL 169 CO -0.14 0.00 0.02 0.00 0.02 0.00 0.00 177.57 177.46 1fui h ALA 170 N 0.34 1.92 0.00 1.67 0.00 -0.81 -2.75 119.26 119.63 1fui h ALA 170 Ca -0.01 -0.02 -0.15 0.00 0.00 0.00 0.00 54.91 54.73 1fui h ALA 170 Cb 0.36 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1fui h ALA 170 CO -0.01 0.06 -0.71 0.77 0.00 0.00 0.00 179.25 179.36 1fui h SER 171 N 0.08 0.00 0.13 0.00 0.02 -0.49 -3.24 113.55 110.04 1fui h SER 171 Ca 0.02 0.00 -0.24 0.00 -0.84 0.00 0.00 61.79 60.73 1fui h SER 171 Cb 0.03 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.58 1fui h SER 171 CO -0.00 0.71 -0.94 0.24 -1.14 0.00 0.00 176.83 175.70 1fui h MET 172 N 0.00 0.58 -6.10 3.45 2.86 -1.26 -3.44 114.93 111.03 1fui h MET 172 Ca -0.01 -0.58 -0.77 0.00 -2.06 0.00 0.00 59.70 56.28 1fui h MET 172 Cb 1.33 0.16 0.01 0.00 0.06 0.00 0.00 31.60 33.16 1fui h MET 172 CO 0.09 1.20 0.90 1.17 1.06 0.00 0.00 176.91 181.33 1fui n LYS 173 N -3.82 0.88 0.00 1.72 4.81 -1.17 -1.14 118.16 119.43 1fui n LYS 173 Ca -0.08 0.32 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1fui n LYS 173 Cb 0.83 -1.98 0.00 0.00 0.02 0.00 0.00 35.03 33.90 1fui n LYS 173 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fui n GLY 174 N 4.38 1.99 3.92 3.14 0.00 0.49 -4.99 105.19 114.13 1fui n GLY 174 Ca 0.29 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.05 1fui n GLY 174 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fui s LYS 175 N -0.52 2.51 0.25 1.61 -0.14 -0.29 -4.74 119.74 118.42 1fui s LYS 175 Ca 0.00 -0.13 0.07 0.00 -1.36 0.00 0.00 55.97 54.55 1fui s LYS 175 Cb 0.00 -2.21 -0.04 0.00 -1.68 0.00 0.00 37.83 33.91 1fui s LYS 175 CO 0.00 -1.01 0.20 -1.12 -0.76 0.00 0.00 175.35 172.66 1fui s SER 176 N -4.43 5.54 -0.14 2.83 0.01 -0.75 -1.19 113.70 115.57 1fui s SER 176 Ca 0.58 -0.24 -0.00 0.00 1.31 0.00 0.00 55.95 57.59 1fui s SER 176 Cb -0.11 -1.42 -0.01 0.00 0.21 0.00 0.00 66.02 64.70 1fui s SER 176 CO 0.45 -0.04 -0.13 -0.47 0.41 0.00 0.00 173.24 173.46 1fui s TYR 177 N -2.13 2.81 -0.40 2.43 5.04 0.22 -1.41 117.35 123.90 1fui s TYR 177 Ca 0.33 -0.77 -0.15 0.00 -2.44 0.00 0.00 57.07 54.03 1fui s TYR 177 Cb -0.08 -1.87 0.01 0.00 0.35 0.00 0.00 41.96 40.38 1fui s TYR 177 CO 0.25 -0.30 0.34 -1.17 -1.34 0.00 0.00 175.55 173.33 1fui s LEU 178 N 0.53 4.92 -0.63 6.97 2.96 -0.13 -1.26 118.68 132.04 1fui s LEU 178 Ca -0.09 -0.73 -0.20 0.00 -0.22 0.00 0.00 54.13 52.89 1fui s LEU 178 Cb -0.16 -2.24 0.09 0.00 0.50 0.00 0.00 46.19 44.39 1fui s LEU 178 CO 0.04 -0.46 0.82 -0.55 -1.32 0.00 0.00 176.35 174.89 1fui s SER 179 N 1.73 6.20 -0.73 3.68 0.15 0.07 -0.93 113.70 123.86 1fui s SER 179 Ca 0.08 -1.30 -0.19 0.00 0.70 0.00 0.00 55.95 55.24 1fui s SER 179 Cb -0.18 -2.35 0.12 0.00 -1.71 0.00 0.00 66.02 61.90 1fui s SER 179 CO 0.11 -1.24 0.87 -0.22 1.20 0.00 0.00 173.24 173.97 1fui s LEU 180 N 3.20 5.31 0.00 3.45 0.20 -0.21 -0.99 118.68 129.64 1fui s LEU 180 Ca 0.16 -1.70 0.00 0.00 0.69 0.00 0.00 54.13 53.29 1fui s LEU 180 Cb -0.20 -2.34 0.00 0.00 -0.43 0.00 0.00 46.19 43.22 1fui s LEU 180 CO 0.07 -1.09 0.00 0.61 -0.29 0.00 0.00 176.35 175.65 1fui n GLY 181 N 5.18 -1.09 0.00 7.98 0.00 0.86 -1.09 105.19 117.03 1fui n GLY 181 Ca 0.04 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.91 1fui n GLY 181 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fui n GLY 182 N -0.01 2.16 3.72 -0.02 0.00 -1.26 -4.71 105.19 105.06 1fui n GLY 182 Ca 0.00 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 1fui n GLY 182 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fui s VAL 183 N 2.94 4.88 -0.38 1.61 1.01 -1.25 -4.77 120.40 124.45 1fui s VAL 183 Ca 0.00 1.82 -0.12 0.00 0.00 0.00 0.00 61.98 63.69 1fui s VAL 183 Cb 0.00 -4.21 0.02 0.00 0.00 0.00 0.00 36.38 32.19 1fui s VAL 183 CO 0.00 0.22 0.22 -0.55 0.00 0.00 0.00 175.10 175.00 1fui s SER 184 N 0.74 5.80 -1.52 3.32 0.15 -1.26 -4.71 113.70 116.22 1fui s SER 184 Ca 0.46 -0.94 -0.05 0.00 0.70 0.00 0.00 55.95 56.12 1fui s SER 184 Cb -0.20 -2.05 0.04 0.00 -1.71 0.00 0.00 66.02 62.10 1fui s SER 184 CO 0.25 -0.38 0.40 0.23 1.20 0.00 0.00 173.24 174.93 1fui n MET 185 N 5.03 -2.58 -1.62 5.44 2.81 -1.26 -1.76 117.12 123.18 1fui n MET 185 Ca -0.12 0.31 -0.20 0.00 -1.81 0.00 0.00 57.70 55.88 1fui n MET 185 Cb 0.46 -4.43 -0.08 0.00 -0.71 0.00 0.00 33.22 28.47 1fui n MET 185 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1fui n GLY 186 N -1.97 1.78 3.65 3.03 0.00 -1.26 -4.94 105.19 105.48 1fui n GLY 186 Ca -0.22 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1fui n GLY 186 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fui s ILE 187 N -2.75 4.31 0.25 -0.61 1.01 -0.72 -4.93 121.20 117.76 1fui s ILE 187 Ca 0.00 1.56 -0.06 0.00 0.00 0.00 0.00 60.65 62.15 1fui s ILE 187 Cb 0.00 -4.08 0.28 0.00 0.01 0.00 0.00 42.46 38.66 1fui s ILE 187 CO 0.00 -0.22 1.64 0.00 0.00 0.00 0.00 174.94 176.36 1fui h ALA 188 N 8.34 0.86 0.00 9.38 0.00 -1.92 0.15 119.26 136.06 1fui h ALA 188 Ca -0.25 0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1fui h ALA 188 Cb 1.09 0.39 -0.00 0.00 0.00 0.00 0.00 17.79 19.28 1fui h ALA 188 CO 0.99 -0.42 -0.01 0.78 0.00 0.00 0.00 179.25 180.58 1fui h GLY 189 N 0.13 0.00 0.39 0.00 0.00 -1.93 -1.50 103.07 100.15 1fui h GLY 189 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 1fui h GLY 189 CO -0.65 0.00 -0.03 -1.14 0.00 0.00 0.00 176.54 174.72 1fui n SER 190 N -3.14 0.72 -4.41 0.19 3.41 0.52 -2.03 113.62 108.87 1fui n SER 190 Ca -0.01 -1.09 -0.45 0.00 -0.26 0.00 0.00 58.87 57.06 1fui n SER 190 Cb 0.18 -0.01 -0.01 0.00 -0.26 0.00 0.00 64.21 64.10 1fui n SER 190 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1fui s ILE 191 N -2.12 5.22 0.05 -1.33 1.01 -0.57 -3.82 121.20 119.63 1fui s ILE 191 Ca 0.39 -2.40 -0.33 0.00 0.00 0.00 0.00 60.65 58.31 1fui s ILE 191 Cb 0.21 -4.73 -0.12 0.00 0.01 0.00 0.00 42.46 37.83 1fui s ILE 191 CO 0.38 -1.40 1.81 0.52 0.00 0.00 0.00 174.94 176.26 1fui n VAL 192 N 4.44 0.41 -3.08 2.92 0.31 -1.26 -4.95 118.33 117.12 1fui n VAL 192 Ca 0.26 -0.07 -0.45 0.00 -0.01 0.00 0.00 64.34 64.07 1fui n VAL 192 Cb 0.45 -1.94 -0.04 0.00 -0.91 0.00 0.00 33.84 31.40 1fui n VAL 192 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1fui s ASP 193 N 3.01 6.25 0.26 4.52 -1.08 -1.26 -4.93 116.67 123.43 1fui s ASP 193 Ca 0.86 -1.51 -0.04 0.00 -0.52 0.00 0.00 52.55 51.34 1fui s ASP 193 Cb -0.59 -2.32 0.36 0.00 -1.46 0.00 0.00 42.92 38.91 1fui s ASP 193 CO 0.43 -1.12 1.88 0.45 0.52 0.00 0.00 175.17 177.33 1fui h HIS 194 N 9.13 1.17 -0.34 -5.34 3.86 -2.01 -2.22 115.15 119.40 1fui h HIS 194 Ca -0.24 0.03 -0.04 0.00 -1.16 0.00 0.00 60.37 58.96 1fui h HIS 194 Cb 1.08 -0.38 -0.02 0.00 1.06 0.00 0.00 27.41 29.15 1fui h HIS 194 CO 0.89 0.63 0.02 -0.97 0.86 0.00 0.00 177.93 179.36 1fui h ASN 195 N 1.17 0.48 -0.22 2.45 -1.24 -1.98 -1.76 115.58 114.48 1fui h ASN 195 Ca 0.41 -0.08 -0.02 0.00 0.71 0.00 0.00 56.30 57.32 1fui h ASN 195 Cb 0.10 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 1fui h ASN 195 CO -0.15 0.53 0.07 0.15 -1.29 0.00 0.00 177.43 176.75 1fui h PHE 196 N 0.50 0.35 -0.47 0.67 3.57 -1.82 0.73 116.94 120.47 1fui h PHE 196 Ca 0.11 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.57 1fui h PHE 196 Cb 0.29 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1fui h PHE 196 CO 0.01 0.41 0.26 0.74 -2.23 0.00 0.00 178.31 177.49 1fui h PHE 197 N 0.19 0.64 -0.02 0.41 0.04 -1.40 -1.52 116.94 115.29 1fui h PHE 197 Ca 0.07 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.82 1fui h PHE 197 Cb 0.22 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.16 1fui h PHE 197 CO -0.00 0.48 -0.02 0.93 -0.60 0.00 0.00 178.31 179.10 1fui h GLU 198 N 0.62 0.05 0.04 1.51 5.08 -1.24 -0.11 114.58 120.53 1fui h GLU 198 Ca 0.16 -0.03 -0.22 0.00 -1.00 0.00 0.00 59.36 58.28 1fui h GLU 198 Cb 0.05 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.32 1fui h GLU 198 CO -0.03 0.54 -0.89 0.77 -1.00 0.00 0.00 179.01 178.41 1fui h SER 199 N -0.44 0.70 0.13 1.42 0.02 -0.87 -2.80 113.55 111.70 1fui h SER 199 Ca 0.00 -0.79 -0.30 0.00 -0.84 0.00 0.00 61.79 59.86 1fui h SER 199 Cb 0.53 -0.22 -0.00 0.00 0.14 0.00 0.00 62.40 62.85 1fui h SER 199 CO 0.01 1.41 -1.51 -0.50 -1.14 0.00 0.00 176.83 175.09 1fui h TRP 200 N 0.07 0.49 0.00 3.45 6.55 -1.43 -1.67 115.95 123.41 1fui h TRP 200 Ca -0.12 -0.36 0.00 0.00 0.95 0.00 0.00 58.89 59.36 1fui h TRP 200 Cb 1.59 -0.02 0.00 0.00 -0.86 0.00 0.00 29.16 29.87 1fui h TRP 200 CO 0.14 1.59 -1.25 1.28 -1.05 0.00 0.00 178.44 179.15 1fui n LEU 201 N -3.84 0.69 -0.91 -4.49 4.77 -1.02 -4.49 117.00 107.72 1fui n LEU 201 Ca -0.25 -0.36 -0.10 0.00 -0.03 0.00 0.00 56.01 55.27 1fui n LEU 201 Cb 0.94 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 42.01 1fui n LEU 201 CO 0.43 0.17 -0.11 0.61 -1.33 0.00 0.00 177.39 177.17 1fui n GLY 202 N 1.43 0.55 3.89 -0.72 0.00 -0.41 -3.92 105.19 106.00 1fui n GLY 202 Ca 0.02 -0.54 -0.20 0.00 0.00 0.00 0.00 46.02 45.29 1fui n GLY 202 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fui s MET 203 N -3.64 2.57 0.27 1.61 1.00 -0.19 -0.38 119.30 120.55 1fui s MET 203 Ca 0.00 -1.50 0.11 0.00 0.00 0.00 0.00 55.69 54.30 1fui s MET 203 Cb 0.00 -2.42 -0.05 0.00 0.00 0.00 0.00 34.83 32.37 1fui s MET 203 CO 0.00 -0.19 -0.14 0.15 0.00 0.00 0.00 175.02 174.84 1fui s LYS 204 N -4.15 1.87 -0.10 2.03 1.02 -0.33 -3.03 119.74 117.06 1fui s LYS 204 Ca 0.48 -1.64 0.04 0.00 0.02 0.00 0.00 55.97 54.87 1fui s LYS 204 Cb -0.04 -1.90 -0.00 0.00 -0.52 0.00 0.00 37.83 35.37 1fui s LYS 204 CO 0.28 0.35 -0.22 0.08 -0.92 0.00 0.00 175.35 174.91 1fui s VAL 205 N -2.41 2.21 -0.21 3.17 1.01 -1.26 -0.61 120.40 122.29 1fui s VAL 205 Ca 0.30 -0.97 -0.03 0.00 0.00 0.00 0.00 61.98 61.28 1fui s VAL 205 Cb -0.06 -1.85 0.00 0.00 0.00 0.00 0.00 36.38 34.47 1fui s VAL 205 CO 0.16 0.56 -0.08 -1.58 0.00 0.00 0.00 175.10 174.16 1fui s GLN 206 N 0.30 3.24 -0.17 2.72 2.00 -0.39 -4.93 119.66 122.43 1fui s GLN 206 Ca -0.17 -0.70 -0.08 0.00 -2.00 0.00 0.00 55.36 52.41 1fui s GLN 206 Cb -0.17 -2.92 -0.04 0.00 0.80 0.00 0.00 33.01 30.68 1fui s GLN 206 CO 0.08 -0.22 0.11 0.00 -0.50 0.00 0.00 175.29 174.76 1fui s ALA 207 N 1.43 3.65 -0.05 1.58 0.00 -1.26 -0.75 121.76 126.34 1fui s ALA 207 Ca 0.05 -0.70 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1fui s ALA 207 Cb -0.14 -2.03 0.02 0.00 0.00 0.00 0.00 23.12 20.97 1fui s ALA 207 CO -0.05 0.29 -0.03 0.08 0.00 0.00 0.00 175.76 176.05 1fui s VAL 208 N -0.02 0.48 0.52 0.00 1.01 -0.17 -4.97 120.40 117.25 1fui s VAL 208 Ca 0.09 -0.05 -0.20 0.00 0.00 0.00 0.00 61.98 61.82 1fui s VAL 208 Cb -0.12 -0.54 -0.07 0.00 0.00 0.00 0.00 36.38 35.66 1fui s VAL 208 CO 0.00 0.23 1.10 -0.62 0.00 0.00 0.00 175.10 175.81 1fui s ASP 209 N 1.19 5.96 0.35 3.32 2.15 -1.26 -0.10 116.67 128.29 1fui s ASP 209 Ca -0.07 2.10 0.26 0.00 0.43 0.00 0.00 52.55 55.27 1fui s ASP 209 Cb -0.14 -2.58 1.23 0.00 -0.30 0.00 0.00 42.92 41.13 1fui s ASP 209 CO -0.02 -1.05 1.78 0.24 -0.17 0.00 0.00 175.17 175.96 1fui h MET 210 N 1.38 0.00 0.00 4.34 2.86 -1.92 -1.96 114.93 119.63 1fui h MET 210 Ca -0.50 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.14 1fui h MET 210 Cb 1.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.91 1fui h MET 210 CO 0.58 0.00 0.00 1.79 1.06 0.00 0.00 176.91 180.34 1fui h THR 211 N 0.00 0.00 -0.24 2.22 1.35 -2.00 -1.55 112.91 112.69 1fui h THR 211 Ca 0.00 -0.20 -0.14 0.00 -0.55 0.00 0.00 66.41 65.52 1fui h THR 211 Cb 0.21 1.13 -0.01 0.00 -1.73 0.00 0.00 68.15 67.75 1fui h THR 211 CO 0.00 0.00 -0.43 -0.08 -0.25 0.00 0.00 175.52 174.76 1fui h GLU 212 N 0.00 0.59 -0.37 4.72 4.57 -1.73 -0.24 114.58 122.12 1fui h GLU 212 Ca 0.00 -0.32 -0.11 0.00 -1.18 0.00 0.00 59.36 57.75 1fui h GLU 212 Cb 0.21 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.80 1fui h GLU 212 CO 0.00 0.91 -0.21 1.25 -1.18 0.00 0.00 179.01 179.78 1fui h LEU 213 N 0.48 0.83 -1.03 1.64 6.46 -1.48 -1.76 115.31 120.46 1fui h LEU 213 Ca 0.04 -0.42 0.00 0.00 -0.12 0.00 0.00 57.88 57.38 1fui h LEU 213 Cb 0.94 -0.23 -0.05 0.00 -0.73 0.00 0.00 40.66 40.60 1fui h LEU 213 CO 0.08 1.07 0.61 -0.09 -0.62 0.00 0.00 178.44 179.49 1fui h ARG 214 N 0.59 1.26 -0.32 1.25 9.65 -1.33 -2.18 114.38 123.32 1fui h ARG 214 Ca 0.08 -0.09 -0.03 0.00 -1.10 0.00 0.00 59.98 58.83 1fui h ARG 214 Cb 0.77 -0.28 -0.01 0.00 -1.39 0.00 0.00 29.97 29.06 1fui h ARG 214 CO 0.06 0.85 0.06 -0.09 2.80 0.00 0.00 179.97 183.66 1fui h ARG 215 N 1.30 0.51 -0.93 0.20 2.43 -0.67 -0.52 114.38 116.69 1fui h ARG 215 Ca 0.35 -0.13 0.01 0.00 -0.81 0.00 0.00 59.98 59.40 1fui h ARG 215 Cb -0.12 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.32 1fui h ARG 215 CO -0.07 0.59 0.62 0.00 -1.51 0.00 0.00 179.97 179.60 1fui h ARG 216 N 0.35 1.22 0.06 0.20 2.47 -1.10 0.83 114.38 118.41 1fui h ARG 216 Ca 0.10 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.74 1fui h ARG 216 Cb 0.32 -0.27 0.00 0.00 -1.65 0.00 0.00 29.97 28.36 1fui h ARG 216 CO 0.00 0.81 -0.03 0.82 0.56 0.00 0.00 179.97 182.13 1fui h ILE 217 N 1.26 1.23 -0.15 2.04 2.04 -1.21 0.87 117.51 123.58 1fui h ILE 217 Ca 0.34 -1.05 -0.08 0.00 1.00 0.00 0.00 64.86 65.07 1fui h ILE 217 Cb -0.13 1.91 -0.01 0.00 -0.74 0.00 0.00 36.82 37.85 1fui h ILE 217 CO -0.08 0.26 -0.28 0.44 0.00 0.00 0.00 178.15 178.49 1fui h ASP 218 N -0.55 0.28 -0.56 1.72 3.32 -1.01 -2.94 116.42 116.67 1fui h ASP 218 Ca -0.01 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.95 1fui h ASP 218 Cb 0.48 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.96 1fui h ASP 218 CO 0.01 0.56 0.00 0.00 -1.72 0.00 0.00 179.24 178.09 1fui n GLN 219 N -4.13 3.57 -3.18 3.56 6.02 0.28 -4.94 117.38 118.56 1fui n GLN 219 Ca -0.01 -2.55 -0.23 0.00 -0.01 0.00 0.00 57.00 54.20 1fui n GLN 219 Cb 0.39 -1.88 0.02 0.00 1.02 0.00 0.00 30.24 29.79 1fui n GLN 219 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1fui n LYS 220 N 0.91 -4.32 -1.80 -1.09 4.01 -1.05 -4.85 118.16 109.97 1fui n LYS 220 Ca 0.23 0.72 -0.40 0.00 -0.51 0.00 0.00 58.31 58.35 1fui n LYS 220 Cb 0.84 -5.52 -0.01 0.00 -0.51 0.00 0.00 35.03 29.84 1fui n LYS 220 CO 0.00 0.00 0.00 -0.89 -1.11 0.00 0.00 177.40 175.40 1fui n ILE 221 N -4.27 4.72 -3.95 -0.18 5.41 0.27 -4.82 119.36 116.55 1fui n ILE 221 Ca -0.07 -3.70 -0.09 0.00 1.00 0.00 0.00 62.75 59.90 1fui n ILE 221 Cb 0.58 -2.32 -0.04 0.00 -0.71 0.00 0.00 39.64 37.15 1fui n ILE 221 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 1fui s TYR 222 N 0.38 0.19 -0.69 1.39 -0.85 -1.26 -4.83 117.35 111.68 1fui s TYR 222 Ca 0.57 -0.57 -0.26 0.00 -0.52 0.00 0.00 57.07 56.29 1fui s TYR 222 Cb 0.17 0.34 0.04 0.00 0.38 0.00 0.00 41.96 42.89 1fui s TYR 222 CO -0.07 -1.05 1.17 0.34 -1.52 0.00 0.00 175.55 174.42 1fui s ASP 223 N -2.98 6.21 0.42 -0.18 -1.08 -1.26 -4.91 116.67 112.89 1fui s ASP 223 Ca 0.19 -0.49 0.09 0.00 -0.52 0.00 0.00 52.55 51.81 1fui s ASP 223 Cb -0.02 -2.52 0.91 0.00 -1.46 0.00 0.00 42.92 39.83 1fui s ASP 223 CO 0.08 -1.66 2.05 -0.33 0.52 0.00 0.00 175.17 175.83 1fui h GLU 224 N 9.81 0.50 -0.16 4.34 5.08 -2.00 -0.99 114.58 131.16 1fui h GLU 224 Ca -0.28 -0.03 -0.15 0.00 -1.00 0.00 0.00 59.36 57.91 1fui h GLU 224 Cb 1.06 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.19 1fui h GLU 224 CO 1.23 0.33 -0.52 0.00 -1.00 0.00 0.00 179.01 179.05 1fui h ALA 225 N 1.74 0.81 -0.46 3.43 0.00 -2.00 -2.60 119.26 120.17 1fui h ALA 225 Ca 0.17 -0.50 -0.12 0.00 0.00 0.00 0.00 54.91 54.47 1fui h ALA 225 Cb 0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1fui h ALA 225 CO -0.04 0.68 -0.19 1.49 0.00 0.00 0.00 179.25 181.19 1fui h GLU 226 N 0.35 0.92 0.12 0.00 4.81 -1.62 -2.73 114.58 116.43 1fui h GLU 226 Ca 0.01 -0.37 0.01 0.00 -0.13 0.00 0.00 59.36 58.89 1fui h GLU 226 Cb 1.03 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 1fui h GLU 226 CO 0.09 1.02 -0.22 1.25 -0.73 0.00 0.00 179.01 180.42 1fui h LEU 227 N 0.80 -0.63 -1.33 1.64 5.85 -1.05 0.54 115.31 121.14 1fui h LEU 227 Ca 0.11 0.07 0.17 0.00 0.84 0.00 0.00 57.88 59.08 1fui h LEU 227 Cb 0.74 0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.93 1fui h LEU 227 CO 0.06 -0.31 0.59 -0.33 -0.34 0.00 0.00 178.44 178.10 1fui h GLU 228 N -0.42 0.58 -0.13 1.25 5.08 -1.38 -0.10 114.58 119.46 1fui h GLU 228 Ca 0.02 -0.03 -0.17 0.00 -1.00 0.00 0.00 59.36 58.18 1fui h GLU 228 Cb 0.44 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.55 1fui h GLU 228 CO -0.12 0.38 -0.62 1.98 -1.00 0.00 0.00 179.01 179.64 1fui h MET 229 N 0.59 0.46 -0.33 2.33 4.05 -1.00 -2.39 114.93 118.64 1fui h MET 229 Ca 0.47 -0.32 -0.10 0.00 -0.28 0.00 0.00 59.70 59.48 1fui h MET 229 Cb 0.91 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.75 1fui h MET 229 CO -0.22 0.93 -0.17 0.00 0.23 0.00 0.00 176.91 177.68 1fui h ALA 230 N 0.99 0.47 -0.61 0.39 0.00 0.79 -2.48 119.26 118.82 1fui h ALA 230 Ca -0.01 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.53 1fui h ALA 230 Cb 1.16 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.81 1fui h ALA 230 CO 0.11 0.39 0.30 -0.07 0.00 0.00 0.00 179.25 179.98 1fui h LEU 231 N 0.47 0.79 -0.57 0.00 3.38 -1.09 -0.35 115.31 117.94 1fui h LEU 231 Ca 0.07 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1fui h LEU 231 Cb 0.71 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 1fui h LEU 231 CO 0.05 0.70 0.37 0.00 0.09 0.00 0.00 178.44 179.64 1fui h ALA 232 N 1.13 0.73 -0.74 1.53 0.00 -1.41 0.95 119.26 121.45 1fui h ALA 232 Ca 0.21 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.05 1fui h ALA 232 Cb 0.11 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1fui h ALA 232 CO -0.03 0.13 0.31 2.35 0.00 0.00 0.00 179.25 182.02 1fui h TRP 233 N 0.74 1.11 -0.06 0.00 7.01 -1.09 -1.27 115.95 122.39 1fui h TRP 233 Ca 0.22 -0.08 -0.01 0.00 2.11 0.00 0.00 58.89 61.13 1fui h TRP 233 Cb -0.05 -0.34 -0.00 0.00 -2.10 0.00 0.00 29.16 26.67 1fui h TRP 233 CO -0.04 0.84 0.00 0.00 -2.79 0.00 0.00 178.44 176.45 1fui h ALA 234 N 1.16 0.08 -0.58 2.65 0.00 -0.40 -0.93 119.26 121.24 1fui h ALA 234 Ca 0.25 -0.16 0.08 0.00 0.00 0.00 0.00 54.91 55.08 1fui h ALA 234 Cb 0.19 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.89 1fui h ALA 234 CO -0.02 -0.26 0.23 -0.44 0.00 0.00 0.00 179.25 178.76 1fui h ASP 235 N -0.18 0.24 0.47 0.00 3.32 -0.69 0.29 116.42 119.87 1fui h ASP 235 Ca 0.02 0.07 -0.14 0.00 0.02 0.00 0.00 57.03 57.00 1fui h ASP 235 Cb 0.32 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1fui h ASP 235 CO 0.00 0.15 -0.60 0.50 -1.72 0.00 0.00 179.24 177.57 1fui h LYS 236 N 0.42 0.13 0.00 3.56 1.63 -1.14 -3.38 116.57 117.79 1fui h LYS 236 Ca 0.28 -0.09 -0.01 0.00 -0.85 0.00 0.00 60.65 59.98 1fui h LYS 236 Cb 0.32 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.96 1fui h LYS 236 CO -0.27 0.70 -1.39 0.09 -3.45 0.00 0.00 179.45 175.12 1fui n ASN 237 N -3.85 3.07 -4.68 4.20 3.02 -0.36 -5.02 115.26 111.64 1fui n ASN 237 Ca -0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.11 1fui n ASN 237 Cb 0.61 1.35 -0.03 0.00 -0.61 0.00 0.00 39.78 41.11 1fui n ASN 237 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1fui s PHE 238 N -2.57 2.74 -0.27 3.10 0.40 0.99 -4.79 117.98 117.58 1fui s PHE 238 Ca -0.03 0.81 -0.11 0.00 -0.60 0.00 0.00 56.93 57.00 1fui s PHE 238 Cb 0.05 -3.63 -0.05 0.00 0.51 0.00 0.00 43.02 39.90 1fui s PHE 238 CO 0.35 -2.35 0.18 0.50 0.70 0.00 0.00 175.22 174.60 1fui s ARG 239 N 2.95 3.97 -0.06 0.44 3.52 -1.26 -4.96 118.95 123.54 1fui s ARG 239 Ca 0.62 -0.31 -0.14 0.00 -0.13 0.00 0.00 55.73 55.76 1fui s ARG 239 Cb -0.28 -3.61 -0.05 0.00 -1.56 0.00 0.00 34.95 29.44 1fui s ARG 239 CO 0.23 -0.12 0.37 0.71 -0.81 0.00 0.00 175.30 175.69 1fui s TYR 240 N 1.57 3.63 0.15 5.12 2.02 -1.26 -0.23 117.35 128.34 1fui s TYR 240 Ca 0.07 0.85 -0.02 0.00 -0.37 0.00 0.00 57.07 57.61 1fui s TYR 240 Cb -0.15 -2.31 0.03 0.00 -0.40 0.00 0.00 41.96 39.13 1fui s TYR 240 CO 0.09 0.50 0.21 0.41 -1.57 0.00 0.00 175.55 175.19 1fui n GLY 241 N 2.38 -0.35 3.85 0.71 0.00 0.09 -4.77 105.19 107.10 1fui n GLY 241 Ca -0.13 -1.80 -0.35 0.00 0.00 0.00 0.00 46.02 43.73 1fui n GLY 241 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1fui s GLU 242 N -3.23 3.94 -0.22 1.61 2.12 -1.26 -4.81 118.70 116.85 1fui s GLU 242 Ca 0.13 0.43 -0.29 0.00 0.36 0.00 0.00 54.97 55.59 1fui s GLU 242 Cb -0.00 -2.95 -0.01 0.00 0.26 0.00 0.00 34.13 31.42 1fui s GLU 242 CO 0.09 0.50 1.28 0.34 -0.54 0.00 0.00 175.26 176.92 1fui s ASP 243 N -1.71 6.83 -0.17 -1.70 -1.08 -1.26 -4.61 116.67 112.97 1fui s ASP 243 Ca 0.36 1.49 0.16 0.00 -0.52 0.00 0.00 52.55 54.05 1fui s ASP 243 Cb -0.15 -2.54 0.70 0.00 -1.46 0.00 0.00 42.92 39.47 1fui s ASP 243 CO 0.19 -0.89 1.62 -0.62 0.52 0.00 0.00 175.17 175.99 1fui n GLU 244 N 6.89 4.01 -1.78 4.34 1.02 -1.26 -5.00 120.64 128.87 1fui n GLU 244 Ca 0.14 -2.96 -0.31 0.00 -0.02 0.00 0.00 57.16 54.02 1fui n GLU 244 Cb 0.46 -2.01 0.02 0.00 -0.02 0.00 0.00 31.44 29.89 1fui n GLU 244 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1fui s ASN 245 N -1.09 5.96 0.50 1.62 0.01 -1.26 -5.00 114.94 115.68 1fui s ASN 245 Ca 0.49 1.48 -0.23 0.00 -0.71 0.00 0.00 52.86 53.89 1fui s ASN 245 Cb 0.36 -2.47 -0.06 0.00 0.41 0.00 0.00 41.25 39.49 1fui s ASN 245 CO 0.17 -1.05 1.31 0.20 -1.51 0.00 0.00 177.10 176.22 1fui s ASN 246 N -4.07 5.69 0.34 -1.22 0.01 -1.26 -4.84 114.94 109.59 1fui s ASN 246 Ca 0.56 2.66 0.14 0.00 -0.71 0.00 0.00 52.86 55.50 1fui s ASN 246 Cb -0.12 -2.63 1.06 0.00 0.41 0.00 0.00 41.25 39.98 1fui s ASN 246 CO 0.54 -1.28 1.66 0.11 -1.51 0.00 0.00 177.10 176.63 1fui h LYS 247 N 1.85 0.32 0.00 -0.60 1.79 -1.98 -1.52 116.57 116.43 1fui h LYS 247 Ca -0.50 -0.02 0.00 0.00 -2.18 0.00 0.00 60.65 57.95 1fui h LYS 247 Cb 1.28 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.85 1fui h LYS 247 CO 0.59 0.21 0.00 1.96 -1.08 0.00 0.00 179.45 181.13 1fui h GLN 248 N 0.33 0.00 -0.01 3.15 7.50 -2.05 -2.96 115.11 121.08 1fui h GLN 248 Ca 0.72 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.87 1fui h GLN 248 Cb 1.63 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.16 1fui h GLN 248 CO -0.60 0.00 -0.66 0.66 -1.50 0.00 0.00 178.83 176.73 1fui n TYR 249 N -2.87 0.00 -2.20 2.96 4.01 -0.57 -4.93 117.16 113.55 1fui n TYR 249 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.33 1fui n TYR 249 Cb 0.24 -0.02 -0.03 0.00 -0.31 0.00 0.00 39.34 39.22 1fui n TYR 249 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 1fui s GLN 250 N -2.71 4.37 0.04 -0.72 -0.21 -1.12 -4.97 119.66 114.34 1fui s GLN 250 Ca 0.15 2.06 -0.10 0.00 0.02 0.00 0.00 55.36 57.48 1fui s GLN 250 Cb 0.17 -3.21 -0.05 0.00 1.00 0.00 0.00 33.01 30.92 1fui s GLN 250 CO 0.69 -0.30 0.37 1.03 -2.12 0.00 0.00 175.29 174.95 1fui s ARG 251 N 0.19 3.75 0.87 2.91 0.52 -1.26 -5.09 118.95 120.85 1fui s ARG 251 Ca 0.59 0.17 -0.12 0.00 -0.52 0.00 0.00 55.73 55.85 1fui s ARG 251 Cb -0.37 -3.07 0.12 0.00 0.52 0.00 0.00 34.95 32.15 1fui s ARG 251 CO 0.36 0.62 1.11 0.54 0.02 0.00 0.00 175.30 177.95 1fui s ASN 252 N -1.55 3.80 0.25 0.23 2.20 -1.26 -4.72 114.94 113.89 1fui s ASN 252 Ca 0.29 1.17 -0.05 0.00 -0.94 0.00 0.00 52.86 53.33 1fui s ASN 252 Cb -0.14 -1.82 0.47 0.00 -2.00 0.00 0.00 41.25 37.75 1fui s ASN 252 CO 0.16 -2.39 1.67 0.00 -2.94 0.00 0.00 177.10 173.60 1fui h ALA 253 N -1.38 0.92 -0.13 3.54 0.00 -1.98 -1.47 119.26 118.76 1fui h ALA 253 Ca -0.49 0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.64 1fui h ALA 253 Cb 1.30 0.28 -0.03 0.00 0.00 0.00 0.00 17.79 19.35 1fui h ALA 253 CO 0.60 -0.37 -0.06 1.49 0.00 0.00 0.00 179.25 180.90 1fui h GLU 254 N 0.22 -0.05 -0.45 0.00 4.81 -2.00 -1.07 114.58 116.04 1fui h GLU 254 Ca 0.42 0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.60 1fui h GLU 254 Cb 0.74 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 1fui h GLU 254 CO -0.56 -0.03 0.05 1.96 -0.73 0.00 0.00 179.01 179.70 1fui h GLN 255 N -0.05 0.70 -0.05 1.92 4.20 -1.76 -1.73 115.11 118.34 1fui h GLN 255 Ca 0.07 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.55 1fui h GLN 255 Cb 0.16 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 1fui h GLN 255 CO -0.16 0.69 -0.30 0.77 -0.67 0.00 0.00 178.83 179.15 1fui h SER 256 N 0.67 0.09 -0.09 1.46 0.02 -0.76 -2.05 113.55 112.89 1fui h SER 256 Ca 0.14 -0.03 -0.08 0.00 -0.84 0.00 0.00 61.79 60.99 1fui h SER 256 Cb 0.35 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.86 1fui h SER 256 CO 0.01 0.40 -0.25 -0.09 -1.14 0.00 0.00 176.83 175.76 1fui h ARG 257 N 0.08 0.32 -0.56 3.45 9.65 -0.53 -1.87 114.38 124.92 1fui h ARG 257 Ca 0.01 -0.23 0.13 0.00 -1.10 0.00 0.00 59.98 58.79 1fui h ARG 257 Cb 0.58 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.17 1fui h ARG 257 CO 0.04 0.84 0.39 0.00 2.80 0.00 0.00 179.97 184.05 1fui h ALA 258 N 0.48 2.27 0.02 2.80 0.00 -0.99 0.22 119.26 124.07 1fui h ALA 258 Ca -0.01 -0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.70 1fui h ALA 258 Cb 0.86 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.65 1fui h ALA 258 CO 0.05 -0.42 -0.75 0.28 0.00 0.00 0.00 179.25 178.41 1fui h VAL 259 N 0.19 1.40 -0.27 0.00 2.07 -1.22 -2.25 116.25 116.16 1fui h VAL 259 Ca 0.27 -2.18 -0.01 0.00 0.82 0.00 0.00 66.70 65.59 1fui h VAL 259 Cb 0.80 2.62 -0.01 0.00 -1.52 0.00 0.00 31.29 33.19 1fui h VAL 259 CO -0.04 0.64 0.12 0.25 0.02 0.00 0.00 177.57 178.56 1fui h LEU 260 N -0.01 0.36 0.10 2.57 6.46 -0.34 -0.23 115.31 124.22 1fui h LEU 260 Ca -0.10 -0.15 0.02 0.00 -0.12 0.00 0.00 57.88 57.53 1fui h LEU 260 Cb 1.46 -0.09 -0.03 0.00 -0.73 0.00 0.00 40.66 41.27 1fui h LEU 260 CO 0.15 0.41 -0.21 -0.09 -0.62 0.00 0.00 178.44 178.08 1fui h ARG 261 N 0.29 -0.37 -0.81 1.25 2.43 -0.69 -1.30 114.38 115.17 1fui h ARG 261 Ca 0.09 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 1fui h ARG 261 Cb 0.15 0.09 -0.04 0.00 -0.42 0.00 0.00 29.97 29.75 1fui h ARG 261 CO -0.01 -0.25 0.42 1.49 -1.51 0.00 0.00 179.97 180.11 1fui h GLU 262 N -0.39 1.15 -0.74 0.20 4.81 -1.28 -1.88 114.58 116.45 1fui h GLU 262 Ca 0.03 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1fui h GLU 262 Cb 0.42 -0.22 -0.04 0.00 0.63 0.00 0.00 28.75 29.54 1fui h GLU 262 CO -0.12 0.86 0.45 0.77 -0.73 0.00 0.00 179.01 180.24 1fui h SER 263 N 1.15 0.88 -0.00 1.04 0.02 -0.58 -0.92 113.55 115.13 1fui h SER 263 Ca 0.28 -0.06 -0.14 0.00 -0.84 0.00 0.00 61.79 61.04 1fui h SER 263 Cb 0.07 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1fui h SER 263 CO -0.04 0.68 -0.43 -0.07 -1.14 0.00 0.00 176.83 175.83 1fui h LEU 264 N 1.01 0.57 -0.96 5.07 3.38 -0.95 -2.88 115.31 120.55 1fui h LEU 264 Ca 0.27 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1fui h LEU 264 Cb -0.05 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 1fui h LEU 264 CO -0.05 0.93 0.32 -0.07 0.09 0.00 0.00 178.44 179.66 1fui h LEU 265 N 0.43 0.98 -0.85 1.67 3.38 -0.71 -1.83 115.31 118.38 1fui h LEU 265 Ca 0.03 -0.13 0.03 0.00 0.09 0.00 0.00 57.88 57.91 1fui h LEU 265 Cb 0.94 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.38 1fui h LEU 265 CO 0.08 0.85 0.55 0.24 0.09 0.00 0.00 178.44 180.25 1fui h MET 266 N 1.05 1.03 -0.31 1.13 2.86 -0.98 0.98 114.93 120.70 1fui h MET 266 Ca 0.25 -0.06 -0.02 0.00 -2.06 0.00 0.00 59.70 57.81 1fui h MET 266 Cb 0.16 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1fui h MET 266 CO -0.03 0.68 0.11 0.00 1.06 0.00 0.00 176.91 178.74 1fui h ALA 267 N 1.36 0.40 0.20 6.32 0.00 -1.26 -1.31 119.26 124.96 1fui h ALA 267 Ca 0.34 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1fui h ALA 267 Cb 0.01 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1fui h ALA 267 CO -0.12 0.02 -0.10 0.52 0.00 0.00 0.00 179.25 179.57 1fui h MET 268 N 0.35 -0.26 -0.64 0.00 2.07 -0.50 -1.89 114.93 114.06 1fui h MET 268 Ca 0.10 0.02 -0.04 0.00 -2.07 0.00 0.00 59.70 57.71 1fui h MET 268 Cb 0.21 0.06 -0.03 0.00 -1.87 0.00 0.00 31.60 29.97 1fui h MET 268 CO -0.01 -0.16 0.26 0.00 1.07 0.00 0.00 176.91 178.08 1fui h ILE 270 N 0.90 1.16 -0.53 0.00 2.04 -1.20 0.69 117.51 120.57 1fui h ILE 270 Ca 0.22 -0.44 0.01 0.00 1.00 0.00 0.00 64.86 65.64 1fui h ILE 270 Cb 0.20 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 1fui h ILE 270 CO -0.02 0.17 0.34 -0.09 0.00 0.00 0.00 178.15 178.55 1fui h ARG 271 N 0.47 0.68 -0.51 2.37 2.43 -1.13 -0.69 114.38 118.00 1fui h ARG 271 Ca 0.13 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.24 1fui h ARG 271 Cb 0.10 -0.15 -0.03 0.00 -0.42 0.00 0.00 29.97 29.47 1fui h ARG 271 CO -0.02 0.45 0.25 -0.44 -1.51 0.00 0.00 179.97 178.70 1fui h ASP 272 N 0.70 0.64 -0.09 -3.80 3.32 -0.72 -1.48 116.42 114.98 1fui h ASP 272 Ca 0.20 -0.06 -0.14 0.00 0.02 0.00 0.00 57.03 57.05 1fui h ASP 272 Cb -0.06 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.32 1fui h ASP 272 CO -0.06 0.55 -0.42 0.24 -1.72 0.00 0.00 179.24 177.83 1fui h MET 273 N 0.72 0.63 -0.06 3.56 2.86 -0.00 0.35 114.93 122.98 1fui h MET 273 Ca 0.18 -0.33 -0.03 0.00 -2.06 0.00 0.00 59.70 57.46 1fui h MET 273 Cb 0.08 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.75 1fui h MET 273 CO -0.02 0.93 -0.07 0.52 1.06 0.00 0.00 176.91 179.33 1fui h MET 274 N 0.51 0.16 -0.01 1.72 2.86 -0.40 0.63 114.93 120.40 1fui h MET 274 Ca 0.04 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.59 1fui h MET 274 Cb 0.94 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.61 1fui h MET 274 CO 0.08 0.61 0.00 0.00 1.06 0.00 0.00 176.91 178.67 1fui n GLN 275 N -4.72 -0.53 0.00 1.72 10.64 -0.63 -0.67 117.38 123.19 1fui n GLN 275 Ca -0.08 -0.70 0.00 0.00 -1.83 0.00 0.00 57.00 54.40 1fui n GLN 275 Cb 0.31 -1.06 0.00 0.00 -0.86 0.00 0.00 30.24 28.63 1fui n GLN 275 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1fui n GLY 276 N 0.17 -1.58 3.11 2.61 0.00 0.12 -4.75 105.19 104.87 1fui n GLY 276 Ca 0.02 -1.56 0.01 0.00 0.00 0.00 0.00 46.02 44.49 1fui n GLY 276 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fui s ASN 277 N -4.23 -1.07 0.50 1.61 3.84 -0.08 -4.66 114.94 110.85 1fui s ASN 277 Ca 0.00 0.77 0.18 0.00 0.21 0.00 0.00 52.86 54.02 1fui s ASN 277 Cb 0.00 1.97 1.24 0.00 -0.55 0.00 0.00 41.25 43.91 1fui s ASN 277 CO 0.00 -0.27 2.06 0.77 -2.79 0.00 0.00 177.10 176.88 1fui h SER 278 N 8.04 0.10 -0.06 -4.21 4.64 -1.96 -1.61 113.55 118.48 1fui h SER 278 Ca -0.22 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.12 1fui h SER 278 Cb 1.16 -0.02 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1fui h SER 278 CO 0.26 0.06 0.08 0.11 -0.87 0.00 0.00 176.83 176.48 1fui h LYS 279 N 0.11 0.00 0.00 4.77 1.79 -1.96 -0.40 116.57 120.88 1fui h LYS 279 Ca 0.14 0.00 -0.03 0.00 -2.18 0.00 0.00 60.65 58.58 1fui h LYS 279 Cb 0.42 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 31.07 1fui h LYS 279 CO -0.02 0.00 -0.12 -0.07 -1.08 0.00 0.00 179.45 178.16 1fui h LEU 280 N 0.00 0.00 -1.11 2.94 3.38 -1.60 -2.28 115.31 116.64 1fui h LEU 280 Ca 0.03 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.92 1fui h LEU 280 Cb 0.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1fui h LEU 280 CO -0.00 0.12 -0.28 0.00 0.09 0.00 0.00 178.44 178.37 1fui h ALA 281 N 1.88 1.25 -0.06 1.53 0.00 -1.22 -1.41 119.26 121.24 1fui h ALA 281 Ca -0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1fui h ALA 281 Cb 0.48 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1fui h ALA 281 CO 0.02 0.50 -0.02 -0.44 0.00 0.00 0.00 179.25 179.30 1fui h ASP 282 N 0.25 0.07 -0.50 0.00 3.32 -1.52 -2.68 116.42 115.36 1fui h ASP 282 Ca 0.04 -0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1fui h ASP 282 Cb 0.63 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 1fui h ASP 282 CO 0.05 0.11 0.01 2.30 -1.72 0.00 0.00 179.24 179.99 1fui n ILE 283 N -4.46 2.66 -0.85 0.35 -5.35 -1.04 -4.94 119.36 105.73 1fui n ILE 283 Ca -0.02 -1.56 0.00 0.00 -0.27 0.00 0.00 62.75 60.90 1fui n ILE 283 Cb 0.14 -0.28 0.00 0.00 -1.74 0.00 0.00 39.64 37.76 1fui n ILE 283 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1fui n GLY 284 N 0.27 0.49 2.78 3.28 0.00 -1.01 -4.99 105.19 106.02 1fui n GLY 284 Ca 0.27 -0.75 -0.29 0.00 0.00 0.00 0.00 46.02 45.24 1fui n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fui n ARG 285 N -2.85 3.39 -0.20 1.61 5.12 -0.56 -4.88 116.66 118.30 1fui n ARG 285 Ca 0.00 -4.79 -0.10 0.00 -1.93 0.00 0.00 57.85 51.04 1fui n ARG 285 Cb 0.00 -2.28 0.02 0.00 -1.16 0.00 0.00 32.46 29.03 1fui n ARG 285 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 1fui h VAL 286 N 2.96 1.27 -0.08 1.55 -1.51 -1.84 -1.57 116.25 117.02 1fui h VAL 286 Ca 0.20 -1.19 0.00 0.00 -1.23 0.00 0.00 66.70 64.48 1fui h VAL 286 Cb 0.52 0.88 -0.00 0.00 -2.13 0.00 0.00 31.29 30.55 1fui h VAL 286 CO 0.89 0.43 0.05 -0.08 -1.23 0.00 0.00 177.57 177.63 1fui h GLU 287 N 0.93 0.10 0.00 5.19 4.81 -1.95 -2.53 114.58 121.13 1fui h GLU 287 Ca 0.16 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1fui h GLU 287 Cb 0.60 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.96 1fui h GLU 287 CO 0.04 0.09 -0.09 0.93 -0.73 0.00 0.00 179.01 179.25 1fui h GLU 288 N 0.08 0.00 0.00 1.92 3.07 -1.93 -2.69 114.58 115.03 1fui h GLU 288 Ca 0.03 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1fui h GLU 288 Cb 0.01 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1fui h GLU 288 CO -0.01 0.09 -0.02 0.66 -1.40 0.00 0.00 179.01 178.33 1fui h SER 289 N 0.00 0.00 -0.09 1.42 4.64 -0.83 -3.17 113.55 115.52 1fui h SER 289 Ca -0.00 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.20 1fui h SER 289 Cb 0.23 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.30 1fui h SER 289 CO 0.01 0.02 -0.34 -0.07 -0.87 0.00 0.00 176.83 175.58 1fui h LEU 290 N 0.00 0.61 0.00 5.97 3.38 -1.54 -0.20 115.31 123.53 1fui h LEU 290 Ca -0.00 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1fui h LEU 290 Cb 0.41 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1fui h LEU 290 CO 0.00 0.90 0.00 0.61 0.09 0.00 0.00 178.44 180.05 1fui n GLY 291 N -0.13 -2.29 0.21 0.83 0.00 -1.20 -4.13 105.19 98.48 1fui n GLY 291 Ca -0.01 -1.55 0.04 0.00 0.00 0.00 0.00 46.02 44.50 1fui n GLY 291 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1fui n TYR 292 N -0.48 0.17 -3.12 1.61 4.01 0.21 -4.86 117.16 114.70 1fui n TYR 292 Ca 0.00 -0.66 -0.23 0.00 -0.16 0.00 0.00 57.90 56.86 1fui n TYR 292 Cb 0.00 -0.10 0.03 0.00 -0.31 0.00 0.00 39.34 38.96 1fui n TYR 292 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1fui n ASN 293 N -0.55 -5.50 -4.73 7.72 5.15 -1.12 -4.61 115.26 111.61 1fui n ASN 293 Ca 0.08 -0.32 -0.40 0.00 -0.60 0.00 0.00 54.58 53.35 1fui n ASN 293 Cb 0.44 -4.46 -0.05 0.00 -0.53 0.00 0.00 39.78 35.17 1fui n ASN 293 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1fui s ALA 294 N -3.12 3.36 -1.33 5.20 0.00 0.15 -1.82 121.76 124.20 1fui s ALA 294 Ca 0.33 0.18 0.19 0.00 0.00 0.00 0.00 51.96 52.67 1fui s ALA 294 Cb -0.16 -2.96 -0.11 0.00 0.00 0.00 0.00 23.12 19.90 1fui s ALA 294 CO 0.41 -0.03 0.89 1.51 0.00 0.00 0.00 175.76 178.55 1fui n ILE 295 N 3.37 0.00 -3.54 0.00 3.06 -0.50 -4.58 119.36 117.17 1fui n ILE 295 Ca -0.02 -0.17 -0.17 0.00 -2.50 0.00 0.00 62.75 59.89 1fui n ILE 295 Cb 0.51 1.11 -0.06 0.00 0.54 0.00 0.00 39.64 41.74 1fui n ILE 295 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1fui s ALA 296 N -2.52 -1.67 0.22 1.51 0.00 -1.24 -4.54 121.76 113.52 1fui s ALA 296 Ca 0.12 1.19 -0.05 0.00 0.00 0.00 0.00 51.96 53.22 1fui s ALA 296 Cb 0.15 0.04 -0.03 0.00 0.00 0.00 0.00 23.12 23.28 1fui s ALA 296 CO 0.64 -0.37 0.27 0.00 0.00 0.00 0.00 175.76 176.30 1fui s ALA 297 N -1.30 0.63 -0.02 0.00 0.00 0.44 -0.96 121.76 120.55 1fui s ALA 297 Ca -0.11 -1.39 -0.03 0.00 0.00 0.00 0.00 51.96 50.43 1fui s ALA 297 Cb -0.00 1.27 0.00 0.00 0.00 0.00 0.00 23.12 24.38 1fui s ALA 297 CO 0.09 -0.70 0.08 0.20 0.00 0.00 0.00 175.76 175.43 1fui s GLY 298 N -3.11 -0.01 -0.24 0.00 0.00 -0.11 -0.30 107.32 103.55 1fui s GLY 298 Ca 0.33 0.08 0.02 0.00 0.00 0.00 0.00 44.72 45.15 1fui s GLY 298 CO 0.11 0.03 -0.13 -0.12 0.00 0.00 0.00 173.10 173.00 1fui s PHE 299 N -0.33 3.07 0.11 1.90 5.36 -0.69 -1.04 117.98 126.36 1fui s PHE 299 Ca -0.04 -2.10 -0.32 0.00 -0.96 0.00 0.00 56.93 53.51 1fui s PHE 299 Cb -0.03 -1.90 -0.11 0.00 -0.34 0.00 0.00 43.02 40.64 1fui s PHE 299 CO 0.00 -0.85 1.58 0.37 -1.46 0.00 0.00 175.22 174.86 1fui h GLN 300 N 7.83 -0.66 0.00 10.12 4.15 -1.39 -1.88 115.11 133.28 1fui h GLN 300 Ca -0.26 0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.20 1fui h GLN 300 Cb 1.07 0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.91 1fui h GLN 300 CO 0.50 -0.44 0.00 0.41 -1.93 0.00 0.00 178.83 177.37 1fui n GLY 301 N -1.47 1.63 3.77 2.39 0.00 -1.26 -3.87 105.19 106.37 1fui n GLY 301 Ca -0.08 0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1fui n GLY 301 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1fui s GLN 302 N 0.00 3.80 -0.11 1.61 -0.21 -1.26 -1.83 119.66 121.65 1fui s GLN 302 Ca 0.00 1.74 0.17 0.00 0.02 0.00 0.00 55.36 57.29 1fui s GLN 302 Cb 0.00 -2.42 -0.24 0.00 1.00 0.00 0.00 33.01 31.35 1fui s GLN 302 CO 0.00 -0.51 0.34 0.54 -2.12 0.00 0.00 175.29 173.54 1fui n ARG 303 N -0.45 0.67 -0.32 2.91 5.12 -1.26 -4.09 116.66 119.24 1fui n ARG 303 Ca 0.07 0.07 0.04 0.00 -1.93 0.00 0.00 57.85 56.09 1fui n ARG 303 Cb 0.48 -1.62 0.23 0.00 -1.16 0.00 0.00 32.46 30.39 1fui n ARG 303 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1fui h HIS 304 N 0.00 1.08 0.00 -1.55 3.86 -1.97 -1.76 115.15 114.81 1fui h HIS 304 Ca -0.38 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 58.84 1fui h HIS 304 Cb 1.98 -0.35 -0.00 0.00 1.06 0.00 0.00 27.41 30.09 1fui h HIS 304 CO 0.00 0.56 -0.13 2.35 0.86 0.00 0.00 177.93 181.57 1fui h TRP 305 N 1.06 0.00 -0.00 2.45 2.91 -1.70 -3.38 115.95 117.29 1fui h TRP 305 Ca 0.40 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.42 1fui h TRP 305 Cb 0.19 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 28.84 1fui h TRP 305 CO -0.00 0.54 0.03 1.79 -1.03 0.00 0.00 178.44 179.77 1fui h THR 306 N -1.00 0.08 0.00 2.65 1.35 -1.54 0.28 112.91 114.73 1fui h THR 306 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 1fui h THR 306 Cb 0.56 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 67.96 1fui h THR 306 CO -0.02 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.72 1fui n ASP 307 N -3.18 0.00 0.00 5.36 9.92 -0.67 -2.06 116.55 125.92 1fui n ASP 307 Ca -0.03 -0.85 0.00 0.00 -0.53 0.00 0.00 54.79 53.39 1fui n ASP 307 Cb 0.10 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.58 1fui n ASP 307 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1fui n GLN 308 N -0.98 1.94 -4.43 -1.24 10.64 -0.60 -4.59 117.38 118.12 1fui n GLN 308 Ca 0.19 0.00 -0.22 0.00 -1.83 0.00 0.00 57.00 55.14 1fui n GLN 308 Cb 0.09 -0.26 -0.10 0.00 -0.86 0.00 0.00 30.24 29.10 1fui n GLN 308 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1fui s TYR 309 N -0.38 2.02 0.41 2.61 2.02 -0.01 -4.53 117.35 119.49 1fui s TYR 309 Ca 0.00 -0.58 -0.25 0.00 -0.37 0.00 0.00 57.07 55.87 1fui s TYR 309 Cb 0.00 -1.06 -0.10 0.00 -0.40 0.00 0.00 41.96 40.40 1fui s TYR 309 CO 0.00 0.42 1.11 -2.30 -1.57 0.00 0.00 175.55 173.21 1fui n PRO 310 N -0.57 1.57 -1.51 -1.71 -0.02 -1.20 -3.77 135.00 127.79 1fui n PRO 310 Ca -0.06 0.56 -0.29 0.00 -2.02 0.00 0.00 63.50 61.69 1fui n PRO 310 Cb 0.62 -2.16 0.18 0.00 -0.02 0.00 0.00 33.50 32.12 1fui n PRO 310 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1fui s ASN 311 N -0.65 2.63 -0.02 2.55 2.20 0.76 -4.81 114.94 117.60 1fui s ASN 311 Ca 0.62 0.67 0.10 0.00 -0.94 0.00 0.00 52.86 53.31 1fui s ASN 311 Cb -0.55 -1.00 0.31 0.00 -2.00 0.00 0.00 41.25 38.01 1fui s ASN 311 CO 0.57 -3.07 1.21 0.61 -2.94 0.00 0.00 177.10 173.48 1fui n GLY 312 N -2.27 0.88 0.22 0.45 0.00 -1.26 -4.53 105.19 98.68 1fui n GLY 312 Ca 0.11 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.67 1fui n GLY 312 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1fui h ASP 313 N 1.93 -0.56 -0.03 1.61 3.32 -1.87 0.68 116.42 121.50 1fui h ASP 313 Ca 0.00 0.11 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 1fui h ASP 313 Cb 0.59 0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 1fui h ASP 313 CO 0.04 -0.22 0.01 0.74 -1.72 0.00 0.00 179.24 178.09 1fui h THR 314 N -0.20 1.17 0.00 0.35 2.02 -1.77 -0.73 112.91 113.75 1fui h THR 314 Ca 0.12 -0.50 0.02 0.00 0.77 0.00 0.00 66.41 66.82 1fui h THR 314 Cb 0.37 1.45 -0.03 0.00 -1.74 0.00 0.00 68.15 68.20 1fui h THR 314 CO -0.30 0.14 -0.13 0.00 0.37 0.00 0.00 175.52 175.60 1fui h ALA 315 N 0.81 -0.15 -0.61 6.16 0.00 -1.69 0.01 119.26 123.79 1fui h ALA 315 Ca 0.01 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1fui h ALA 315 Cb 0.21 0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.20 1fui h ALA 315 CO -0.00 -0.62 0.39 0.93 0.00 0.00 0.00 179.25 179.95 1fui h GLU 316 N -0.22 0.82 -0.21 0.00 5.08 -0.85 0.37 114.58 119.57 1fui h GLU 316 Ca 0.05 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1fui h GLU 316 Cb 0.27 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1fui h GLU 316 CO -0.13 0.56 0.09 0.00 -1.00 0.00 0.00 179.01 178.54 1fui h ALA 317 N 1.21 0.27 0.23 3.43 0.00 -0.76 -2.20 119.26 121.44 1fui h ALA 317 Ca 0.22 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1fui h ALA 317 Cb -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1fui h ALA 317 CO -0.05 -0.16 -0.11 0.82 0.00 0.00 0.00 179.25 179.75 1fui h ILE 318 N 0.19 0.84 -0.80 0.00 1.08 -0.82 -2.68 117.51 115.32 1fui h ILE 318 Ca 0.07 -0.56 0.07 0.00 -0.39 0.00 0.00 64.86 64.05 1fui h ILE 318 Cb 0.14 1.16 -0.05 0.00 -3.07 0.00 0.00 36.82 35.00 1fui h ILE 318 CO -0.01 0.12 0.52 -0.07 -0.69 0.00 0.00 178.15 178.03 1fui h LEU 319 N -0.60 0.75 -0.02 1.44 3.38 -0.97 -1.39 115.31 117.88 1fui h LEU 319 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1fui h LEU 319 Cb 0.44 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.03 1fui h LEU 319 CO 0.05 0.48 0.00 0.59 0.09 0.00 0.00 178.44 179.65 1fui n ASN 320 N -4.49 0.32 -4.89 -0.43 3.02 -0.83 -0.53 115.26 107.43 1fui n ASN 320 Ca 0.12 0.53 -0.30 0.00 -0.03 0.00 0.00 54.58 54.91 1fui n ASN 320 Cb 0.23 -0.62 0.02 0.00 -0.61 0.00 0.00 39.78 38.81 1fui n ASN 320 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1fui s SER 321 N -3.60 5.92 -0.12 6.41 0.01 -0.53 -4.32 113.70 117.48 1fui s SER 321 Ca 0.12 1.16 0.04 0.00 1.31 0.00 0.00 55.95 58.58 1fui s SER 321 Cb 0.16 -2.17 0.30 0.00 0.21 0.00 0.00 66.02 64.52 1fui s SER 321 CO 0.54 -0.99 1.11 -1.20 0.41 0.00 0.00 173.24 173.10 1fui n SER 322 N -2.73 2.99 -3.61 2.44 7.64 -1.26 -4.20 113.62 114.90 1fui n SER 322 Ca 0.05 -2.45 -0.04 0.00 1.01 0.00 0.00 58.87 57.44 1fui n SER 322 Cb 0.56 -0.59 -0.02 0.00 -1.01 0.00 0.00 64.21 63.15 1fui n SER 322 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1fui s PHE 323 N -1.55 -0.18 0.00 1.43 -0.12 -1.26 -1.04 117.98 115.26 1fui s PHE 323 Ca 0.21 0.03 0.00 0.00 -0.05 0.00 0.00 56.93 57.13 1fui s PHE 323 Cb 0.17 0.56 0.00 0.00 -0.63 0.00 0.00 43.02 43.12 1fui s PHE 323 CO 0.06 -0.46 0.00 -0.40 -0.05 0.00 0.00 175.22 174.36 1fui n ASP 324 N -0.31 0.00 0.30 1.98 5.68 -0.92 -4.87 116.55 118.40 1fui n ASP 324 Ca -0.06 -0.39 0.15 0.00 -0.50 0.00 0.00 54.79 53.99 1fui n ASP 324 Cb 0.61 0.00 0.80 0.00 -1.14 0.00 0.00 41.12 41.39 1fui n ASP 324 CO 0.00 0.00 0.00 4.11 -1.33 0.00 0.00 177.20 179.98 1fui h TRP 325 N 0.39 0.00 -0.49 2.11 0.09 -1.93 0.09 115.95 116.22 1fui h TRP 325 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.89 58.98 1fui h TRP 325 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.24 1fui h TRP 325 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 178.44 178.62 1fui n ASN 326 N -2.74 3.06 0.00 0.11 3.02 -1.26 -5.00 115.26 112.44 1fui n ASN 326 Ca -0.02 -1.96 0.00 0.00 -0.03 0.00 0.00 54.58 52.57 1fui n ASN 326 Cb 0.29 -0.32 0.00 0.00 -0.61 0.00 0.00 39.78 39.14 1fui n ASN 326 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fui n GLY 327 N 1.42 -2.00 3.79 7.41 0.00 0.02 -4.97 105.19 110.87 1fui n GLY 327 Ca 0.19 -2.09 -0.36 0.00 0.00 0.00 0.00 46.02 43.77 1fui n GLY 327 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fui s VAL 328 N -0.18 4.09 0.33 1.61 -7.23 -1.26 -2.18 120.40 115.59 1fui s VAL 328 Ca 0.00 1.60 -0.13 0.00 -1.81 0.00 0.00 61.98 61.64 1fui s VAL 328 Cb 0.00 -3.83 0.02 0.00 0.56 0.00 0.00 36.38 33.14 1fui s VAL 328 CO 0.00 0.01 0.64 0.00 -0.31 0.00 0.00 175.10 175.43 1fui s ARG 329 N -2.42 1.93 0.19 4.82 1.70 -0.21 -4.94 118.95 120.03 1fui s ARG 329 Ca 0.55 -1.38 -0.30 0.00 -0.47 0.00 0.00 55.73 54.12 1fui s ARG 329 Cb -0.18 0.55 -0.09 0.00 -0.57 0.00 0.00 34.95 34.66 1fui s ARG 329 CO 0.23 -0.86 1.31 -2.00 -1.08 0.00 0.00 175.30 172.90 1fui s GLU 330 N -3.16 4.39 0.51 3.89 2.12 -1.26 -4.38 118.70 120.81 1fui s GLU 330 Ca 0.20 2.05 -0.21 0.00 0.36 0.00 0.00 54.97 57.36 1fui s GLU 330 Cb -0.03 -3.20 -0.06 0.00 0.26 0.00 0.00 34.13 31.10 1fui s GLU 330 CO 0.12 -0.26 1.16 -1.25 -0.54 0.00 0.00 175.26 174.50 1fui s PRO 331 N -0.06 3.49 0.68 4.30 0.04 -1.26 -4.91 135.00 137.28 1fui s PRO 331 Ca 0.57 1.72 -0.04 0.00 0.04 0.00 0.00 61.00 63.29 1fui s PRO 331 Cb -0.36 -2.18 0.07 0.00 0.04 0.00 0.00 34.50 32.07 1fui s PRO 331 CO 0.38 -0.76 0.97 -0.06 0.04 0.00 0.00 177.00 177.56 1fui s PHE 332 N -1.64 2.66 -0.35 0.56 0.08 0.31 -5.00 117.98 114.59 1fui s PHE 332 Ca 0.69 0.23 0.04 0.00 0.12 0.00 0.00 56.93 58.01 1fui s PHE 332 Cb -0.27 -3.11 0.10 0.00 -0.57 0.00 0.00 43.02 39.17 1fui s PHE 332 CO 0.32 -1.38 0.07 0.08 -0.10 0.00 0.00 175.22 174.20 1fui s VAL 333 N -3.15 2.33 -0.23 -0.44 1.01 -1.26 -4.29 120.40 114.38 1fui s VAL 333 Ca 0.61 -2.39 0.02 0.00 0.00 0.00 0.00 61.98 60.21 1fui s VAL 333 Cb -0.10 -2.72 0.05 0.00 0.00 0.00 0.00 36.38 33.62 1fui s VAL 333 CO 0.43 -0.61 -0.11 -0.69 0.00 0.00 0.00 175.10 174.12 1fui s VAL 334 N 0.84 1.90 -0.08 2.92 1.01 -1.26 -0.42 120.40 125.31 1fui s VAL 334 Ca 0.11 -1.29 -0.26 0.00 0.00 0.00 0.00 61.98 60.54 1fui s VAL 334 Cb -0.20 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 1fui s VAL 334 CO -0.07 0.09 0.82 0.00 0.00 0.00 0.00 175.10 175.94 1fui s ALA 335 N 1.26 3.33 0.51 5.51 0.00 0.59 -4.95 121.76 128.02 1fui s ALA 335 Ca -0.04 0.23 -0.19 0.00 0.00 0.00 0.00 51.96 51.96 1fui s ALA 335 Cb -0.18 -3.15 -0.07 0.00 0.00 0.00 0.00 23.12 19.72 1fui s ALA 335 CO -0.07 -0.29 1.03 -0.08 0.00 0.00 0.00 175.76 176.35 1fui s THR 336 N 1.24 3.88 -2.04 0.00 -1.32 -1.26 -1.71 115.64 114.44 1fui s THR 336 Ca 0.42 1.07 0.00 0.00 -1.21 0.00 0.00 61.69 61.97 1fui s THR 336 Cb -0.18 -3.46 0.00 0.00 -1.51 0.00 0.00 72.50 67.35 1fui s THR 336 CO 0.19 -0.35 0.00 -0.62 -2.21 0.00 0.00 174.62 171.63 1fui n GLU 337 N -1.29 -1.55 -3.19 7.08 1.02 -0.81 -2.44 120.64 119.46 1fui n GLU 337 Ca 0.09 1.14 -0.20 0.00 -0.02 0.00 0.00 57.16 58.17 1fui n GLU 337 Cb 0.53 -5.64 -0.01 0.00 -0.02 0.00 0.00 31.44 26.30 1fui n GLU 337 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1fui n ASN 338 N -1.61 -3.36 -4.56 1.62 5.15 -0.77 -4.30 115.26 107.42 1fui n ASN 338 Ca -0.22 -0.25 -0.40 0.00 -0.60 0.00 0.00 54.58 53.10 1fui n ASN 338 Cb 0.68 -2.82 -0.03 0.00 -0.53 0.00 0.00 39.78 37.09 1fui n ASN 338 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 1fui s ASP 339 N -2.57 6.44 0.46 1.20 -1.08 -1.02 -3.91 116.67 116.20 1fui s ASP 339 Ca 0.32 -1.57 0.14 0.00 -0.52 0.00 0.00 52.55 50.92 1fui s ASP 339 Cb -0.17 -2.57 1.09 0.00 -1.46 0.00 0.00 42.92 39.80 1fui s ASP 339 CO 0.39 -1.56 2.03 0.77 0.52 0.00 0.00 175.17 177.33 1fui h SER 340 N 9.52 0.27 0.39 -0.34 4.64 -1.74 -0.88 113.55 125.42 1fui h SER 340 Ca 0.24 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.44 1fui h SER 340 Cb 0.99 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 63.00 1fui h SER 340 CO 1.42 0.18 -0.49 -0.07 -0.87 0.00 0.00 176.83 177.00 1fui h LEU 341 N 0.31 0.12 -0.08 5.97 3.38 -1.88 0.94 115.31 124.07 1fui h LEU 341 Ca 0.19 -0.06 -0.24 0.00 0.09 0.00 0.00 57.88 57.86 1fui h LEU 341 Cb 0.37 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.09 1fui h LEU 341 CO -0.04 0.59 -1.03 -1.13 0.09 0.00 0.00 178.44 176.92 1fui h ASN 342 N 0.09 0.57 -0.96 -0.43 -1.24 -1.56 -2.77 115.58 109.29 1fui h ASN 342 Ca 0.00 -0.49 0.07 0.00 0.71 0.00 0.00 56.30 56.60 1fui h ASN 342 Cb 0.89 -0.18 -0.07 0.00 0.73 0.00 0.00 38.32 39.70 1fui h ASN 342 CO 0.07 1.31 0.61 1.23 -1.29 0.00 0.00 177.43 179.36 1fui h GLY 343 N 1.15 1.47 0.99 1.57 0.00 -0.61 0.05 103.07 107.70 1fui h GLY 343 Ca -0.10 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 46.72 1fui h GLY 343 CO 0.18 0.29 0.08 -2.08 0.00 0.00 0.00 176.54 175.01 1fui h VAL 344 N 1.09 1.25 -0.74 4.60 2.07 -0.75 0.18 116.25 123.96 1fui h VAL 344 Ca 0.42 -0.95 -0.06 0.00 0.82 0.00 0.00 66.70 66.93 1fui h VAL 344 Cb 0.21 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1fui h VAL 344 CO -0.19 0.34 0.22 0.00 0.02 0.00 0.00 177.57 177.96 1fui h ALA 345 N 0.97 0.99 -0.50 1.67 0.00 -1.04 -0.95 119.26 120.40 1fui h ALA 345 Ca 0.15 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 1fui h ALA 345 Cb 0.41 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1fui h ALA 345 CO 0.01 0.67 0.14 0.52 0.00 0.00 0.00 179.25 180.59 1fui h MET 346 N 1.10 0.79 -0.11 0.00 2.86 -0.68 -1.16 114.93 117.73 1fui h MET 346 Ca 0.24 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.70 1fui h MET 346 Cb 0.32 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 1fui h MET 346 CO -0.01 0.75 0.05 1.25 1.06 0.00 0.00 176.91 180.02 1fui h LEU 347 N 0.69 0.08 -0.28 1.22 6.46 -0.26 -0.09 115.31 123.13 1fui h LEU 347 Ca 0.16 0.00 0.02 0.00 -0.12 0.00 0.00 57.88 57.94 1fui h LEU 347 Cb 0.30 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.19 1fui h LEU 347 CO -0.00 0.06 0.14 0.24 -0.62 0.00 0.00 178.44 178.26 1fui h MET 348 N 0.12 0.28 -0.74 1.25 2.86 -1.05 0.45 114.93 118.10 1fui h MET 348 Ca 0.04 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1fui h MET 348 Cb 0.01 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 31.57 1fui h MET 348 CO -0.03 0.19 0.43 0.78 1.06 0.00 0.00 176.91 179.33 1fui h GLY 349 N 0.29 1.08 0.93 8.32 0.00 -0.97 -1.50 103.07 111.23 1fui h GLY 349 Ca 0.11 -0.47 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 1fui h GLY 349 CO -0.08 0.45 -0.11 0.84 0.00 0.00 0.00 176.54 177.65 1fui h HIS 350 N 1.01 0.75 0.00 5.60 6.17 -0.66 -1.21 115.15 126.82 1fui h HIS 350 Ca 0.26 -0.17 -0.04 0.00 0.71 0.00 0.00 60.37 61.13 1fui h HIS 350 Cb -0.00 -0.18 -0.01 0.00 2.52 0.00 0.00 27.41 29.74 1fui h HIS 350 CO -0.01 0.85 -0.21 1.96 0.71 0.00 0.00 177.93 181.23 1fui h GLN 351 N 0.44 0.00 0.01 5.26 1.08 -0.67 0.61 115.11 121.84 1fui h GLN 351 Ca 0.08 0.00 -0.26 0.00 -1.45 0.00 0.00 58.65 57.03 1fui h GLN 351 Cb 0.62 0.00 -0.04 0.00 -0.05 0.00 0.00 27.48 28.01 1fui h GLN 351 CO 0.04 0.21 -1.36 -0.07 -0.95 0.00 0.00 178.83 176.70 1fui h LEU 352 N 0.00 0.04 0.00 1.46 3.38 -1.13 -3.41 115.31 115.64 1fui h LEU 352 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1fui h LEU 352 Cb 0.43 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.16 1fui h LEU 352 CO 0.03 1.05 -1.15 0.35 0.09 0.00 0.00 178.44 178.81 1fui n THR 353 N -3.23 0.00 -1.00 0.22 -2.24 -0.47 -5.00 114.28 102.56 1fui n THR 353 Ca -0.09 -0.08 -0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1fui n THR 353 Cb 1.00 0.43 -0.00 0.00 -2.10 0.00 0.00 70.33 69.66 1fui n THR 353 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fui n GLY 354 N 2.30 0.40 3.95 3.38 0.00 0.21 -4.65 105.19 110.78 1fui n GLY 354 Ca -0.01 -0.01 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 1fui n GLY 354 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fui s THR 355 N -1.79 2.74 0.45 2.61 -4.23 -1.26 -3.71 115.64 110.44 1fui s THR 355 Ca 0.00 -1.17 -0.22 0.00 -1.18 0.00 0.00 61.69 59.12 1fui s THR 355 Cb 0.00 -2.91 -0.08 0.00 1.34 0.00 0.00 72.50 70.85 1fui s THR 355 CO 0.00 0.00 1.06 0.00 -0.54 0.00 0.00 174.62 175.14 1fui s ALA 356 N -2.44 2.97 -0.04 3.99 0.00 -1.26 -4.54 121.76 120.43 1fui s ALA 356 Ca 0.52 0.69 0.03 0.00 0.00 0.00 0.00 51.96 53.19 1fui s ALA 356 Cb -0.06 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 1fui s ALA 356 CO 0.31 -0.32 -0.12 -0.65 0.00 0.00 0.00 175.76 174.98 1fui s GLN 357 N -2.86 2.53 -0.32 0.00 -1.52 -1.26 -4.76 119.66 111.47 1fui s GLN 357 Ca 0.63 -0.69 -0.13 0.00 -1.95 0.00 0.00 55.36 53.22 1fui s GLN 357 Cb -0.20 -2.43 -0.03 0.00 -0.22 0.00 0.00 33.01 30.13 1fui s GLN 357 CO 0.25 0.62 0.27 0.08 -0.25 0.00 0.00 175.29 176.26 1fui s VAL 358 N -0.81 5.25 -0.05 1.09 1.01 -0.87 -4.38 120.40 121.64 1fui s VAL 358 Ca 0.13 0.02 -0.25 0.00 0.00 0.00 0.00 61.98 61.88 1fui s VAL 358 Cb -0.11 -3.69 -0.03 0.00 0.00 0.00 0.00 36.38 32.55 1fui s VAL 358 CO 0.02 0.05 0.77 0.12 0.00 0.00 0.00 175.10 176.07 1fui s PHE 359 N 1.84 3.60 -0.00 5.22 2.19 -1.26 -1.26 117.98 128.30 1fui s PHE 359 Ca 0.08 1.36 -0.03 0.00 0.33 0.00 0.00 56.93 58.67 1fui s PHE 359 Cb -0.17 -2.88 -0.00 0.00 -1.31 0.00 0.00 43.02 38.66 1fui s PHE 359 CO 0.11 0.06 0.06 0.00 1.83 0.00 0.00 175.22 177.28 1fui s ALA 360 N 0.86 -0.13 -0.10 11.12 0.00 -0.85 -4.22 121.76 128.44 1fui s ALA 360 Ca 0.41 -0.19 -0.19 0.00 0.00 0.00 0.00 51.96 51.99 1fui s ALA 360 Cb -0.19 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.95 1fui s ALA 360 CO 0.21 -0.14 0.51 -0.51 0.00 0.00 0.00 175.76 175.83 1fui s ASP 361 N -0.99 6.74 -1.07 0.00 1.11 -1.09 -1.31 116.67 120.06 1fui s ASP 361 Ca -0.11 0.88 -0.19 0.00 0.18 0.00 0.00 52.55 53.31 1fui s ASP 361 Cb -0.06 -2.31 0.10 0.00 1.07 0.00 0.00 42.92 41.72 1fui s ASP 361 CO 0.00 -0.00 1.40 -0.69 1.18 0.00 0.00 175.17 177.06 1fui s VAL 362 N 0.58 4.37 -0.08 -1.27 1.01 -0.24 -2.08 120.40 122.68 1fui s VAL 362 Ca 0.28 -1.49 -0.25 0.00 0.00 0.00 0.00 61.98 60.51 1fui s VAL 362 Cb -0.16 -4.98 -0.28 0.00 0.00 0.00 0.00 36.38 30.97 1fui s VAL 362 CO 0.12 -1.78 0.87 -0.09 0.00 0.00 0.00 175.10 174.22 1fui h ARG 363 N 8.72 0.16 -3.58 2.72 2.43 -1.45 -3.47 114.38 119.90 1fui h ARG 363 Ca 0.25 -0.25 -0.18 0.00 -0.81 0.00 0.00 59.98 58.99 1fui h ARG 363 Cb 0.97 0.09 -0.24 0.00 -0.42 0.00 0.00 29.97 30.37 1fui h ARG 363 CO 1.31 1.09 -0.58 0.99 -1.51 0.00 0.00 179.97 181.26 1fui s THR 364 N -2.49 0.05 -0.25 0.20 2.01 -1.19 -4.98 115.64 108.98 1fui s THR 364 Ca -0.16 -0.37 -0.07 0.00 0.31 0.00 0.00 61.69 61.39 1fui s THR 364 Cb -0.01 -0.26 -0.03 0.00 0.01 0.00 0.00 72.50 72.22 1fui s THR 364 CO 0.76 -0.21 0.07 -0.47 -0.69 0.00 0.00 174.62 174.08 1fui s TYR 365 N -0.65 3.08 -0.40 4.92 5.04 -1.26 -0.30 117.35 127.77 1fui s TYR 365 Ca -0.07 -0.48 -0.10 0.00 -2.44 0.00 0.00 57.07 53.98 1fui s TYR 365 Cb -0.04 -2.23 0.06 0.00 0.35 0.00 0.00 41.96 40.09 1fui s TYR 365 CO 0.00 -0.38 0.24 -1.58 -1.34 0.00 0.00 175.55 172.50 1fui s TRP 366 N 1.60 3.30 0.58 4.97 0.52 0.42 -4.99 118.94 125.34 1fui s TRP 366 Ca 0.06 -1.30 -0.15 0.00 0.02 0.00 0.00 56.10 54.73 1fui s TRP 366 Cb -0.15 -2.77 -0.04 0.00 -1.15 0.00 0.00 33.47 29.36 1fui s TRP 366 CO 0.03 -0.78 1.04 -1.54 0.02 0.00 0.00 176.95 175.72 1fui s SER 367 N 1.94 5.98 0.47 2.95 1.04 -1.26 -1.42 113.70 123.40 1fui s SER 367 Ca 0.02 1.72 0.16 0.00 0.48 0.00 0.00 55.95 58.34 1fui s SER 367 Cb -0.22 -2.52 1.14 0.00 0.10 0.00 0.00 66.02 64.52 1fui s SER 367 CO 0.04 -1.03 2.03 1.55 0.98 0.00 0.00 173.24 176.81 1fui h PRO 368 N 0.44 0.25 -0.35 4.02 0.13 -1.87 -0.75 132.00 133.87 1fui h PRO 368 Ca -0.46 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 1fui h PRO 368 Cb 1.21 -0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.27 1fui h PRO 368 CO 0.59 0.16 0.01 0.93 -0.23 0.00 0.00 178.00 179.46 1fui h GLU 369 N 0.25 0.61 -0.61 0.86 3.07 -1.97 -1.14 114.58 115.65 1fui h GLU 369 Ca 0.19 -0.19 -0.07 0.00 -0.50 0.00 0.00 59.36 58.79 1fui h GLU 369 Cb 0.44 -0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 28.27 1fui h GLU 369 CO -0.04 0.73 0.11 0.00 -1.40 0.00 0.00 179.01 178.41 1fui h ALA 370 N 0.87 1.04 0.37 3.43 0.00 -1.68 -1.05 119.26 122.23 1fui h ALA 370 Ca 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 1fui h ALA 370 Cb 0.44 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1fui h ALA 370 CO 0.02 0.62 -0.18 0.82 0.00 0.00 0.00 179.25 180.53 1fui h ILE 371 N 0.93 0.65 -0.34 0.00 1.08 -0.88 -2.10 117.51 116.84 1fui h ILE 371 Ca 0.19 -0.19 0.06 0.00 -0.39 0.00 0.00 64.86 64.53 1fui h ILE 371 Cb 0.39 0.75 -0.06 0.00 -3.07 0.00 0.00 36.82 34.83 1fui h ILE 371 CO 0.01 0.04 -0.03 -0.08 -0.69 0.00 0.00 178.15 177.39 1fui h GLU 372 N -0.60 0.06 -0.38 2.37 4.81 -1.08 0.21 114.58 119.96 1fui h GLU 372 Ca -0.05 -0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.23 1fui h GLU 372 Cb 0.44 -0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.77 1fui h GLU 372 CO 0.08 0.04 0.11 -0.09 -0.73 0.00 0.00 179.01 178.42 1fui h ARG 373 N 0.06 0.24 0.00 1.92 2.43 -1.09 0.54 114.38 118.48 1fui h ARG 373 Ca 0.17 -0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.25 1fui h ARG 373 Cb 0.24 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.72 1fui h ARG 373 CO -0.31 0.16 -0.62 -0.39 -1.51 0.00 0.00 179.97 177.31 1fui h VAL 374 N 0.25 0.42 0.00 0.20 -1.51 -0.93 -3.39 116.25 111.28 1fui h VAL 374 Ca 0.18 -1.64 0.00 0.00 -1.23 0.00 0.00 66.70 64.00 1fui h VAL 374 Cb 0.18 2.08 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 1fui h VAL 374 CO -0.20 0.24 -0.57 0.35 -1.23 0.00 0.00 177.57 176.16 1fui n THR 375 N -3.04 0.00 0.00 7.19 -2.24 0.02 -5.02 114.28 111.19 1fui n THR 375 Ca 0.00 -0.16 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 1fui n THR 375 Cb 0.67 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 1fui n THR 375 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fui n GLY 376 N 1.72 3.03 3.74 3.38 0.00 0.19 -5.00 105.19 112.25 1fui n GLY 376 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1fui n GLY 376 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1fui s HIS 377 N -1.49 3.46 -0.64 1.61 5.65 -1.26 -4.89 115.29 117.73 1fui s HIS 377 Ca 0.00 1.46 -0.16 0.00 0.25 0.00 0.00 55.06 56.60 1fui s HIS 377 Cb 0.00 -3.40 0.15 0.00 -1.18 0.00 0.00 32.58 28.15 1fui s HIS 377 CO 0.00 -1.08 0.64 0.21 -0.65 0.00 0.00 174.74 173.86 1fui s LYS 378 N -0.20 3.18 0.58 2.88 2.20 -1.26 -3.58 119.74 123.55 1fui s LYS 378 Ca 0.52 -1.82 -0.21 0.00 -0.36 0.00 0.00 55.97 54.11 1fui s LYS 378 Cb -0.32 -4.35 -0.04 0.00 -1.51 0.00 0.00 37.83 31.61 1fui s LYS 378 CO 0.36 -1.39 1.35 -0.11 -0.36 0.00 0.00 175.35 175.20 1fui n LEU 379 N 5.23 5.76 -4.12 5.43 7.94 -1.26 -5.07 117.00 130.91 1fui n LEU 379 Ca -0.04 0.94 -0.16 0.00 -1.11 0.00 0.00 56.01 55.64 1fui n LEU 379 Cb 0.43 -1.58 -0.04 0.00 0.53 0.00 0.00 43.42 42.75 1fui n LEU 379 CO 0.50 -0.67 0.11 1.51 -1.11 0.00 0.00 177.39 177.73 1fui s ASP 380 N -1.04 1.13 0.00 1.96 -4.77 -1.26 -4.51 116.67 108.17 1fui s ASP 380 Ca 0.75 -1.57 0.00 0.00 -3.30 0.00 0.00 52.55 48.43 1fui s ASP 380 Cb -0.40 0.66 0.00 0.00 -1.09 0.00 0.00 42.92 42.09 1fui s ASP 380 CO 0.46 -1.28 0.00 0.61 0.70 0.00 0.00 175.17 175.66 1fui n GLY 381 N -0.59 0.07 0.28 2.12 0.00 -1.26 -3.60 105.19 102.20 1fui n GLY 381 Ca 0.02 -1.07 0.04 0.00 0.00 0.00 0.00 46.02 45.01 1fui n GLY 381 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1fui h LEU 382 N 0.00 0.29 -0.20 0.99 -0.00 -1.99 -2.02 115.31 112.38 1fui h LEU 382 Ca 0.00 -0.02 0.00 0.00 -0.00 0.00 0.00 57.88 57.86 1fui h LEU 382 Cb 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 40.66 40.59 1fui h LEU 382 CO 0.00 0.27 0.00 0.00 -0.00 0.00 0.00 178.44 178.71 1fui n ALA 383 N -2.50 2.61 -0.25 1.53 0.00 -1.24 -4.33 120.51 116.34 1fui n ALA 383 Ca 0.00 -0.20 0.18 0.00 0.00 0.00 0.00 53.44 53.42 1fui n ALA 383 Cb 0.13 -1.30 0.49 0.00 0.00 0.00 0.00 19.45 18.76 1fui n ALA 383 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1fui h GLU 384 N 0.42 0.44 -0.47 0.00 4.81 -1.47 -2.67 114.58 115.64 1fui h GLU 384 Ca 0.00 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1fui h GLU 384 Cb 0.09 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1fui h GLU 384 CO 0.00 0.29 0.00 0.72 -0.73 0.00 0.00 179.01 179.29 1fui n HIS 385 N -4.53 0.61 0.00 0.92 8.25 -1.26 -4.81 115.22 114.40 1fui n HIS 385 Ca 0.19 -0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.33 1fui n HIS 385 Cb 0.65 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.76 1fui n HIS 385 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fui n GLY 386 N 1.46 3.16 3.24 -1.41 0.00 -1.01 -4.31 105.19 106.32 1fui n GLY 386 Ca 0.20 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.19 1fui n GLY 386 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1fui s ILE 387 N -2.18 0.03 -0.15 -0.61 2.07 -0.51 -4.72 121.20 115.14 1fui s ILE 387 Ca 0.00 -0.28 -0.02 0.00 -1.41 0.00 0.00 60.65 58.94 1fui s ILE 387 Cb 0.00 -0.56 -0.02 0.00 0.13 0.00 0.00 42.46 42.00 1fui s ILE 387 CO 0.00 -0.15 -0.08 -0.63 -1.91 0.00 0.00 174.94 172.17 1fui s ILE 388 N -0.71 3.51 -0.40 2.00 1.01 -0.00 -0.44 121.20 126.17 1fui s ILE 388 Ca -0.08 -0.49 -0.22 0.00 0.00 0.00 0.00 60.65 59.86 1fui s ILE 388 Cb -0.04 -2.52 0.01 0.00 0.01 0.00 0.00 42.46 39.93 1fui s ILE 388 CO 0.03 0.50 0.71 -2.28 0.00 0.00 0.00 174.94 173.90 1fui s HIS 389 N 0.42 3.08 -0.35 3.97 5.65 0.59 -1.22 115.29 127.42 1fui s HIS 389 Ca -0.06 0.26 -0.10 0.00 0.25 0.00 0.00 55.06 55.41 1fui s HIS 389 Cb -0.15 -3.38 0.02 0.00 -1.18 0.00 0.00 32.58 27.89 1fui s HIS 389 CO 0.04 -0.80 0.17 -0.51 -0.65 0.00 0.00 174.74 172.99 1fui s LEU 390 N 2.98 4.45 -0.10 8.88 1.43 -0.66 -1.21 118.68 134.46 1fui s LEU 390 Ca 0.27 -0.87 -0.03 0.00 -1.03 0.00 0.00 54.13 52.46 1fui s LEU 390 Cb -0.13 -1.99 0.05 0.00 0.03 0.00 0.00 46.19 44.14 1fui s LEU 390 CO 0.18 -0.32 0.09 -0.63 0.23 0.00 0.00 176.35 175.91 1fui s ILE 391 N 1.55 -0.14 0.56 -0.59 1.01 -0.88 -1.89 121.20 120.81 1fui s ILE 391 Ca 0.02 0.21 -0.15 0.00 0.00 0.00 0.00 60.65 60.73 1fui s ILE 391 Cb -0.19 -0.33 -0.06 0.00 0.01 0.00 0.00 42.46 41.90 1fui s ILE 391 CO 0.06 0.01 1.01 0.21 0.00 0.00 0.00 174.94 176.23 1fui s ASN 392 N 2.19 6.37 0.00 3.58 2.47 -1.25 -2.67 114.94 125.63 1fui s ASN 392 Ca 0.04 1.55 -0.02 0.00 0.42 0.00 0.00 52.86 54.85 1fui s ASN 392 Cb -0.13 -2.50 -0.10 0.00 -1.45 0.00 0.00 41.25 37.06 1fui s ASN 392 CO -0.06 -0.76 1.85 -1.54 -3.72 0.00 0.00 177.10 172.87 1fui n SER 393 N -2.03 2.80 0.00 -4.21 3.41 -1.26 -4.32 113.62 108.01 1fui n SER 393 Ca 0.07 -1.94 0.00 0.00 -0.26 0.00 0.00 58.87 56.73 1fui n SER 393 Cb 0.54 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.78 1fui n SER 393 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fui n GLY 394 N 2.45 1.66 3.05 5.00 0.00 -1.26 -4.99 105.19 111.10 1fui n GLY 394 Ca 0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.10 1fui n GLY 394 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fui s SER 395 N -1.44 0.27 -0.26 1.61 1.04 -1.26 -1.59 113.70 112.06 1fui s SER 395 Ca 0.00 -0.61 -0.27 0.00 0.48 0.00 0.00 55.95 55.56 1fui s SER 395 Cb 0.00 0.17 0.15 0.00 0.10 0.00 0.00 66.02 66.44 1fui s SER 395 CO 0.00 -0.44 1.18 0.00 0.98 0.00 0.00 173.24 174.96 1fui s ALA 396 N -2.37 -2.05 0.12 5.32 0.00 -1.26 -4.58 121.76 116.93 1fui s ALA 396 Ca -0.07 1.76 -0.35 0.00 0.00 0.00 0.00 51.96 53.30 1fui s ALA 396 Cb -0.03 -1.40 -0.14 0.00 0.00 0.00 0.00 23.12 21.55 1fui s ALA 396 CO -0.04 -0.21 1.55 0.00 0.00 0.00 0.00 175.76 177.06 1fui n ALA 397 N 1.54 0.79 0.31 0.00 0.00 -1.26 -4.61 120.51 117.29 1fui n ALA 397 Ca -0.10 0.45 0.19 0.00 0.00 0.00 0.00 53.44 53.98 1fui n ALA 397 Cb 0.57 -2.30 1.06 0.00 0.00 0.00 0.00 19.45 18.78 1fui n ALA 397 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1fui h LEU 398 N 5.90 0.00 -2.40 0.00 3.38 -1.88 0.18 115.31 120.49 1fui h LEU 398 Ca -0.46 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.51 1fui h LEU 398 Cb 1.27 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.02 1fui h LEU 398 CO 0.87 0.00 -0.01 0.44 0.09 0.00 0.00 178.44 179.83 1fui h ASP 399 N 0.00 0.00 0.02 -0.43 5.19 -1.91 -2.25 116.42 117.05 1fui h ASP 399 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1fui h ASP 399 Cb 0.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.57 1fui h ASP 399 CO -0.00 0.01 0.00 1.23 -3.12 0.00 0.00 179.24 177.36 1fui h GLY 400 N 0.07 0.00 2.00 2.75 0.00 -0.99 -1.94 103.07 104.96 1fui h GLY 400 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1fui h GLY 400 CO 0.00 0.00 -0.05 1.48 0.00 0.00 0.00 176.54 177.97 1fui h SER 401 N 0.00 0.00 -4.61 0.19 4.64 -1.60 -3.40 113.55 108.77 1fui h SER 401 Ca 0.00 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 61.03 1fui h SER 401 Cb 0.01 0.00 0.11 0.00 -0.31 0.00 0.00 62.40 62.21 1fui h SER 401 CO 0.00 0.05 -0.51 0.00 -0.87 0.00 0.00 176.83 175.50 1fui n LYS 403 N -3.79 0.10 -1.83 0.00 4.76 -1.26 -3.92 118.16 112.22 1fui n LYS 403 Ca -0.02 0.04 -0.32 0.00 -2.87 0.00 0.00 58.31 55.14 1fui n LYS 403 Cb 0.55 -1.57 0.03 0.00 -1.84 0.00 0.00 35.03 32.20 1fui n LYS 403 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1fui s GLN 404 N -3.06 3.18 0.06 1.97 -0.21 -1.25 -4.91 119.66 115.45 1fui s GLN 404 Ca 0.10 1.06 0.05 0.00 0.02 0.00 0.00 55.36 56.58 1fui s GLN 404 Cb 0.16 -2.02 -0.03 0.00 1.00 0.00 0.00 33.01 32.13 1fui s GLN 404 CO 0.67 -0.91 -0.13 1.03 -2.12 0.00 0.00 175.29 173.83 1fui s ARG 405 N -4.58 0.81 0.20 2.91 1.81 -1.26 -1.39 118.95 117.45 1fui s ARG 405 Ca 0.60 -0.87 -0.00 0.00 -1.72 0.00 0.00 55.73 53.74 1fui s ARG 405 Cb -0.14 -0.80 0.04 0.00 -0.45 0.00 0.00 34.95 33.59 1fui s ARG 405 CO 0.46 0.18 0.27 -0.40 -0.68 0.00 0.00 175.30 175.13 1fui n ASP 406 N 1.49 0.34 -0.15 0.23 5.75 -0.81 -4.91 116.55 118.48 1fui n ASP 406 Ca -0.20 -1.29 -0.03 0.00 -0.01 0.00 0.00 54.79 53.25 1fui n ASP 406 Cb 0.54 -0.18 0.06 0.00 -1.03 0.00 0.00 41.12 40.52 1fui n ASP 406 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1fui h SER 407 N -0.17 0.06 0.18 -1.12 0.02 -2.01 -1.37 113.55 109.12 1fui h SER 407 Ca -0.09 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1fui h SER 407 Cb 0.32 0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1fui h SER 407 CO 0.09 0.06 0.00 -0.62 -1.14 0.00 0.00 176.83 175.22 1fui n GLU 408 N -5.08 0.50 -0.47 3.45 1.02 -1.26 -4.89 120.64 113.91 1fui n GLU 408 Ca 0.05 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1fui n GLU 408 Cb 0.22 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.14 1fui n GLU 408 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1fui n GLY 409 N 0.39 0.74 3.80 0.62 0.00 -0.52 -5.07 105.19 105.16 1fui n GLY 409 Ca 0.13 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 1fui n GLY 409 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1fui s ASN 410 N -2.89 6.71 0.28 1.61 0.01 -1.26 -4.70 114.94 114.71 1fui s ASN 410 Ca 0.00 1.84 -0.29 0.00 -0.71 0.00 0.00 52.86 53.69 1fui s ASN 410 Cb 0.00 -2.56 -0.10 0.00 0.41 0.00 0.00 41.25 39.00 1fui s ASN 410 CO 0.00 -0.52 1.36 -2.16 -1.51 0.00 0.00 177.10 174.27 1fui s PRO 411 N -3.03 4.32 0.32 -0.60 0.04 -1.26 -1.93 135.00 132.85 1fui s PRO 411 Ca 0.63 2.23 -0.13 0.00 0.04 0.00 0.00 61.00 63.77 1fui s PRO 411 Cb -0.14 -3.10 0.05 0.00 0.04 0.00 0.00 34.50 31.35 1fui s PRO 411 CO 0.18 -0.29 0.68 -2.37 0.04 0.00 0.00 177.00 175.25 1fui n THR 412 N 1.61 0.00 -4.59 1.26 5.66 -0.49 -4.88 114.28 112.85 1fui n THR 412 Ca 0.03 -0.80 -0.26 0.00 -3.05 0.00 0.00 64.05 59.98 1fui n THR 412 Cb 0.41 0.81 -0.17 0.00 -1.55 0.00 0.00 70.33 69.84 1fui n THR 412 CO 0.00 0.00 0.00 -0.04 -3.05 0.00 0.00 175.07 171.98 1fui s MET 413 N -2.07 1.84 0.29 1.09 -1.94 -1.26 -3.76 119.30 113.49 1fui s MET 413 Ca 0.14 -0.45 0.09 0.00 -1.71 0.00 0.00 55.69 53.76 1fui s MET 413 Cb -0.04 -1.53 -0.06 0.00 2.01 0.00 0.00 34.83 35.22 1fui s MET 413 CO 0.09 0.01 -0.13 0.15 -0.01 0.00 0.00 175.02 175.14 1fui s LYS 414 N 0.73 1.65 0.41 2.03 1.02 -1.26 -4.96 119.74 119.36 1fui s LYS 414 Ca -0.13 -1.81 -0.26 0.00 0.02 0.00 0.00 55.97 53.79 1fui s LYS 414 Cb -0.16 -1.53 -0.09 0.00 -0.52 0.00 0.00 37.83 35.53 1fui s LYS 414 CO 0.03 0.18 1.35 -2.14 -0.92 0.00 0.00 175.35 173.86 1fui s PRO 415 N -3.61 3.91 0.57 -1.68 0.02 -1.26 -4.61 135.00 128.35 1fui s PRO 415 Ca 0.30 2.26 0.30 0.00 0.02 0.00 0.00 61.00 63.88 1fui s PRO 415 Cb -0.00 -2.76 1.45 0.00 0.02 0.00 0.00 34.50 33.21 1fui s PRO 415 CO 0.14 -0.58 1.84 1.12 -0.33 0.00 0.00 177.00 179.20 1fui h HIS 416 N 2.63 0.00 0.00 6.54 2.07 -1.86 0.02 115.15 124.55 1fui h HIS 416 Ca -0.50 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.02 1fui h HIS 416 Cb 1.25 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.23 1fui h HIS 416 CO 0.52 0.00 0.00 -2.67 -3.07 0.00 0.00 177.93 172.71 1fui n TRP 417 N -3.90 0.00 0.01 6.12 2.14 -1.26 -2.76 117.44 117.79 1fui n TRP 417 Ca 0.14 0.00 0.03 0.00 2.07 0.00 0.00 57.50 59.74 1fui n TRP 417 Cb 0.87 -0.34 0.07 0.00 -0.81 0.00 0.00 31.31 31.11 1fui n TRP 417 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 1fui n GLU 418 N -1.34 2.04 -3.61 -2.67 1.02 -0.01 -4.97 120.64 111.09 1fui n GLU 418 Ca 0.09 -1.55 -0.36 0.00 -0.02 0.00 0.00 57.16 55.32 1fui n GLU 418 Cb 0.20 -1.15 -0.08 0.00 -0.02 0.00 0.00 31.44 30.39 1fui n GLU 418 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1fui s ILE 419 N -0.87 5.34 0.24 -3.67 1.01 -1.11 -4.95 121.20 117.19 1fui s ILE 419 Ca 0.12 0.35 -0.04 0.00 0.00 0.00 0.00 60.65 61.08 1fui s ILE 419 Cb 0.07 -3.56 -0.05 0.00 0.01 0.00 0.00 42.46 38.93 1fui s ILE 419 CO 0.09 0.38 0.47 -0.94 0.00 0.00 0.00 174.94 174.94 1fui s SER 420 N 0.67 6.44 0.58 3.58 1.04 -1.26 -4.97 113.70 119.77 1fui s SER 420 Ca 0.12 0.60 0.28 0.00 0.48 0.00 0.00 55.95 57.43 1fui s SER 420 Cb -0.13 -2.10 1.59 0.00 0.10 0.00 0.00 66.02 65.49 1fui s SER 420 CO 0.03 -0.10 2.05 -0.61 0.98 0.00 0.00 173.24 175.58 1fui h GLN 421 N 2.00 0.00 -0.20 4.02 5.75 -1.99 -0.19 115.11 124.49 1fui h GLN 421 Ca -0.47 0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.00 1fui h GLN 421 Cb 1.19 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.73 1fui h GLN 421 CO 0.68 0.00 0.01 1.96 -2.65 0.00 0.00 178.83 178.83 1fui h GLN 422 N 0.00 0.35 -0.63 1.69 4.20 -1.99 -1.41 115.11 117.31 1fui h GLN 422 Ca 0.12 -0.11 -0.07 0.00 0.06 0.00 0.00 58.65 58.66 1fui h GLN 422 Cb 0.67 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.39 1fui h GLN 422 CO -0.00 0.53 0.10 0.93 -0.67 0.00 0.00 178.83 179.73 1fui h GLU 423 N 0.12 1.03 -0.27 1.46 5.08 -1.46 -1.07 114.58 119.47 1fui h GLU 423 Ca 0.06 -0.26 0.02 0.00 -1.00 0.00 0.00 59.36 58.18 1fui h GLU 423 Cb 0.37 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 1fui h GLU 423 CO 0.01 0.94 0.13 0.00 -1.00 0.00 0.00 179.01 179.09 1fui h ALA 424 N 1.14 0.32 -0.32 3.43 0.00 -1.07 -1.84 119.26 120.92 1fui h ALA 424 Ca 0.19 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1fui h ALA 424 Cb 0.41 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1fui h ALA 424 CO 0.01 -0.27 -0.06 -0.44 0.00 0.00 0.00 179.25 178.49 1fui h ASP 425 N 0.27 0.50 -0.72 0.00 3.32 -0.95 -2.26 116.42 116.58 1fui h ASP 425 Ca 0.11 -0.11 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 1fui h ASP 425 Cb 0.04 -0.13 -0.03 0.00 0.22 0.00 0.00 39.33 39.43 1fui h ASP 425 CO -0.08 0.61 0.21 0.00 -1.72 0.00 0.00 179.24 178.26 1fui h ALA 426 N 1.45 1.00 -0.70 3.45 0.00 -0.62 -0.24 119.26 123.59 1fui h ALA 426 Ca 0.10 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.70 1fui h ALA 426 Cb 0.41 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1fui h ALA 426 CO 0.02 0.66 0.16 0.00 0.00 0.00 0.00 179.25 180.09 1fui h LEU 428 N 1.07 0.64 -1.22 0.00 6.46 -1.09 -2.80 115.31 118.38 1fui h LEU 428 Ca 0.22 -0.25 -0.05 0.00 -0.12 0.00 0.00 57.88 57.68 1fui h LEU 428 Cb 0.39 -0.18 -0.01 0.00 -0.73 0.00 0.00 40.66 40.14 1fui h LEU 428 CO 0.00 0.90 -0.24 0.00 -0.62 0.00 0.00 178.44 178.48 1fui h ALA 429 N 1.14 1.07 -0.16 1.25 0.00 -0.65 -2.58 119.26 119.33 1fui h ALA 429 Ca 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1fui h ALA 429 Cb 0.78 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.53 1fui h ALA 429 CO 0.06 0.30 0.00 0.00 0.00 0.00 0.00 179.25 179.62 1fui n ALA 430 N -2.26 2.52 -2.56 0.00 0.00 -0.63 -4.86 120.51 112.73 1fui n ALA 430 Ca -0.00 -0.47 -0.33 0.00 0.00 0.00 0.00 53.44 52.64 1fui n ALA 430 Cb 0.41 -1.10 -0.13 0.00 0.00 0.00 0.00 19.45 18.62 1fui n ALA 430 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1fui s THR 431 N -1.80 2.98 -0.08 0.00 2.01 -0.97 -4.52 115.64 113.26 1fui s THR 431 Ca 0.30 -0.74 0.04 0.00 0.31 0.00 0.00 61.69 61.60 1fui s THR 431 Cb 0.16 -2.17 -0.01 0.00 0.01 0.00 0.00 72.50 70.49 1fui s THR 431 CO 0.24 0.58 -0.22 -1.61 -0.69 0.00 0.00 174.62 172.93 1fui s GLU 432 N -0.56 2.77 -0.35 4.92 2.02 -0.25 -4.37 118.70 122.88 1fui s GLU 432 Ca 0.08 -0.84 -0.16 0.00 0.02 0.00 0.00 54.97 54.06 1fui s GLU 432 Cb -0.11 -2.29 -0.01 0.00 0.10 0.00 0.00 34.13 31.82 1fui s GLU 432 CO 0.01 0.34 0.41 -1.58 0.02 0.00 0.00 175.26 174.47 1fui s TRP 433 N -0.05 3.20 -0.08 1.61 0.52 0.67 -0.99 118.94 123.82 1fui s TRP 433 Ca -0.06 0.01 0.01 0.00 0.02 0.00 0.00 56.10 56.08 1fui s TRP 433 Cb -0.15 -2.76 -0.03 0.00 -1.15 0.00 0.00 33.47 29.39 1fui s TRP 433 CO 0.05 -0.48 -0.08 0.00 0.02 0.00 0.00 176.95 176.46 1fui n PRO 435 N 2.39 2.12 -2.24 0.00 -0.02 -1.26 -0.32 135.00 135.66 1fui n PRO 435 Ca -0.18 0.75 -0.36 0.00 -2.02 0.00 0.00 63.50 61.69 1fui n PRO 435 Cb 0.53 -2.40 -0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1fui n PRO 435 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fui s ALA 436 N -1.14 2.83 -0.32 3.55 0.00 -0.32 -4.76 121.76 121.59 1fui s ALA 436 Ca 0.57 0.89 -0.29 0.00 0.00 0.00 0.00 51.96 53.14 1fui s ALA 436 Cb -0.53 -3.38 -0.00 0.00 0.00 0.00 0.00 23.12 19.21 1fui s ALA 436 CO 0.61 -0.74 1.46 0.42 0.00 0.00 0.00 175.76 177.51 1fui s ILE 437 N -1.65 3.89 0.30 0.00 1.01 -1.26 -4.75 121.20 118.74 1fui s ILE 437 Ca 0.68 0.96 0.05 0.00 0.00 0.00 0.00 60.65 62.34 1fui s ILE 437 Cb -0.27 -4.01 0.31 0.00 0.01 0.00 0.00 42.46 38.50 1fui s ILE 437 CO 0.31 -0.52 1.67 -0.74 0.00 0.00 0.00 174.94 175.66 1fui h HIS 438 N 10.47 0.56 -0.06 3.97 -0.00 -1.93 -0.11 115.15 128.04 1fui h HIS 438 Ca -0.29 0.04 -0.06 0.00 -0.00 0.00 0.00 60.37 60.06 1fui h HIS 438 Cb 1.12 -0.10 -0.01 0.00 -0.00 0.00 0.00 27.41 28.42 1fui h HIS 438 CO 0.93 -0.15 -0.24 0.93 -0.00 0.00 0.00 177.93 179.40 1fui h GLU 439 N 0.29 0.10 0.10 5.26 3.07 -1.97 -2.32 114.58 119.12 1fui h GLU 439 Ca 0.59 -0.03 -0.35 0.00 -0.50 0.00 0.00 59.36 59.07 1fui h GLU 439 Cb 1.19 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 29.07 1fui h GLU 439 CO -0.60 0.35 -1.94 0.66 -1.40 0.00 0.00 179.01 176.07 1fui n TYR 440 N -4.21 1.22 -3.74 4.33 4.01 -0.78 -4.66 117.16 113.33 1fui n TYR 440 Ca -0.02 0.29 -0.28 0.00 -0.16 0.00 0.00 57.90 57.73 1fui n TYR 440 Cb 0.32 -1.17 -0.11 0.00 -0.31 0.00 0.00 39.34 38.07 1fui n TYR 440 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1fui n PHE 441 N -3.40 2.49 0.25 -0.72 3.72 -0.12 -4.81 117.46 114.87 1fui n PHE 441 Ca -0.29 -4.11 0.18 0.00 -0.05 0.00 0.00 57.45 53.18 1fui n PHE 441 Cb 1.05 -0.46 0.90 0.00 -0.94 0.00 0.00 39.48 40.03 1fui n PHE 441 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1fui h ARG 442 N 5.25 0.00 -0.01 -1.08 3.08 -0.84 0.45 114.38 121.23 1fui h ARG 442 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 1fui h ARG 442 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.82 1fui h ARG 442 CO 0.67 0.00 -0.24 0.41 -1.07 0.00 0.00 179.97 179.74 1fui n GLY 443 N -1.31 -0.43 2.47 0.04 0.00 -0.87 -4.79 105.19 100.30 1fui n GLY 443 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1fui n GLY 443 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fui n GLY 444 N 1.32 -2.40 0.00 -0.02 0.00 0.15 -3.26 105.19 100.99 1fui n GLY 444 Ca 0.13 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1fui n GLY 444 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fui n GLY 445 N -0.21 -0.32 2.74 -0.02 0.00 -1.26 -0.17 105.19 105.95 1fui n GLY 445 Ca 0.00 -1.41 -0.25 0.00 0.00 0.00 0.00 46.02 44.36 1fui n GLY 445 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1fui s TYR 446 N -1.85 0.80 0.33 1.61 2.02 -1.26 -1.17 117.35 117.82 1fui s TYR 446 Ca 0.00 -0.51 -0.19 0.00 -0.37 0.00 0.00 57.07 56.00 1fui s TYR 446 Cb 0.00 -0.90 -0.10 0.00 -0.40 0.00 0.00 41.96 40.57 1fui s TYR 446 CO 0.00 -0.48 0.82 -1.12 -1.57 0.00 0.00 175.55 173.20 1fui s SER 447 N 1.93 6.95 -0.52 2.29 0.01 0.56 -3.05 113.70 121.87 1fui s SER 447 Ca 0.02 1.50 -0.18 0.00 1.31 0.00 0.00 55.95 58.60 1fui s SER 447 Cb -0.15 -2.46 0.08 0.00 0.21 0.00 0.00 66.02 63.71 1fui s SER 447 CO -0.07 -0.19 0.57 -0.94 0.41 0.00 0.00 173.24 173.02 1fui s SER 448 N -2.04 6.19 -0.24 2.44 1.04 -0.62 -1.70 113.70 118.76 1fui s SER 448 Ca 0.54 -1.25 -0.10 0.00 0.48 0.00 0.00 55.95 55.62 1fui s SER 448 Cb -0.12 -2.25 -0.05 0.00 0.10 0.00 0.00 66.02 63.70 1fui s SER 448 CO 0.18 -0.87 0.16 -0.60 0.98 0.00 0.00 173.24 173.08 1fui s ARG 449 N 2.25 4.03 0.22 4.02 3.52 -0.17 -3.42 118.95 129.41 1fui s ARG 449 Ca 0.10 -0.29 -0.11 0.00 -0.13 0.00 0.00 55.73 55.30 1fui s ARG 449 Cb -0.23 -3.54 -0.01 0.00 -1.56 0.00 0.00 34.95 29.62 1fui s ARG 449 CO 0.08 0.02 0.41 -0.59 -0.81 0.00 0.00 175.30 174.41 1fui s PHE 450 N 1.15 0.43 -0.13 5.12 -0.12 -1.26 -1.09 117.98 122.08 1fui s PHE 450 Ca 0.07 -0.77 0.00 0.00 -0.05 0.00 0.00 56.93 56.18 1fui s PHE 450 Cb -0.14 0.07 0.02 0.00 -0.63 0.00 0.00 43.02 42.35 1fui s PHE 450 CO 0.05 -0.90 -0.12 -1.17 -0.05 0.00 0.00 175.22 173.04 1fui s LEU 451 N -3.01 1.48 0.19 -1.99 0.20 -1.26 -1.95 118.68 112.34 1fui s LEU 451 Ca 0.22 -0.40 -0.30 0.00 0.69 0.00 0.00 54.13 54.34 1fui s LEU 451 Cb 0.01 -1.03 -0.09 0.00 -0.43 0.00 0.00 46.19 44.65 1fui s LEU 451 CO 0.07 -0.08 1.33 -0.89 -0.29 0.00 0.00 176.35 176.49 1fui s THR 452 N 1.53 3.17 0.51 3.68 2.01 -0.76 -4.81 115.64 120.98 1fui s THR 452 Ca 0.04 0.95 -0.23 0.00 0.31 0.00 0.00 61.69 62.76 1fui s THR 452 Cb -0.13 -3.61 -0.06 0.00 0.01 0.00 0.00 72.50 68.72 1fui s THR 452 CO -0.09 0.14 1.35 -1.61 -0.69 0.00 0.00 174.62 173.72 1fui s GLU 453 N 0.00 3.33 0.71 4.92 2.02 -1.14 -4.83 118.70 123.71 1fui s GLU 453 Ca 0.58 2.22 -0.11 0.00 0.02 0.00 0.00 54.97 57.67 1fui s GLU 453 Cb -0.37 -2.36 0.02 0.00 0.10 0.00 0.00 34.13 31.51 1fui s GLU 453 CO 0.38 -1.03 1.10 0.20 0.02 0.00 0.00 175.26 175.92 1fui s GLY 454 N -0.90 1.63 0.00 -1.39 0.00 -1.26 -4.27 107.32 101.12 1fui s GLY 454 Ca 0.68 -0.35 0.00 0.00 0.00 0.00 0.00 44.72 45.06 1fui s GLY 454 CO 0.48 0.03 0.00 0.61 0.00 0.00 0.00 173.10 174.22 1fui n GLY 455 N -2.98 0.50 3.69 0.20 0.00 0.18 -4.84 105.19 101.95 1fui n GLY 455 Ca 0.07 -0.02 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 1fui n GLY 455 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fui s VAL 456 N -2.00 5.31 0.14 1.61 1.01 -1.24 -4.84 120.40 120.40 1fui s VAL 456 Ca 0.00 0.41 -0.31 0.00 0.00 0.00 0.00 61.98 62.08 1fui s VAL 456 Cb 0.00 -3.59 -0.08 0.00 0.00 0.00 0.00 36.38 32.71 1fui s VAL 456 CO 0.00 0.35 1.31 -2.16 0.00 0.00 0.00 175.10 174.60 1fui s PRO 457 N 0.85 4.38 0.09 2.72 0.04 -1.26 -0.88 135.00 140.94 1fui s PRO 457 Ca 0.13 2.00 0.02 0.00 0.04 0.00 0.00 61.00 63.19 1fui s PRO 457 Cb -0.13 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.12 1fui s PRO 457 CO 0.04 -0.31 -0.07 -0.06 0.04 0.00 0.00 177.00 176.65 1fui s PHE 458 N 0.62 0.88 -0.13 0.56 0.08 -0.38 -0.26 117.98 119.35 1fui s PHE 458 Ca 0.60 -0.87 0.00 0.00 0.12 0.00 0.00 56.93 56.77 1fui s PHE 458 Cb -0.35 -0.51 0.02 0.00 -0.57 0.00 0.00 43.02 41.61 1fui s PHE 458 CO 0.34 -0.14 -0.12 0.99 -0.10 0.00 0.00 175.22 176.19 1fui s THR 459 N -3.42 1.38 -0.18 0.64 2.01 -0.05 -0.98 115.64 115.05 1fui s THR 459 Ca 0.10 -0.51 -0.10 0.00 0.31 0.00 0.00 61.69 61.49 1fui s THR 459 Cb 0.04 -1.32 -0.05 0.00 0.01 0.00 0.00 72.50 71.18 1fui s THR 459 CO -0.04 0.43 0.14 -0.32 -0.69 0.00 0.00 174.62 174.14 1fui s MET 460 N 1.54 4.06 0.20 4.92 1.75 0.36 -0.95 119.30 131.18 1fui s MET 460 Ca 0.05 -0.18 0.01 0.00 -1.25 0.00 0.00 55.69 54.31 1fui s MET 460 Cb -0.13 -3.38 -0.05 0.00 2.84 0.00 0.00 34.83 34.12 1fui s MET 460 CO -0.10 0.38 0.07 0.95 -0.65 0.00 0.00 175.02 175.67 1fui s THR 461 N 0.11 0.44 -0.28 10.11 -4.23 -0.37 -0.21 115.64 121.20 1fui s THR 461 Ca 0.10 -1.98 -0.25 0.00 -1.18 0.00 0.00 61.69 58.38 1fui s THR 461 Cb -0.11 -2.37 0.12 0.00 1.34 0.00 0.00 72.50 71.47 1fui s THR 461 CO -0.00 -0.21 1.00 -0.60 -0.54 0.00 0.00 174.62 174.26 1fui s ARG 462 N -4.02 0.54 -0.09 3.99 6.06 -0.80 -1.40 118.95 123.22 1fui s ARG 462 Ca 0.32 0.62 0.00 0.00 -2.50 0.00 0.00 55.73 54.17 1fui s ARG 462 Cb 0.07 0.26 -0.03 0.00 0.06 0.00 0.00 34.95 35.32 1fui s ARG 462 CO 0.09 -0.07 -0.09 0.08 -2.50 0.00 0.00 175.30 172.81 1fui s VAL 463 N 0.20 3.50 0.05 7.11 1.01 -1.26 -0.75 120.40 130.26 1fui s VAL 463 Ca 0.03 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.51 1fui s VAL 463 Cb -0.05 -2.45 -0.03 0.00 0.00 0.00 0.00 36.38 33.86 1fui s VAL 463 CO -0.05 0.56 -0.10 0.20 0.00 0.00 0.00 175.10 175.71 1fui s ASN 464 N -0.36 1.20 -0.26 3.32 0.01 -0.55 -4.71 114.94 113.58 1fui s ASN 464 Ca 0.05 -0.57 -0.08 0.00 -0.71 0.00 0.00 52.86 51.55 1fui s ASN 464 Cb -0.12 -0.00 -0.02 0.00 0.41 0.00 0.00 41.25 41.51 1fui s ASN 464 CO 0.02 -0.14 0.08 -0.63 -1.51 0.00 0.00 177.10 174.92 1fui s ILE 465 N -1.30 4.32 -0.32 0.60 1.01 -1.26 -0.67 121.20 123.57 1fui s ILE 465 Ca -0.06 -0.27 -0.09 0.00 0.00 0.00 0.00 60.65 60.23 1fui s ILE 465 Cb -0.10 -3.07 0.01 0.00 0.01 0.00 0.00 42.46 39.31 1fui s ILE 465 CO 0.01 0.27 0.14 -0.63 0.00 0.00 0.00 174.94 174.73 1fui s ILE 466 N 1.60 4.33 0.19 2.92 -1.09 0.39 -4.97 121.20 124.58 1fui s ILE 466 Ca 0.06 -0.66 -0.33 0.00 -2.23 0.00 0.00 60.65 57.49 1fui s ILE 466 Cb -0.16 -3.28 -0.13 0.00 -1.58 0.00 0.00 42.46 37.31 1fui s ILE 466 CO 0.04 -0.01 1.58 1.17 -1.23 0.00 0.00 174.94 176.49 1fui n LYS 467 N 4.94 2.31 -0.12 2.79 4.81 -1.26 -0.25 118.16 131.37 1fui n LYS 467 Ca -0.13 0.83 0.00 0.00 -0.87 0.00 0.00 58.31 58.14 1fui n LYS 467 Cb 0.48 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 32.93 1fui n LYS 467 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fui n GLY 468 N 3.22 1.10 0.63 3.14 0.00 -1.26 -4.73 105.19 107.28 1fui n GLY 468 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1fui n GLY 468 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1fui n LEU 469 N 0.00 1.06 0.00 0.99 0.00 -0.29 -5.16 117.00 113.60 1fui n LEU 469 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1fui n LEU 469 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.42 1fui n LEU 469 CO 0.00 0.10 0.00 0.61 0.00 0.00 0.00 177.39 178.10 1fui n GLY 470 N 2.67 -0.52 3.82 -3.96 0.00 0.65 -4.98 105.19 102.87 1fui n GLY 470 Ca 0.00 -2.10 -0.33 0.00 0.00 0.00 0.00 46.02 43.59 1fui n GLY 470 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fui s PRO 471 N 0.00 4.10 0.05 1.61 0.04 -1.26 -0.46 135.00 139.08 1fui s PRO 471 Ca 0.00 1.12 0.01 0.00 0.04 0.00 0.00 61.00 62.17 1fui s PRO 471 Cb 0.00 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 1fui s PRO 471 CO 0.00 -0.14 -0.05 0.14 0.04 0.00 0.00 177.00 176.98 1fui s VAL 472 N -2.24 0.40 -0.01 -0.36 -7.23 0.16 -4.04 120.40 107.08 1fui s VAL 472 Ca 0.62 -1.41 0.07 0.00 -1.81 0.00 0.00 61.98 59.44 1fui s VAL 472 Cb -0.10 -0.99 -0.03 0.00 0.56 0.00 0.00 36.38 35.82 1fui s VAL 472 CO 0.18 -0.67 -0.20 -0.22 -0.31 0.00 0.00 175.10 173.87 1fui s LEU 473 N -2.21 2.42 -0.03 1.32 2.96 0.02 -1.49 118.68 121.67 1fui s LEU 473 Ca -0.02 -0.39 0.07 0.00 -0.22 0.00 0.00 54.13 53.57 1fui s LEU 473 Cb -0.02 -1.45 -0.02 0.00 0.50 0.00 0.00 46.19 45.21 1fui s LEU 473 CO -0.04 0.30 -0.25 -1.10 -1.32 0.00 0.00 176.35 173.95 1fui s GLN 474 N -0.93 2.13 0.01 1.98 -0.21 0.07 -1.51 119.66 121.20 1fui s GLN 474 Ca 0.12 -0.88 0.02 0.00 0.02 0.00 0.00 55.36 54.64 1fui s GLN 474 Cb -0.10 -1.99 -0.01 0.00 1.00 0.00 0.00 33.01 31.91 1fui s GLN 474 CO 0.01 0.49 -0.07 0.42 -2.12 0.00 0.00 175.29 174.02 1fui s ILE 475 N -0.47 0.57 -0.27 1.08 1.01 0.37 -1.91 121.20 121.58 1fui s ILE 475 Ca 0.06 -0.53 -0.01 0.00 0.00 0.00 0.00 60.65 60.17 1fui s ILE 475 Cb -0.11 -0.52 0.14 0.00 0.01 0.00 0.00 42.46 41.98 1fui s ILE 475 CO 0.00 0.01 0.33 0.00 0.00 0.00 0.00 174.94 175.28 1fui s ALA 476 N -0.51 -0.74 0.35 9.38 0.00 0.70 -3.73 121.76 127.21 1fui s ALA 476 Ca -0.01 0.13 -0.20 0.00 0.00 0.00 0.00 51.96 51.88 1fui s ALA 476 Cb -0.05 -1.78 -0.10 0.00 0.00 0.00 0.00 23.12 21.20 1fui s ALA 476 CO 0.00 -1.57 0.86 -1.21 0.00 0.00 0.00 175.76 173.85 1fui s GLU 477 N 2.44 4.26 0.00 0.00 2.02 -1.26 -0.49 118.70 125.67 1fui s GLU 477 Ca 0.10 1.02 0.00 0.00 0.02 0.00 0.00 54.97 56.10 1fui s GLU 477 Cb -0.14 -2.49 0.00 0.00 0.10 0.00 0.00 34.13 31.59 1fui s GLU 477 CO -0.26 0.15 0.00 0.41 0.02 0.00 0.00 175.26 175.58 1fui n GLY 478 N -0.08 2.01 3.10 -1.39 0.00 -0.15 -1.41 105.19 107.27 1fui n GLY 478 Ca 0.03 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.51 1fui n GLY 478 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1fui s TRP 479 N -1.50 0.27 0.23 1.61 0.51 -0.31 -1.24 118.94 118.51 1fui s TRP 479 Ca 0.00 -0.63 -0.17 0.00 -2.12 0.00 0.00 56.10 53.19 1fui s TRP 479 Cb 0.00 -0.19 -0.08 0.00 -0.81 0.00 0.00 33.47 32.39 1fui s TRP 479 CO 0.00 -0.36 0.68 -1.54 -0.51 0.00 0.00 176.95 175.21 1fui s SER 480 N -2.28 6.90 0.24 2.95 1.04 -0.06 -0.83 113.70 121.67 1fui s SER 480 Ca -0.03 1.27 0.12 0.00 0.48 0.00 0.00 55.95 57.79 1fui s SER 480 Cb 0.00 -2.37 -0.05 0.00 0.10 0.00 0.00 66.02 63.71 1fui s SER 480 CO -0.06 -0.02 -0.21 0.68 0.98 0.00 0.00 173.24 174.61 1fui s VAL 481 N -1.65 2.40 -0.22 5.02 -7.23 0.12 0.49 120.40 119.33 1fui s VAL 481 Ca 0.45 -2.26 -0.06 0.00 -1.81 0.00 0.00 61.98 58.30 1fui s VAL 481 Cb -0.14 -2.22 -0.03 0.00 0.56 0.00 0.00 36.38 34.55 1fui s VAL 481 CO 0.20 -0.30 0.03 -0.70 -0.31 0.00 0.00 175.10 174.02 1fui s GLU 482 N -3.19 3.63 0.04 4.82 2.12 -1.26 -4.37 118.70 120.48 1fui s GLU 482 Ca 0.26 -0.50 -0.02 0.00 0.36 0.00 0.00 54.97 55.07 1fui s GLU 482 Cb -0.06 -3.19 -0.04 0.00 0.26 0.00 0.00 34.13 31.10 1fui s GLU 482 CO 0.13 -0.08 0.22 -0.51 -0.54 0.00 0.00 175.26 174.47 1fui s LEU 483 N 1.29 4.36 0.29 2.70 1.43 -1.26 -5.02 118.68 122.46 1fui s LEU 483 Ca 0.04 0.34 -0.30 0.00 -1.03 0.00 0.00 54.13 53.18 1fui s LEU 483 Cb -0.15 -2.85 -0.11 0.00 0.03 0.00 0.00 46.19 43.11 1fui s LEU 483 CO 0.02 0.20 1.55 -2.16 0.23 0.00 0.00 176.35 176.19 1fui s PRO 484 N -2.28 4.15 0.16 1.29 0.04 -1.26 -4.68 135.00 132.42 1fui s PRO 484 Ca 0.32 2.52 -0.09 0.00 0.04 0.00 0.00 61.00 63.78 1fui s PRO 484 Cb -0.13 -3.04 0.21 0.00 0.04 0.00 0.00 34.50 31.58 1fui s PRO 484 CO 0.24 -0.57 1.03 0.36 0.04 0.00 0.00 177.00 178.09 1fui n LYS 485 N 2.07 -0.12 -0.15 4.56 -0.00 -1.26 -0.92 118.16 122.33 1fui n LYS 485 Ca 0.07 1.02 -0.03 0.00 -0.00 0.00 0.00 58.31 59.37 1fui n LYS 485 Cb 0.38 -1.52 0.06 0.00 -0.00 0.00 0.00 35.03 33.95 1fui n LYS 485 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 1fui h ASP 486 N 0.00 0.16 -0.17 -5.58 2.03 -2.00 -1.14 116.42 109.72 1fui h ASP 486 Ca 0.26 0.06 -0.02 0.00 -0.73 0.00 0.00 57.03 56.60 1fui h ASP 486 Cb 0.42 0.05 -0.01 0.00 -0.83 0.00 0.00 39.33 38.97 1fui h ASP 486 CO -0.66 0.12 0.02 0.58 -1.03 0.00 0.00 179.24 178.27 1fui h VAL 487 N 0.33 1.23 -0.92 4.15 2.07 -1.38 -2.68 116.25 119.05 1fui h VAL 487 Ca 0.23 -0.75 0.10 0.00 0.82 0.00 0.00 66.70 67.10 1fui h VAL 487 Cb 0.25 1.40 -0.08 0.00 -1.52 0.00 0.00 31.29 31.34 1fui h VAL 487 CO -0.24 0.23 0.57 -0.74 0.02 0.00 0.00 177.57 177.40 1fui h HIS 488 N 0.06 1.03 -0.59 1.57 -0.00 -1.13 -2.27 115.15 113.83 1fui h HIS 488 Ca 0.05 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.35 1fui h HIS 488 Cb 0.32 -0.33 -0.02 0.00 -0.00 0.00 0.00 27.41 27.38 1fui h HIS 488 CO 0.02 0.45 -0.03 -0.44 -0.00 0.00 0.00 177.93 177.93 1fui h ASP 489 N 0.95 1.03 0.18 3.26 3.32 -1.09 0.10 116.42 124.17 1fui h ASP 489 Ca 0.44 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 1fui h ASP 489 Cb 0.36 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.63 1fui h ASP 489 CO -0.23 1.10 -0.09 0.40 -1.72 0.00 0.00 179.24 178.70 1fui h ILE 490 N 0.95 0.85 -0.52 0.35 1.08 -1.10 -1.42 117.51 117.71 1fui h ILE 490 Ca 0.16 -0.13 -0.08 0.00 -0.39 0.00 0.00 64.86 64.43 1fui h ILE 490 Cb 0.59 0.93 -0.02 0.00 -3.07 0.00 0.00 36.82 35.25 1fui h ILE 490 CO 0.04 0.03 0.02 -0.07 -0.69 0.00 0.00 178.15 177.48 1fui h LEU 491 N -0.30 0.87 -0.48 1.44 3.38 -1.38 -2.92 115.31 115.93 1fui h LEU 491 Ca -0.02 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 1fui h LEU 491 Cb 0.23 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1fui h LEU 491 CO 0.04 0.95 0.09 -1.13 0.09 0.00 0.00 178.44 178.49 1fui h ASN 492 N 0.77 0.75 1.32 -0.43 -1.24 -0.70 -2.54 115.58 113.51 1fui h ASN 492 Ca 0.15 -0.25 0.00 0.00 0.71 0.00 0.00 56.30 56.91 1fui h ASN 492 Cb 0.49 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 39.34 1fui h ASN 492 CO 0.02 0.81 0.00 0.07 -1.29 0.00 0.00 177.43 177.04 1fui h LYS 493 N 0.67 0.00 0.00 6.67 2.10 -1.28 -2.74 116.57 121.99 1fui h LYS 493 Ca 0.15 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.80 1fui h LYS 493 Cb 0.37 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.70 1fui h LYS 493 CO 0.01 0.00 -0.25 -0.09 -2.00 0.00 0.00 179.45 177.11 1fui h ARG 494 N 0.00 0.00 0.00 0.07 2.43 -1.30 -3.44 114.38 112.14 1fui h ARG 494 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1fui h ARG 494 Cb 0.66 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1fui h ARG 494 CO 0.00 0.00 0.00 2.41 -1.51 0.00 0.00 179.97 180.87 1fui n THR 495 N -2.55 0.00 -2.94 0.20 -1.04 -0.98 -5.06 114.28 101.91 1fui n THR 495 Ca 0.04 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.94 1fui n THR 495 Cb 0.48 -0.34 -0.02 0.00 -1.82 0.00 0.00 70.33 68.63 1fui n THR 495 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1fui n ASN 496 N -0.21 -2.54 0.26 8.00 4.13 -1.15 -5.04 115.26 118.69 1fui n ASN 496 Ca 0.00 -2.78 0.17 0.00 1.68 0.00 0.00 54.58 53.65 1fui n ASN 496 Cb 0.00 1.08 0.82 0.00 -1.54 0.00 0.00 39.78 40.14 1fui n ASN 496 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 1fui h SER 497 N 5.10 0.00 -0.18 6.41 4.64 -1.80 -1.81 113.55 125.91 1fui h SER 497 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1fui h SER 497 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1fui h SER 497 CO 0.14 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.45 1fui n THR 498 N -3.22 0.23 -4.14 2.95 -2.24 -1.26 -4.93 114.28 101.66 1fui n THR 498 Ca 0.01 -0.37 -0.26 0.00 -2.27 0.00 0.00 64.05 61.16 1fui n THR 498 Cb 0.42 0.40 -0.06 0.00 -2.10 0.00 0.00 70.33 68.99 1fui n THR 498 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 1fui s TRP 499 N -1.77 3.01 0.20 4.78 0.51 -0.68 -4.37 118.94 120.62 1fui s TRP 499 Ca 0.32 -0.08 -0.30 0.00 -2.12 0.00 0.00 56.10 53.92 1fui s TRP 499 Cb 0.17 -1.43 -0.09 0.00 -0.81 0.00 0.00 33.47 31.31 1fui s TRP 499 CO 0.26 0.53 1.38 -1.25 -0.51 0.00 0.00 176.95 177.35 1fui s PRO 500 N -3.16 4.33 0.05 4.98 0.04 -1.22 -4.59 135.00 135.43 1fui s PRO 500 Ca 0.30 2.15 0.07 0.00 0.04 0.00 0.00 61.00 63.56 1fui s PRO 500 Cb -0.09 -3.17 -0.03 0.00 0.04 0.00 0.00 34.50 31.24 1fui s PRO 500 CO 0.22 -0.35 -0.16 0.99 0.04 0.00 0.00 177.00 177.73 1fui s THR 501 N 0.28 2.94 -0.13 1.26 2.01 -0.82 -3.94 115.64 117.24 1fui s THR 501 Ca 0.59 -1.20 -0.04 0.00 0.31 0.00 0.00 61.69 61.35 1fui s THR 501 Cb -0.39 -2.28 0.07 0.00 0.01 0.00 0.00 72.50 69.91 1fui s THR 501 CO 0.38 0.28 0.21 -0.89 -0.69 0.00 0.00 174.62 173.92 1fui s THR 502 N -0.99 -0.33 -0.19 -0.82 2.01 -0.79 -1.82 115.64 112.69 1fui s THR 502 Ca 0.16 0.19 -0.18 0.00 0.31 0.00 0.00 61.69 62.17 1fui s THR 502 Cb -0.11 -0.46 -0.03 0.00 0.01 0.00 0.00 72.50 71.91 1fui s THR 502 CO 0.07 0.03 0.49 0.26 -0.69 0.00 0.00 174.62 174.79 1fui s TRP 503 N 2.34 3.38 -0.07 4.92 0.52 -1.26 -1.65 118.94 127.13 1fui s TRP 503 Ca 0.04 0.75 0.05 0.00 0.02 0.00 0.00 56.10 56.96 1fui s TRP 503 Cb -0.13 -2.64 -0.01 0.00 -1.15 0.00 0.00 33.47 29.54 1fui s TRP 503 CO -0.09 -0.07 -0.22 0.12 0.02 0.00 0.00 176.95 176.72 1fui s PHE 504 N 1.51 2.52 -0.25 -1.98 5.36 -0.36 -0.70 117.98 124.08 1fui s PHE 504 Ca 0.23 -0.64 0.01 0.00 -0.96 0.00 0.00 56.93 55.57 1fui s PHE 504 Cb -0.15 -1.64 0.06 0.00 -0.34 0.00 0.00 43.02 40.96 1fui s PHE 504 CO 0.09 -0.16 -0.05 0.00 -1.46 0.00 0.00 175.22 173.64 1fui s ALA 505 N -0.17 2.08 0.40 11.12 0.00 -0.01 -0.82 121.76 134.36 1fui s ALA 505 Ca -0.03 -1.50 -0.24 0.00 0.00 0.00 0.00 51.96 50.19 1fui s ALA 505 Cb -0.14 -1.50 -0.09 0.00 0.00 0.00 0.00 23.12 21.40 1fui s ALA 505 CO 0.04 -1.25 1.08 -1.25 0.00 0.00 0.00 175.76 174.38 1fui s PRO 506 N 1.34 4.14 0.04 0.00 0.04 -1.26 -1.16 135.00 138.14 1fui s PRO 506 Ca -0.04 1.60 -0.31 0.00 0.04 0.00 0.00 61.00 62.29 1fui s PRO 506 Cb -0.19 -2.59 -0.06 0.00 0.04 0.00 0.00 34.50 31.70 1fui s PRO 506 CO -0.07 -0.18 1.32 0.50 0.04 0.00 0.00 177.00 178.60 1fui s ARG 507 N -2.42 4.35 0.21 4.56 3.52 -0.50 -4.94 118.95 123.73 1fui s ARG 507 Ca 0.57 1.90 -0.11 0.00 -0.13 0.00 0.00 55.73 57.97 1fui s ARG 507 Cb -0.24 -3.41 -0.07 0.00 -1.56 0.00 0.00 34.95 29.66 1fui s ARG 507 CO 0.31 -0.43 0.55 -0.51 -0.81 0.00 0.00 175.30 174.41 1fui s LEU 508 N 1.62 4.22 -0.00 -0.88 1.43 -1.26 -4.92 118.68 118.89 1fui s LEU 508 Ca 0.62 0.97 0.05 0.00 -1.03 0.00 0.00 54.13 54.74 1fui s LEU 508 Cb -0.32 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.28 1fui s LEU 508 CO 0.28 -0.02 0.17 0.35 0.23 0.00 0.00 176.35 177.36 1fui n THR 509 N 0.15 0.00 -0.07 5.49 -2.24 -0.39 -5.01 114.28 112.20 1fui n THR 509 Ca -0.01 -0.29 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 1fui n THR 509 Cb 0.52 0.77 0.00 0.00 -2.10 0.00 0.00 70.33 69.53 1fui n THR 509 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fui n GLY 510 N 1.52 1.77 3.34 3.38 0.00 -0.08 -4.98 105.19 110.13 1fui n GLY 510 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1fui n GLY 510 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fui s LYS 511 N -0.37 1.27 4.63 1.61 1.02 -1.25 -4.57 119.74 122.07 1fui s LYS 511 Ca 0.00 -1.28 0.00 0.00 0.02 0.00 0.00 55.97 54.71 1fui s LYS 511 Cb 0.00 -1.62 0.00 0.00 -0.52 0.00 0.00 37.83 35.69 1fui s LYS 511 CO 0.00 0.37 0.00 0.41 -0.92 0.00 0.00 175.35 175.21 1fui n GLY 512 N 0.90 2.63 0.02 -3.33 0.00 -1.26 -1.67 105.19 102.47 1fui n GLY 512 Ca -0.18 -0.33 0.04 0.00 0.00 0.00 0.00 46.02 45.56 1fui n GLY 512 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1fui n PRO 513 N 14.00 0.02 -1.28 1.61 -0.02 -1.26 -2.66 135.00 145.41 1fui n PRO 513 Ca 0.00 0.40 -0.23 0.00 -2.02 0.00 0.00 63.50 61.65 1fui n PRO 513 Cb 0.00 -1.55 0.13 0.00 -0.02 0.00 0.00 33.50 32.06 1fui n PRO 513 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1fui n PHE 514 N -1.59 2.63 0.07 6.00 3.72 -0.67 -1.79 117.46 125.84 1fui n PHE 514 Ca 0.01 -2.26 -0.22 0.00 -0.05 0.00 0.00 57.45 54.94 1fui n PHE 514 Cb 0.09 -0.94 -0.12 0.00 -0.94 0.00 0.00 39.48 37.57 1fui n PHE 514 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1fui h THR 515 N 1.16 1.28 -3.30 4.37 2.02 -1.57 0.19 112.91 117.06 1fui h THR 515 Ca 0.50 -2.38 0.00 0.00 0.77 0.00 0.00 66.41 65.30 1fui h THR 515 Cb 1.71 2.57 -0.06 0.00 -1.74 0.00 0.00 68.15 70.63 1fui h THR 515 CO 1.06 0.73 0.08 1.51 0.37 0.00 0.00 175.52 179.27 1fui s ASP 516 N -7.38 -0.13 0.37 4.18 1.47 -1.26 -4.51 116.67 109.40 1fui s ASP 516 Ca -0.10 -0.81 0.06 0.00 1.18 0.00 0.00 52.55 52.89 1fui s ASP 516 Cb 0.06 0.68 0.73 0.00 -0.34 0.00 0.00 42.92 44.04 1fui s ASP 516 CO 0.93 -1.29 1.95 0.58 0.68 0.00 0.00 175.17 178.02 1fui h VAL 517 N 2.11 1.16 -0.76 2.11 2.07 -1.90 -2.41 116.25 118.63 1fui h VAL 517 Ca -0.23 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 66.72 1fui h VAL 517 Cb 1.25 0.83 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 1fui h VAL 517 CO 0.30 0.20 0.47 0.22 0.02 0.00 0.00 177.57 178.78 1fui h TYR 518 N 0.48 0.99 -0.51 1.57 3.20 -1.93 -2.70 116.97 118.08 1fui h TYR 518 Ca 0.11 0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.93 1fui h TYR 518 Cb 0.20 -0.33 -0.02 0.00 1.54 0.00 0.00 36.73 38.12 1fui h TYR 518 CO 0.01 0.66 0.09 0.77 -1.64 0.00 0.00 178.16 178.04 1fui h SER 519 N 1.03 0.74 -0.16 -2.11 0.02 -1.65 0.34 113.55 111.76 1fui h SER 519 Ca 0.27 -0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1fui h SER 519 Cb -0.05 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 1fui h SER 519 CO -0.05 0.76 0.10 0.58 -1.14 0.00 0.00 176.83 177.08 1fui h VAL 520 N 0.76 1.06 0.10 2.27 2.07 -1.04 -1.44 116.25 120.04 1fui h VAL 520 Ca 0.16 -0.15 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 1fui h VAL 520 Cb 0.33 0.87 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1fui h VAL 520 CO 0.00 0.06 -0.05 -0.03 0.02 0.00 0.00 177.57 177.58 1fui h MET 521 N 0.20 -0.13 -0.18 1.57 -1.53 -1.24 -2.82 114.93 110.79 1fui h MET 521 Ca 0.06 0.01 0.05 0.00 -3.44 0.00 0.00 59.70 56.38 1fui h MET 521 Cb 0.01 0.03 -0.01 0.00 -0.55 0.00 0.00 31.60 31.08 1fui h MET 521 CO -0.01 0.04 0.15 0.00 0.14 0.00 0.00 176.91 177.23 1fui h ALA 522 N 0.59 1.99 -0.64 0.39 0.00 -0.85 -1.60 119.26 119.15 1fui h ALA 522 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1fui h ALA 522 Cb 0.24 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1fui h ALA 522 CO 0.02 -0.24 0.00 0.09 0.00 0.00 0.00 179.25 179.13 1fui n ASN 523 N -4.19 3.68 -4.76 0.00 3.02 -0.55 -4.94 115.26 107.52 1fui n ASN 523 Ca 0.01 -1.99 -0.40 0.00 -0.03 0.00 0.00 54.58 52.17 1fui n ASN 523 Cb 0.28 -0.42 -0.05 0.00 -0.61 0.00 0.00 39.78 38.98 1fui n ASN 523 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 1fui s TRP 524 N -1.16 3.68 -2.14 3.10 -0.11 -0.60 -4.94 118.94 116.77 1fui s TRP 524 Ca 0.45 1.76 0.16 0.00 1.22 0.00 0.00 56.10 59.69 1fui s TRP 524 Cb 0.24 -3.21 0.59 0.00 -1.50 0.00 0.00 33.47 29.59 1fui s TRP 524 CO 0.32 -0.29 1.43 0.41 -4.62 0.00 0.00 176.95 174.20 1fui n GLY 525 N 1.26 0.20 3.82 5.86 0.00 -1.26 -4.93 105.19 110.14 1fui n GLY 525 Ca -0.01 -0.35 -0.08 0.00 0.00 0.00 0.00 46.02 45.58 1fui n GLY 525 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fui s ALA 526 N -1.73 -0.92 -2.49 4.61 0.00 -1.26 -5.01 121.76 114.95 1fui s ALA 526 Ca 0.27 -0.67 0.25 0.00 0.00 0.00 0.00 51.96 51.81 1fui s ALA 526 Cb 0.14 0.69 0.78 0.00 0.00 0.00 0.00 23.12 24.74 1fui s ALA 526 CO 0.21 -1.00 1.59 0.27 0.00 0.00 0.00 175.76 176.82 1fui n ASN 527 N -1.38 1.92 -4.40 0.00 6.94 -1.26 -4.90 115.26 112.18 1fui n ASN 527 Ca -0.07 -1.68 -0.21 0.00 -0.02 0.00 0.00 54.58 52.60 1fui n ASN 527 Cb 0.60 -0.06 -0.10 0.00 -2.36 0.00 0.00 39.78 37.86 1fui n ASN 527 CO 0.00 0.00 0.00 -1.00 -1.03 0.00 0.00 177.26 175.23 1fui s HIS 528 N -1.89 1.97 0.28 -2.53 3.76 -1.26 -1.08 115.29 114.54 1fui s HIS 528 Ca 0.35 -0.47 -0.16 0.00 -0.15 0.00 0.00 55.06 54.62 1fui s HIS 528 Cb 0.20 -0.89 0.01 0.00 1.11 0.00 0.00 32.58 33.01 1fui s HIS 528 CO 0.31 0.51 0.62 0.20 -0.85 0.00 0.00 174.74 175.53 1fui s GLY 529 N -3.41 0.27 -0.01 -2.22 0.00 -0.43 -4.83 107.32 96.69 1fui s GLY 529 Ca 0.26 -0.63 0.04 0.00 0.00 0.00 0.00 44.72 44.40 1fui s GLY 529 CO 0.11 -0.36 -0.14 0.14 0.00 0.00 0.00 173.10 172.85 1fui s VAL 530 N -3.77 1.09 -0.18 1.40 1.01 -0.49 -2.00 120.40 117.45 1fui s VAL 530 Ca 0.17 -0.61 -0.03 0.00 0.00 0.00 0.00 61.98 61.51 1fui s VAL 530 Cb -0.04 -0.91 -0.02 0.00 0.00 0.00 0.00 36.38 35.42 1fui s VAL 530 CO 0.09 0.29 -0.05 -0.76 0.00 0.00 0.00 175.10 174.67 1fui s LEU 531 N -0.36 3.01 -0.05 3.92 1.02 -0.39 -1.24 118.68 124.59 1fui s LEU 531 Ca 0.05 -0.27 0.06 0.00 0.02 0.00 0.00 54.13 53.99 1fui s LEU 531 Cb -0.05 -1.74 -0.01 0.00 0.02 0.00 0.00 46.19 44.40 1fui s LEU 531 CO -0.00 0.09 -0.24 -0.89 0.02 0.00 0.00 176.35 175.32 1fui s THR 532 N 0.85 2.13 0.43 5.49 2.01 -0.13 -2.05 115.64 124.37 1fui s THR 532 Ca -0.01 -1.05 -0.26 0.00 0.31 0.00 0.00 61.69 60.68 1fui s THR 532 Cb -0.15 -1.77 -0.09 0.00 0.01 0.00 0.00 72.50 70.51 1fui s THR 532 CO 0.01 0.57 1.46 0.00 -0.69 0.00 0.00 174.62 175.97 1fui n ILE 533 N 2.82 2.59 -1.44 1.82 0.13 -1.26 -0.87 119.36 123.14 1fui n ILE 533 Ca -0.17 -0.50 0.00 0.00 -1.10 0.00 0.00 62.75 60.98 1fui n ILE 533 Cb 0.52 -1.90 0.00 0.00 -0.84 0.00 0.00 39.64 37.42 1fui n ILE 533 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1fui n GLY 534 N 0.53 -2.35 3.21 4.50 0.00 0.64 -4.60 105.19 107.11 1fui n GLY 534 Ca 0.04 -1.58 -0.40 0.00 0.00 0.00 0.00 46.02 44.08 1fui n GLY 534 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1fui s HIS 535 N -0.58 3.86 -0.30 1.61 3.76 -1.26 -2.30 115.29 120.08 1fui s HIS 535 Ca 0.00 -2.68 0.11 0.00 -0.15 0.00 0.00 55.06 52.33 1fui s HIS 535 Cb 0.00 -3.49 0.65 0.00 1.11 0.00 0.00 32.58 30.85 1fui s HIS 535 CO 0.00 -0.86 1.67 1.33 -0.85 0.00 0.00 174.74 176.03 1fui n VAL 536 N 2.97 2.76 -0.35 -0.90 0.24 -1.26 -4.66 118.33 117.12 1fui n VAL 536 Ca 0.18 -1.95 -0.01 0.00 -2.04 0.00 0.00 64.34 60.52 1fui n VAL 536 Cb 0.40 -0.34 0.12 0.00 -1.47 0.00 0.00 33.84 32.55 1fui n VAL 536 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 1fui h GLY 537 N 1.99 1.35 1.35 7.63 0.00 -1.97 -1.82 103.07 111.61 1fui h GLY 537 Ca 0.24 -0.47 0.03 0.00 0.00 0.00 0.00 47.33 47.12 1fui h GLY 537 CO 0.60 0.42 0.37 0.00 0.00 0.00 0.00 176.54 177.93 1fui h ALA 538 N 1.37 1.69 -0.24 3.60 0.00 -1.87 0.69 119.26 124.50 1fui h ALA 538 Ca 0.37 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 1fui h ALA 538 Cb -0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.56 1fui h ALA 538 CO -0.11 0.25 -0.40 -0.44 0.00 0.00 0.00 179.25 178.55 1fui h ASP 539 N 0.67 0.78 -0.44 0.00 3.32 -1.70 -2.19 116.42 116.85 1fui h ASP 539 Ca 0.22 -0.53 -0.05 0.00 0.02 0.00 0.00 57.03 56.70 1fui h ASP 539 Cb 0.06 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.37 1fui h ASP 539 CO -0.06 1.16 0.11 -0.26 -1.72 0.00 0.00 179.24 178.46 1fui h PHE 540 N 0.43 0.80 -0.33 4.55 0.04 -0.82 -0.56 116.94 121.05 1fui h PHE 540 Ca 0.02 -0.07 -0.04 0.00 2.80 0.00 0.00 57.97 60.67 1fui h PHE 540 Cb 1.00 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.90 1fui h PHE 540 CO 0.08 0.69 0.04 0.82 -0.60 0.00 0.00 178.31 179.34 1fui h ILE 541 N 0.75 1.24 -0.47 -0.55 2.04 -0.76 0.33 117.51 120.10 1fui h ILE 541 Ca 0.16 -0.85 -0.04 0.00 1.00 0.00 0.00 64.86 65.13 1fui h ILE 541 Cb 0.30 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.52 1fui h ILE 541 CO 0.00 0.28 0.13 0.74 0.00 0.00 0.00 178.15 179.30 1fui h THR 542 N 0.38 1.23 -0.81 -0.27 2.02 -1.12 -1.57 112.91 112.76 1fui h THR 542 Ca 0.10 -0.80 -0.02 0.00 0.77 0.00 0.00 66.41 66.46 1fui h THR 542 Cb 0.37 0.86 -0.04 0.00 -1.74 0.00 0.00 68.15 67.60 1fui h THR 542 CO 0.01 0.29 0.41 0.25 0.37 0.00 0.00 175.52 176.85 1fui h LEU 543 N 0.62 1.05 -0.70 2.58 5.85 -0.94 -2.44 115.31 121.33 1fui h LEU 543 Ca 0.15 -0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.65 1fui h LEU 543 Cb 0.30 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1fui h LEU 543 CO -0.00 0.87 -0.07 0.00 -0.34 0.00 0.00 178.44 178.90 1fui h ALA 544 N 1.22 0.90 0.00 1.25 0.00 -0.61 -2.25 119.26 119.77 1fui h ALA 544 Ca 0.28 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 1fui h ALA 544 Cb 0.09 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1fui h ALA 544 CO -0.04 0.64 -0.23 0.66 0.00 0.00 0.00 179.25 180.28 1fui h SER 545 N 0.84 0.00 0.67 0.00 4.64 -0.90 0.60 113.55 119.39 1fui h SER 545 Ca 0.14 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.34 1fui h SER 545 Cb 0.60 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.67 1fui h SER 545 CO 0.04 0.23 -0.57 0.24 -0.87 0.00 0.00 176.83 175.90 1fui h MET 546 N 0.00 0.00 -0.02 4.77 2.07 -0.96 -3.06 114.93 117.73 1fui h MET 546 Ca -0.00 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.63 1fui h MET 546 Cb 0.41 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.14 1fui h MET 546 CO 0.03 0.57 -0.16 1.28 1.07 0.00 0.00 176.91 179.70 1fui n LEU 547 N -3.75 2.26 -3.36 1.22 4.77 -0.80 -4.88 117.00 112.46 1fui n LEU 547 Ca -0.01 -0.77 -0.22 0.00 -0.03 0.00 0.00 56.01 54.99 1fui n LEU 547 Cb 0.59 -0.01 0.07 0.00 -2.33 0.00 0.00 43.42 41.74 1fui n LEU 547 CO 0.41 0.39 0.22 0.54 -1.33 0.00 0.00 177.39 177.62 1fui n ARG 548 N 0.55 -7.33 -3.71 3.23 3.00 0.09 -4.47 116.66 108.02 1fui n ARG 548 Ca 0.13 0.77 -0.38 0.00 -0.01 0.00 0.00 57.85 58.37 1fui n ARG 548 Cb 0.49 -5.64 -0.12 0.00 0.00 0.00 0.00 32.46 27.19 1fui n ARG 548 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 1fui s ILE 549 N -3.30 4.39 0.39 0.55 1.01 -0.54 -4.83 121.20 118.87 1fui s ILE 549 Ca 0.51 -0.39 -0.26 0.00 0.00 0.00 0.00 60.65 60.50 1fui s ILE 549 Cb -0.22 -3.18 -0.09 0.00 0.01 0.00 0.00 42.46 38.98 1fui s ILE 549 CO 0.68 0.16 1.29 -2.84 0.00 0.00 0.00 174.94 174.22 1fui s PRO 550 N 1.59 4.03 -0.55 2.79 0.02 -1.26 -4.48 135.00 137.14 1fui s PRO 550 Ca 0.05 2.13 -0.18 0.00 0.02 0.00 0.00 61.00 63.02 1fui s PRO 550 Cb -0.16 -2.79 0.09 0.00 0.02 0.00 0.00 34.50 31.66 1fui s PRO 550 CO 0.05 -0.43 0.63 0.08 -0.33 0.00 0.00 177.00 176.99 1fui s VAL 551 N -1.26 4.92 -0.90 3.83 1.01 -1.26 -0.80 120.40 125.94 1fui s VAL 551 Ca 0.56 -0.93 0.28 0.00 0.00 0.00 0.00 61.98 61.88 1fui s VAL 551 Cb -0.38 -4.39 0.25 0.00 0.00 0.00 0.00 36.38 31.87 1fui s VAL 551 CO 0.48 -0.96 1.86 0.00 0.00 0.00 0.00 175.10 176.48 1fui s MET 553 N -3.04 0.67 0.01 0.00 -2.45 -1.24 -5.05 119.30 108.19 1fui s MET 553 Ca 0.13 1.14 -0.28 0.00 -1.25 0.00 0.00 55.69 55.42 1fui s MET 553 Cb 0.16 0.14 0.10 0.00 1.25 0.00 0.00 34.83 36.48 1fui s MET 553 CO 0.54 -0.14 0.85 -3.38 1.05 0.00 0.00 175.02 173.95 1fui s HIS 554 N 1.55 -0.38 -0.20 4.11 -3.43 -1.24 -0.48 115.29 115.22 1fui s HIS 554 Ca -0.09 0.25 0.12 0.00 -0.80 0.00 0.00 55.06 54.54 1fui s HIS 554 Cb -0.05 0.54 0.43 0.00 -1.43 0.00 0.00 32.58 32.07 1fui s HIS 554 CO -0.18 -0.58 1.21 0.27 -2.00 0.00 0.00 174.74 173.46 1fui n ASN 555 N -0.22 2.02 -4.82 7.38 6.94 -1.26 -5.00 115.26 120.31 1fui n ASN 555 Ca -0.10 -3.67 -0.36 0.00 -0.02 0.00 0.00 54.58 50.43 1fui n ASN 555 Cb 0.62 -0.48 -0.06 0.00 -2.36 0.00 0.00 39.78 37.50 1fui n ASN 555 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1fui s VAL 556 N -3.08 4.60 0.29 3.53 1.01 -1.26 -4.90 120.40 120.58 1fui s VAL 556 Ca 0.39 1.23 -0.30 0.00 0.00 0.00 0.00 61.98 63.30 1fui s VAL 556 Cb 0.38 -3.84 -0.11 0.00 0.00 0.00 0.00 36.38 32.81 1fui s VAL 556 CO -0.07 0.20 1.56 -1.61 0.00 0.00 0.00 175.10 175.19 1fui s GLU 557 N -2.00 4.15 0.37 2.72 2.02 -1.26 -4.89 118.70 119.81 1fui s GLU 557 Ca 0.43 2.53 0.12 0.00 0.02 0.00 0.00 54.97 58.07 1fui s GLU 557 Cb -0.16 -3.04 0.92 0.00 0.10 0.00 0.00 34.13 31.95 1fui s GLU 557 CO 0.21 -0.59 1.84 1.49 0.02 0.00 0.00 175.26 178.23 1fui h GLU 558 N 4.84 0.56 0.00 1.61 4.81 -1.99 0.46 114.58 124.87 1fui h GLU 558 Ca -0.47 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.73 1fui h GLU 558 Cb 1.22 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.47 1fui h GLU 558 CO 0.79 0.37 0.00 1.79 -0.73 0.00 0.00 179.01 181.23 1fui h THR 559 N 0.58 0.00 -0.06 0.32 1.35 -2.05 -2.77 112.91 110.28 1fui h THR 559 Ca 0.49 -0.36 0.00 0.00 -0.55 0.00 0.00 66.41 65.99 1fui h THR 559 Cb 0.97 1.22 0.00 0.00 -1.73 0.00 0.00 68.15 68.61 1fui h THR 559 CO -0.23 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.33 1fui n LYS 560 N -2.68 1.86 -2.89 4.72 5.02 0.15 -4.88 118.16 119.47 1fui n LYS 560 Ca 0.01 -1.25 -0.41 0.00 -2.02 0.00 0.00 58.31 54.63 1fui n LYS 560 Cb 0.26 -1.46 -0.04 0.00 -0.02 0.00 0.00 35.03 33.76 1fui n LYS 560 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1fui s VAL 561 N -1.94 4.88 -0.21 -0.18 -7.23 -1.05 -4.80 120.40 109.88 1fui s VAL 561 Ca 0.35 1.65 0.00 0.00 -1.81 0.00 0.00 61.98 62.17 1fui s VAL 561 Cb 0.20 -4.14 0.05 0.00 0.56 0.00 0.00 36.38 33.05 1fui s VAL 561 CO 0.32 0.03 -0.07 -0.47 -0.31 0.00 0.00 175.10 174.60 1fui s TYR 562 N 2.09 2.25 0.27 2.82 5.04 -1.26 -5.10 117.35 123.46 1fui s TYR 562 Ca 0.39 -1.55 0.02 0.00 -2.44 0.00 0.00 57.07 53.49 1fui s TYR 562 Cb -0.17 -1.54 -0.04 0.00 0.35 0.00 0.00 41.96 40.56 1fui s TYR 562 CO 0.13 -0.73 0.15 1.03 -1.34 0.00 0.00 175.55 174.79 1fui s ARG 563 N 1.45 1.45 0.55 4.97 0.52 -1.26 -4.08 118.95 122.54 1fui s ARG 563 Ca -0.03 -1.80 -0.21 0.00 -0.52 0.00 0.00 55.73 53.17 1fui s ARG 563 Cb -0.17 0.01 -0.06 0.00 0.52 0.00 0.00 34.95 35.25 1fui s ARG 563 CO -0.07 -0.42 1.09 -2.30 0.02 0.00 0.00 175.30 173.62 1fui n PRO 564 N -0.47 1.22 0.31 3.54 -0.02 -1.26 -4.67 135.00 133.66 1fui n PRO 564 Ca 0.02 0.46 0.18 0.00 -2.02 0.00 0.00 63.50 62.13 1fui n PRO 564 Cb 0.65 -2.26 1.01 0.00 -0.02 0.00 0.00 33.50 32.88 1fui n PRO 564 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1fui h SER 565 N 0.98 0.00 0.17 2.55 4.64 -1.32 -2.28 113.55 118.28 1fui h SER 565 Ca -0.48 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.82 1fui h SER 565 Cb 1.34 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.43 1fui h SER 565 CO 0.54 0.01 -0.06 0.00 -0.87 0.00 0.00 176.83 176.45 1fui h ALA 566 N 1.99 1.40 -0.96 5.18 0.00 -1.89 -2.58 119.26 122.41 1fui h ALA 566 Ca -0.00 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.91 1fui h ALA 566 Cb 0.03 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.75 1fui h ALA 566 CO 0.00 0.07 0.63 -1.49 0.00 0.00 0.00 179.25 178.46 1fui h TRP 567 N 0.00 1.15 -0.29 0.00 -0.00 -1.76 -1.74 115.95 113.32 1fui h TRP 567 Ca -0.00 0.03 0.03 0.00 -0.00 0.00 0.00 58.89 58.95 1fui h TRP 567 Cb 0.16 -0.38 -0.01 0.00 -0.00 0.00 0.00 29.16 28.92 1fui h TRP 567 CO 0.00 0.64 0.19 0.00 -0.00 0.00 0.00 178.44 179.27 1fui h ALA 568 N 1.46 1.95 0.00 1.49 0.00 -1.67 0.12 119.26 122.61 1fui h ALA 568 Ca 0.39 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.29 1fui h ALA 568 Cb 0.08 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1fui h ALA 568 CO -0.14 0.01 -0.00 0.00 0.00 0.00 0.00 179.25 179.12 1fui h ALA 569 N 1.84 1.00 -0.10 0.00 0.00 -1.45 -1.99 119.26 118.55 1fui h ALA 569 Ca 0.12 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1fui h ALA 569 Cb 0.16 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1fui h ALA 569 CO -0.02 0.01 0.00 0.72 0.00 0.00 0.00 179.25 179.95 1fui n HIS 570 N -3.10 0.13 0.00 0.00 -0.00 0.03 -5.01 115.22 107.27 1fui n HIS 570 Ca -0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 57.72 57.65 1fui n HIS 570 Cb 0.24 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.23 1fui n HIS 570 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1fui n GLY 571 N 1.08 4.13 0.14 -1.41 0.00 -0.75 -4.03 105.19 104.36 1fui n GLY 571 Ca 0.17 -1.57 0.02 0.00 0.00 0.00 0.00 46.02 44.64 1fui n GLY 571 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1fui h MET 572 N 0.00 0.00 -6.37 1.61 0.00 -1.92 -3.41 114.93 104.84 1fui h MET 572 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 59.70 59.16 1fui h MET 572 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 31.60 31.60 1fui h MET 572 CO 0.00 0.53 0.81 0.34 0.00 0.00 0.00 176.91 178.58 1fui s ASP 573 N -6.48 6.88 0.42 1.22 2.15 -1.26 -4.91 116.67 114.70 1fui s ASP 573 Ca 0.02 2.07 0.13 0.00 0.43 0.00 0.00 52.55 55.20 1fui s ASP 573 Cb 0.09 -2.56 0.99 0.00 -0.30 0.00 0.00 42.92 41.14 1fui s ASP 573 CO 0.74 -0.69 1.97 0.40 -0.17 0.00 0.00 175.17 177.41 1fui h ILE 574 N 4.91 0.91 0.07 4.11 1.08 -2.00 -0.46 117.51 126.12 1fui h ILE 574 Ca -0.37 -0.16 -0.27 0.00 -0.39 0.00 0.00 64.86 63.66 1fui h ILE 574 Cb 1.18 0.40 -0.02 0.00 -3.07 0.00 0.00 36.82 35.31 1fui h ILE 574 CO 0.90 0.08 -1.47 -0.08 -0.69 0.00 0.00 178.15 176.89 1fui h GLU 575 N 0.46 0.14 -0.40 2.37 4.81 -1.95 -3.32 114.58 116.70 1fui h GLU 575 Ca 0.29 -0.25 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1fui h GLU 575 Cb 0.52 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.97 1fui h GLU 575 CO -0.09 1.12 0.23 0.78 -0.73 0.00 0.00 179.01 180.32 1fui h GLY 576 N -0.11 0.55 1.52 1.92 0.00 -1.91 -1.47 103.07 103.57 1fui h GLY 576 Ca -0.35 -0.17 0.02 0.00 0.00 0.00 0.00 47.33 46.83 1fui h GLY 576 CO -0.04 0.15 0.28 0.06 0.00 0.00 0.00 176.54 176.99 1fui h GLN 577 N 0.47 0.49 -0.03 4.80 3.07 -1.22 -1.69 115.11 121.00 1fui h GLN 577 Ca 0.16 -0.03 -0.02 0.00 0.09 0.00 0.00 58.65 58.85 1fui h GLN 577 Cb 0.01 -0.11 0.00 0.00 0.08 0.00 0.00 27.48 27.46 1fui h GLN 577 CO -0.08 0.33 -0.05 0.22 0.09 0.00 0.00 178.83 179.34 1fui h ASP 578 N 0.51 0.08 -0.62 0.06 3.58 -1.42 -0.13 116.42 118.48 1fui h ASP 578 Ca 0.17 -0.56 -0.08 0.00 0.42 0.00 0.00 57.03 56.98 1fui h ASP 578 Cb 0.04 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.04 1fui h ASP 578 CO -0.04 0.62 0.08 1.88 -2.88 0.00 0.00 179.24 178.91 1fui h TYR 579 N -0.45 1.10 -0.18 0.28 -1.99 -1.14 -1.25 116.97 113.35 1fui h TYR 579 Ca 0.00 -0.16 -0.02 0.00 2.00 0.00 0.00 58.73 60.55 1fui h TYR 579 Cb 0.61 -0.30 -0.01 0.00 2.00 0.00 0.00 36.73 39.03 1fui h TYR 579 CO 0.12 0.95 0.03 0.00 -0.00 0.00 0.00 178.16 179.25 1fui h ARG 580 N 0.94 0.29 -0.47 4.88 3.08 -1.35 -2.13 114.38 119.64 1fui h ARG 580 Ca 0.19 -0.08 -0.04 0.00 0.07 0.00 0.00 59.98 60.12 1fui h ARG 580 Cb 0.45 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.45 1fui h ARG 580 CO 0.02 0.46 0.14 0.00 -1.07 0.00 0.00 179.97 179.52 1fui h ALA 581 N 0.82 0.61 -0.55 0.04 0.00 -0.98 -1.50 119.26 117.70 1fui h ALA 581 Ca 0.05 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 1fui h ALA 581 Cb 0.31 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 1fui h ALA 581 CO 0.00 0.27 0.12 0.00 0.00 0.00 0.00 179.25 179.65 1fui h GLN 583 N 0.82 0.63 0.52 0.00 4.15 -1.21 -0.90 115.11 119.12 1fui h GLN 583 Ca 0.18 -0.33 -0.03 0.00 0.77 0.00 0.00 58.65 59.24 1fui h GLN 583 Cb 0.31 0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.02 1fui h GLN 583 CO 0.00 0.94 -0.25 -0.97 -1.93 0.00 0.00 178.83 176.62 1fui h ASN 584 N 0.51 -0.60 0.21 -0.69 -0.73 -0.57 -3.34 115.58 110.38 1fui h ASN 584 Ca 0.04 0.02 -0.14 0.00 1.87 0.00 0.00 56.30 58.09 1fui h ASN 584 Cb 0.95 0.15 -0.01 0.00 0.27 0.00 0.00 38.32 39.69 1fui h ASN 584 CO 0.09 -0.38 -0.54 1.88 -0.37 0.00 0.00 177.43 178.11 1fui h TYR 585 N -0.80 0.44 -1.45 0.67 0.05 -1.19 -3.50 116.97 111.19 1fui h TYR 585 Ca -0.07 -0.15 0.11 0.00 0.05 0.00 0.00 58.73 58.66 1fui h TYR 585 Cb 0.54 -0.08 -0.03 0.00 1.01 0.00 0.00 36.73 38.17 1fui h TYR 585 CO 0.07 0.81 -0.14 0.41 -1.05 0.00 0.00 178.16 178.26 1fui n GLY 586 N 0.16 -1.75 3.66 3.88 0.00 -0.34 -4.85 105.19 105.95 1fui n GLY 586 Ca -0.02 -1.25 -0.36 0.00 0.00 0.00 0.00 46.02 44.38 1fui n GLY 586 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fui n PRO 587 N -1.95 0.78 -0.10 1.61 -0.04 -1.26 -4.72 135.00 129.33 1fui n PRO 587 Ca 0.00 0.32 -0.11 0.00 -0.04 0.00 0.00 63.50 63.67 1fui n PRO 587 Cb 0.18 -2.33 -0.04 0.00 -0.04 0.00 0.00 33.50 31.27 1fui n PRO 587 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1fui h LEU 588 N 0.14 0.50 0.03 1.53 5.85 -1.78 -3.37 115.31 118.21 1fui h LEU 588 Ca -0.49 -0.32 -0.29 0.00 0.84 0.00 0.00 57.88 57.62 1fui h LEU 588 Cb 1.34 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 42.20 1fui h LEU 588 CO 0.50 0.70 -1.66 1.88 -0.34 0.00 0.00 178.44 179.52 1fui h TYR 589 N 0.29 0.12 -1.79 1.25 0.05 -1.58 -3.46 116.97 111.84 1fui h TYR 589 Ca 0.08 -0.08 0.10 0.00 0.05 0.00 0.00 58.73 58.88 1fui h TYR 589 Cb 0.45 -0.00 -0.20 0.00 1.01 0.00 0.00 36.73 37.98 1fui h TYR 589 CO 0.04 1.15 0.55 -1.59 -1.05 0.00 0.00 178.16 177.26 1fui s LYS 590 N -2.61 0.65 0.00 4.88 -2.85 -1.24 -5.02 119.74 113.56 1fui s LYS 590 Ca -0.07 -0.02 0.00 0.00 -1.00 0.00 0.00 55.97 54.88 1fui s LYS 590 Cb 0.08 0.30 0.00 0.00 -2.06 0.00 0.00 37.83 36.15 1fui s LYS 590 CO 0.82 -0.24 0.00 -2.13 0.10 0.00 0.00 175.35 173.90