#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 -2.51 -2.80 0.03 5.02 -1.26 -4.76 118.16 111.88 1fui n LYS 2 Ca 0.00 1.99 -0.18 0.00 -2.02 0.00 0.00 58.31 58.10 1fui n LYS 2 Cb 0.00 -2.61 0.00 0.00 -0.02 0.00 0.00 35.03 32.40 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 -2.75 -2.93 -1.33 1.97 4.01 -1.26 -4.74 118.16 111.13 1fui n LYS 3 Ca -0.03 0.63 -0.24 0.00 -0.51 0.00 0.00 58.31 58.16 1fui n LYS 3 Cb 0.37 -5.30 -0.11 0.00 -0.51 0.00 0.00 35.03 29.48 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 -3.75 0.25 -2.93 -0.18 -0.00 -1.26 -4.32 119.36 107.16 1fui n ILE 4 Ca -0.11 -0.25 -0.11 0.00 -0.00 0.00 0.00 62.75 62.29 1fui n ILE 4 Cb 0.60 -2.03 0.01 0.00 -0.00 0.00 0.00 39.64 38.22 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 16.26 -5.37 -4.78 7.28 7.64 -1.26 -4.92 113.62 128.48 1fui n SER 5 Ca 0.43 0.20 -0.37 0.00 1.01 0.00 0.00 58.87 60.14 1fui n SER 5 Cb 0.45 -1.36 -0.02 0.00 -1.01 0.00 0.00 64.21 62.28 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 -1.24 4.02 0.61 -3.43 1.43 -1.26 -5.00 118.68 113.81 1fui s LEU 6 Ca 0.10 2.21 -0.17 0.00 -1.03 0.00 0.00 54.13 55.24 1fui s LEU 6 Cb -0.01 -4.27 -0.02 0.00 0.03 0.00 0.00 46.19 41.92 1fui s LEU 6 CO 0.23 -0.82 1.15 -2.16 0.23 0.00 0.00 176.35 174.98 1fui s PRO 7 N -2.71 2.96 0.36 1.29 0.04 -1.26 -4.98 135.00 130.70 1fui s PRO 7 Ca 0.63 1.61 0.09 0.00 0.04 0.00 0.00 61.00 63.36 1fui s PRO 7 Cb -0.26 -1.95 -0.06 0.00 0.04 0.00 0.00 34.50 32.27 1fui s PRO 7 CO 0.32 -1.17 0.02 0.15 0.04 0.00 0.00 177.00 176.36 1fui s LYS 8 N -3.62 2.04 -0.21 4.56 1.02 -0.55 -4.71 119.74 118.28 1fui s LYS 8 Ca 0.72 -1.85 -0.07 0.00 0.02 0.00 0.00 55.97 54.80 1fui s LYS 8 Cb -0.25 -1.86 -0.03 0.00 -0.52 0.00 0.00 37.83 35.17 1fui s LYS 8 CO 0.35 0.07 0.05 0.42 -0.92 0.00 0.00 175.35 175.32 1fui s ILE 9 N -2.57 4.44 -0.15 2.17 1.01 -0.76 -0.49 121.20 124.85 1fui s ILE 9 Ca 0.35 -0.15 -0.14 0.00 0.00 0.00 0.00 60.65 60.72 1fui s ILE 9 Cb 0.02 -3.02 -0.05 0.00 0.01 0.00 0.00 42.46 39.42 1fui s ILE 9 CO 0.19 0.41 0.32 -0.83 0.00 0.00 0.00 174.94 175.03 1fui s GLY 10 N 0.89 2.24 -0.21 6.18 0.00 -0.26 -0.40 107.32 115.75 1fui s GLY 10 Ca 0.03 -0.42 -0.03 0.00 0.00 0.00 0.00 44.72 44.30 1fui s GLY 10 CO 0.02 0.47 -0.06 -0.42 0.00 0.00 0.00 173.10 173.12 1fui s ILE 11 N 0.45 3.30 -0.44 0.90 1.01 0.94 -1.17 121.20 126.19 1fui s ILE 11 Ca 0.18 -0.52 -0.07 0.00 0.00 0.00 0.00 60.65 60.24 1fui s ILE 11 Cb -0.13 -2.49 0.11 0.00 0.01 0.00 0.00 42.46 39.96 1fui s ILE 11 CO 0.05 0.44 0.29 -0.13 0.00 0.00 0.00 174.94 175.58 1fui s ARG 12 N 1.38 2.31 -0.29 2.79 0.52 0.34 -2.50 118.95 123.50 1fui s ARG 12 Ca 0.05 -1.76 -0.29 0.00 -0.52 0.00 0.00 55.73 53.20 1fui s ARG 12 Cb -0.14 -3.79 0.01 0.00 0.52 0.00 0.00 34.95 31.56 1fui s ARG 12 CO -0.03 -1.13 1.07 -1.25 0.02 0.00 0.00 175.30 173.98 1fui s PRO 13 N 1.28 4.12 0.03 3.54 0.04 -1.26 -1.56 135.00 141.20 1fui s PRO 13 Ca 0.06 1.17 0.01 0.00 0.04 0.00 0.00 61.00 62.29 1fui s PRO 13 Cb -0.25 -3.71 -0.04 0.00 0.04 0.00 0.00 34.50 30.54 1fui s PRO 13 CO -0.02 -0.82 0.07 0.08 0.04 0.00 0.00 177.00 176.35 1fui s VAL 14 N 3.53 4.59 0.12 -0.36 1.01 -0.35 0.03 120.40 128.98 1fui s VAL 14 Ca 0.45 -0.59 -0.14 0.00 0.00 0.00 0.00 61.98 61.71 1fui s VAL 14 Cb -0.13 -3.14 0.02 0.00 0.00 0.00 0.00 36.38 33.13 1fui s VAL 14 CO 0.13 0.25 0.36 -0.51 0.00 0.00 0.00 175.10 175.32 1fui s ILE 15 N -1.27 0.08 0.13 2.22 2.07 0.25 -4.56 121.20 120.13 1fui s ILE 15 Ca 0.25 -0.77 -0.31 0.00 -1.41 0.00 0.00 60.65 58.41 1fui s ILE 15 Cb -0.12 -1.28 -0.09 0.00 0.13 0.00 0.00 42.46 41.10 1fui s ILE 15 CO 0.17 -0.38 1.49 -0.62 -1.91 0.00 0.00 174.94 173.70 1fui s ASP 16 N -2.83 6.69 0.46 4.50 -1.08 -1.19 -4.17 116.67 119.05 1fui s ASP 16 Ca 0.05 2.47 0.26 0.00 -0.52 0.00 0.00 52.55 54.81 1fui s ASP 16 Cb 0.02 -2.59 0.75 0.00 -1.46 0.00 0.00 42.92 39.65 1fui s ASP 16 CO -0.10 -0.75 1.75 1.23 0.52 0.00 0.00 175.17 177.82 1fui h GLY 17 N 6.93 0.00 -4.56 2.66 0.00 -1.87 -3.40 103.07 102.83 1fui h GLY 17 Ca -0.42 0.00 -0.53 0.00 0.00 0.00 0.00 47.33 46.38 1fui h GLY 17 CO 0.89 0.00 0.72 1.09 0.00 0.00 0.00 176.54 179.24 1fui s ARG 18 N -3.41 4.33 0.00 4.80 1.70 -1.26 -4.86 118.95 120.24 1fui s ARG 18 Ca 0.04 2.04 0.00 0.00 -0.47 0.00 0.00 55.73 57.34 1fui s ARG 18 Cb 0.08 -3.28 0.00 0.00 -0.57 0.00 0.00 34.95 31.17 1fui s ARG 18 CO 0.63 -0.43 0.00 0.54 -1.08 0.00 0.00 175.30 174.96 1fui n ARG 19 N 4.06 3.61 -2.45 3.89 5.12 -1.26 -0.45 116.66 129.17 1fui n ARG 19 Ca 0.11 0.00 -0.20 0.00 -1.93 0.00 0.00 57.85 55.83 1fui n ARG 19 Cb 0.43 0.00 -0.00 0.00 -1.16 0.00 0.00 32.46 31.72 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 -1.96 0.00 5.56 1.56 -1.26 -2.92 117.12 118.10 1fui n MET 20 Ca 0.00 0.95 0.00 0.00 -0.27 0.00 0.00 57.70 58.38 1fui n MET 20 Cb 0.00 -5.57 0.00 0.00 2.15 0.00 0.00 33.22 29.80 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 -1.08 3.25 0.13 -5.12 0.00 -1.26 -4.96 105.19 96.16 1fui n GLY 21 Ca -0.22 -0.91 -0.04 0.00 0.00 0.00 0.00 46.02 44.85 1fui n GLY 21 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fui h VAL 22 N 0.00 0.00 -0.94 1.61 2.07 -1.69 -1.26 116.25 116.04 1fui h VAL 22 Ca 0.00 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1fui h VAL 22 Cb 0.00 0.00 -0.05 0.00 -1.52 0.00 0.00 31.29 29.72 1fui h VAL 22 CO 0.00 0.00 0.62 -0.09 0.02 0.00 0.00 177.57 178.12 1fui h ARG 23 N -0.17 1.22 0.00 1.57 2.43 -0.95 -2.72 114.38 115.75 1fui h ARG 23 Ca 0.01 -0.07 -0.06 0.00 -0.81 0.00 0.00 59.98 59.04 1fui h ARG 23 Cb 0.19 -0.27 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1fui h ARG 23 CO -0.11 0.81 -0.29 1.05 -1.51 0.00 0.00 179.97 179.91 1fui h GLU 24 N 1.25 0.00 0.00 0.20 9.09 -1.78 -2.12 114.58 121.22 1fui h GLU 24 Ca 0.36 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.77 1fui h GLU 24 Cb -0.10 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.00 1fui h GLU 24 CO -0.09 0.29 -0.02 0.66 0.05 0.00 0.00 179.01 179.90 1fui h SER 25 N 0.00 0.00 0.15 3.06 4.64 -0.92 -3.28 113.55 117.20 1fui h SER 25 Ca -0.00 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 1fui h SER 25 Cb 0.60 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1fui h SER 25 CO 0.04 0.00 -1.86 0.18 -0.87 0.00 0.00 176.83 174.32 1fui n LEU 26 N -2.47 0.13 -0.15 5.97 4.32 -0.94 -4.68 117.00 119.18 1fui n LEU 26 Ca 0.05 0.05 -0.05 0.00 -0.02 0.00 0.00 56.01 56.04 1fui n LEU 26 Cb 0.46 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.27 1fui n LEU 26 CO 0.31 -0.02 0.67 -0.33 -1.22 0.00 0.00 177.39 176.81 1fui h GLU 27 N 0.00 -0.16 -0.22 3.23 4.39 -1.46 -2.10 114.58 118.26 1fui h GLU 27 Ca -0.01 0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.69 1fui h GLU 27 Cb 1.03 0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.70 1fui h GLU 27 CO 0.00 -0.10 0.09 1.49 -1.16 0.00 0.00 179.01 179.33 1fui h GLU 28 N -0.16 0.33 -0.87 2.33 4.81 -1.83 -2.28 114.58 116.91 1fui h GLU 28 Ca 0.21 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.36 1fui h GLU 28 Cb 0.50 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 1fui h GLU 28 CO -0.57 0.38 0.46 0.37 -0.73 0.00 0.00 179.01 178.92 1fui h GLN 29 N 0.21 1.23 -0.17 1.92 4.15 -1.80 -1.46 115.11 119.19 1fui h GLN 29 Ca 0.07 -0.16 -0.02 0.00 0.77 0.00 0.00 58.65 59.32 1fui h GLN 29 Cb 0.18 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.63 1fui h GLN 29 CO -0.01 0.91 0.04 1.15 -1.93 0.00 0.00 178.83 179.00 1fui h THR 30 N 1.22 1.20 0.00 2.39 2.02 -1.30 -1.51 112.91 116.93 1fui h THR 30 Ca 0.30 -0.62 -0.06 0.00 0.77 0.00 0.00 66.41 66.81 1fui h THR 30 Cb 0.06 1.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1fui h THR 30 CO -0.05 0.19 -0.28 0.24 0.37 0.00 0.00 175.52 176.00 1fui h MET 31 N 0.08 0.00 -0.47 6.66 2.86 -1.32 -2.27 114.93 120.47 1fui h MET 31 Ca 0.05 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.56 1fui h MET 31 Cb 0.25 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1fui h MET 31 CO -0.00 0.28 -0.24 -0.91 1.06 0.00 0.00 176.91 177.10 1fui h ASN 32 N 0.00 1.03 -0.51 1.22 2.35 -1.05 -0.34 115.58 118.28 1fui h ASN 32 Ca -0.00 -0.41 0.01 0.00 -0.55 0.00 0.00 56.30 55.36 1fui h ASN 32 Cb 0.50 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1fui h ASN 32 CO 0.04 1.21 0.32 -0.03 -1.65 0.00 0.00 177.43 177.31 1fui h MET 33 N 0.85 0.63 -0.30 0.81 4.05 -0.85 0.30 114.93 120.41 1fui h MET 33 Ca 0.10 -0.04 -0.01 0.00 -0.28 0.00 0.00 59.70 59.48 1fui h MET 33 Cb 0.82 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 31.47 1fui h MET 33 CO 0.07 0.41 0.15 0.00 0.23 0.00 0.00 176.91 177.78 1fui h ALA 34 N 1.21 0.39 -0.66 0.39 0.00 -1.17 -1.39 119.26 118.02 1fui h ALA 34 Ca 0.20 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 1fui h ALA 34 Cb -0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1fui h ALA 34 CO -0.07 -0.06 0.16 0.87 0.00 0.00 0.00 179.25 180.15 1fui h LYS 35 N 0.36 1.05 -0.49 0.00 1.57 -0.63 -1.41 116.57 117.02 1fui h LYS 35 Ca 0.11 -0.24 -0.06 0.00 -1.87 0.00 0.00 60.65 58.58 1fui h LYS 35 Cb 0.10 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1fui h LYS 35 CO -0.01 0.93 0.06 0.00 -0.57 0.00 0.00 179.45 179.85 1fui h ALA 36 N 1.17 0.66 -0.50 3.86 0.00 -0.25 -1.13 119.26 123.06 1fui h ALA 36 Ca 0.21 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1fui h ALA 36 Cb 0.36 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1fui h ALA 36 CO 0.00 0.41 0.27 1.15 0.00 0.00 0.00 179.25 181.09 1fui h THR 37 N 0.70 1.18 -0.42 0.00 2.02 -0.99 -1.98 112.91 113.42 1fui h THR 37 Ca 0.15 -0.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.84 1fui h THR 37 Cb 0.43 0.56 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1fui h THR 37 CO 0.01 0.19 0.17 0.00 0.37 0.00 0.00 175.52 176.27 1fui h ALA 38 N 1.11 0.54 -0.32 6.16 0.00 -1.09 -2.03 119.26 123.63 1fui h ALA 38 Ca 0.18 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1fui h ALA 38 Cb 0.06 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1fui h ALA 38 CO -0.03 0.14 0.15 0.00 0.00 0.00 0.00 179.25 179.52 1fui h ALA 39 N 1.02 0.39 -0.14 0.00 0.00 -1.03 -1.38 119.26 118.12 1fui h ALA 39 Ca 0.14 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1fui h ALA 39 Cb 0.18 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1fui h ALA 39 CO -0.01 -0.23 0.08 1.25 0.00 0.00 0.00 179.25 180.34 1fui h LEU 40 N 0.32 0.17 -0.17 0.00 5.85 -1.24 -1.95 115.31 118.29 1fui h LEU 40 Ca 0.13 -0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1fui h LEU 40 Cb 0.05 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 1fui h LEU 40 CO -0.10 0.18 0.10 -0.07 -0.34 0.00 0.00 178.44 178.21 1fui h LEU 41 N 0.15 0.20 -1.52 2.25 3.38 -1.07 0.99 115.31 119.70 1fui h LEU 41 Ca 0.05 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1fui h LEU 41 Cb 0.04 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 1fui h LEU 41 CO -0.01 0.19 -0.12 0.71 0.09 0.00 0.00 178.44 179.30 1fui h THR 42 N 0.20 0.34 0.12 0.22 1.35 -1.22 -0.00 112.91 113.91 1fui h THR 42 Ca 0.06 -0.73 -0.24 0.00 -0.55 0.00 0.00 66.41 64.95 1fui h THR 42 Cb 0.02 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 67.99 1fui h THR 42 CO -0.01 0.11 -1.19 -0.08 -0.25 0.00 0.00 175.52 174.11 1fui h GLU 43 N 0.00 0.25 0.00 4.72 4.81 -0.95 -3.40 114.58 120.02 1fui h GLU 43 Ca -0.00 -0.42 0.00 0.00 -0.13 0.00 0.00 59.36 58.80 1fui h GLU 43 Cb 0.54 0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.07 1fui h GLU 43 CO 0.02 1.20 -0.78 0.87 -0.73 0.00 0.00 179.01 179.59 1fui h LYS 44 N -0.37 0.00 -6.37 1.92 1.79 -0.71 -3.48 116.57 109.36 1fui h LYS 44 Ca -0.25 0.00 -0.62 0.00 -2.18 0.00 0.00 60.65 57.61 1fui h LYS 44 Cb 1.69 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 32.22 1fui h LYS 44 CO 0.08 0.00 -0.67 -0.51 -1.08 0.00 0.00 179.45 177.27 1fui s LEU 45 N -4.58 3.27 -0.01 2.94 1.43 -0.02 -5.07 118.68 116.64 1fui s LEU 45 Ca 0.04 -0.39 -0.06 0.00 -1.03 0.00 0.00 54.13 52.69 1fui s LEU 45 Cb 0.12 -1.94 0.00 0.00 0.03 0.00 0.00 46.19 44.40 1fui s LEU 45 CO 0.75 0.11 0.12 -0.13 0.23 0.00 0.00 176.35 177.43 1fui s ARG 46 N -2.81 0.39 0.70 1.70 1.81 -1.26 -3.92 118.95 115.56 1fui s ARG 46 Ca 0.26 -0.28 -0.12 0.00 -1.72 0.00 0.00 55.73 53.88 1fui s ARG 46 Cb -0.10 0.16 0.02 0.00 -0.45 0.00 0.00 34.95 34.58 1fui s ARG 46 CO 0.18 -0.08 1.08 -1.01 -0.68 0.00 0.00 175.30 174.79 1fui s HIS 47 N -1.03 2.76 0.57 -0.53 3.76 0.21 -4.90 115.29 116.13 1fui s HIS 47 Ca -0.11 1.52 0.26 0.00 -0.15 0.00 0.00 55.06 56.58 1fui s HIS 47 Cb -0.06 -3.03 1.62 0.00 1.11 0.00 0.00 32.58 32.21 1fui s HIS 47 CO 0.01 -1.56 2.16 0.00 -0.85 0.00 0.00 174.74 174.50 1fui h ALA 48 N -0.55 1.80 0.00 -1.40 0.00 -1.88 0.12 119.26 117.36 1fui h ALA 48 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1fui h ALA 48 Cb 1.23 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1fui h ALA 48 CO 0.54 -0.16 0.00 0.00 0.00 0.00 0.00 179.25 179.63 1fui n GLY 50 N 0.81 3.24 3.74 0.00 0.00 0.42 -4.91 105.19 108.48 1fui n GLY 50 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.85 2.22 0.57 4.61 0.00 -1.26 -4.65 121.76 120.40 1fui s ALA 51 Ca 0.00 0.79 -0.17 0.00 0.00 0.00 0.00 51.96 52.59 1fui s ALA 51 Cb 0.00 -3.43 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 1fui s ALA 51 CO 0.00 -1.69 1.05 0.00 0.00 0.00 0.00 175.76 175.12 1fui s ALA 52 N -2.07 2.79 -0.05 0.00 0.00 -1.26 -0.62 121.76 120.55 1fui s ALA 52 Ca 0.72 0.42 -0.20 0.00 0.00 0.00 0.00 51.96 52.90 1fui s ALA 52 Cb -0.27 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.58 1fui s ALA 52 CO 0.44 -0.67 0.57 0.08 0.00 0.00 0.00 175.76 176.18 1fui s VAL 53 N -2.37 5.03 -0.06 0.00 1.01 -1.25 -4.71 120.40 118.05 1fui s VAL 53 Ca 0.64 1.17 -0.02 0.00 0.00 0.00 0.00 61.98 63.77 1fui s VAL 53 Cb -0.16 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 1fui s VAL 53 CO 0.33 0.37 0.05 -1.61 0.00 0.00 0.00 175.10 174.24 1fui s GLU 54 N 0.21 3.06 0.11 2.72 2.02 -1.26 -4.46 118.70 121.10 1fui s GLU 54 Ca 0.30 -0.41 0.09 0.00 0.02 0.00 0.00 54.97 54.97 1fui s GLU 54 Cb -0.17 -2.87 -0.04 0.00 0.10 0.00 0.00 34.13 31.16 1fui s GLU 54 CO 0.15 0.69 -0.17 0.00 0.02 0.00 0.00 175.26 175.95 1fui s VAL 56 N -1.13 1.71 0.04 0.00 1.01 0.46 -4.91 120.40 117.57 1fui s VAL 56 Ca 0.18 -0.79 0.02 0.00 0.00 0.00 0.00 61.98 61.39 1fui s VAL 56 Cb -0.11 -1.53 -0.04 0.00 0.00 0.00 0.00 36.38 34.71 1fui s VAL 56 CO 0.10 0.48 0.05 -0.63 0.00 0.00 0.00 175.10 175.10 1fui s ILE 57 N 0.76 4.42 0.52 2.22 1.01 -1.26 -0.04 121.20 128.83 1fui s ILE 57 Ca -0.10 -0.66 -0.22 0.00 0.00 0.00 0.00 60.65 59.67 1fui s ILE 57 Cb -0.16 -3.06 -0.06 0.00 0.01 0.00 0.00 42.46 39.19 1fui s ILE 57 CO 0.01 0.25 1.33 -0.24 0.00 0.00 0.00 174.94 176.29 1fui n SER 58 N 0.91 2.61 0.12 3.58 2.88 -1.04 -4.88 113.62 117.79 1fui n SER 58 Ca -0.12 1.00 0.04 0.00 -1.33 0.00 0.00 58.87 58.47 1fui n SER 58 Cb 0.52 -1.56 0.47 0.00 -0.75 0.00 0.00 64.21 62.89 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 1.54 0.23 -4.87 -3.46 3.32 -1.94 -3.45 116.42 107.79 1fui h ASP 59 Ca -0.50 -0.02 -0.34 0.00 0.02 0.00 0.00 57.03 56.18 1fui h ASP 59 Cb 1.30 -0.06 -0.14 0.00 0.22 0.00 0.00 39.33 40.65 1fui h ASP 59 CO 0.57 0.27 -0.60 0.42 -1.72 0.00 0.00 179.24 178.18 1fui s THR 60 N -5.04 0.34 0.48 0.35 -4.23 -1.26 -5.14 115.64 101.15 1fui s THR 60 Ca -0.06 -2.00 -0.21 0.00 -1.18 0.00 0.00 61.69 58.24 1fui s THR 60 Cb 0.16 -2.57 -0.08 0.00 1.34 0.00 0.00 72.50 71.35 1fui s THR 60 CO 0.71 0.00 1.05 0.00 -0.54 0.00 0.00 174.62 175.84 1fui s ILE 62 N -1.92 4.36 0.00 0.00 1.01 0.11 -4.91 121.20 119.84 1fui s ILE 62 Ca 0.66 -0.16 0.00 0.00 0.00 0.00 0.00 60.65 61.15 1fui s ILE 62 Cb -0.17 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.28 1fui s ILE 62 CO 0.21 0.37 0.11 0.00 0.00 0.00 0.00 174.94 175.63 1fui n ALA 63 N 4.54 1.73 -3.18 9.38 0.00 -1.26 -0.59 120.51 131.13 1fui n ALA 63 Ca -0.16 -0.11 0.01 0.00 0.00 0.00 0.00 53.44 53.18 1fui n ALA 63 Cb 0.52 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.97 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 0.60 1.41 0.35 0.00 0.00 -1.26 -4.50 105.19 101.78 1fui n GLY 64 Ca 0.00 -1.01 -0.05 0.00 0.00 0.00 0.00 46.02 44.96 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 1.21 -0.17 1.61 0.00 -1.95 -1.12 114.93 114.51 1fui h MET 65 Ca -0.06 -0.18 0.00 0.00 0.00 0.00 0.00 59.70 59.45 1fui h MET 65 Cb 0.26 -0.22 -0.01 0.00 0.00 0.00 0.00 31.60 31.64 1fui h MET 65 CO 0.08 0.93 0.11 0.00 0.00 0.00 0.00 176.91 178.04 1fui h ALA 66 N 1.21 0.21 -0.37 6.32 0.00 -1.97 0.11 119.26 124.78 1fui h ALA 66 Ca 0.29 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 1fui h ALA 66 Cb 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1fui h ALA 66 CO -0.03 -0.31 -0.30 0.93 0.00 0.00 0.00 179.25 179.54 1fui h GLU 67 N 0.23 0.79 -0.76 0.00 5.08 -1.91 -1.98 114.58 116.03 1fui h GLU 67 Ca 0.06 -0.36 -0.02 0.00 -1.00 0.00 0.00 59.36 58.04 1fui h GLU 67 Cb -0.02 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1fui h GLU 67 CO -0.02 0.99 0.38 0.00 -1.00 0.00 0.00 179.01 179.37 1fui h ALA 68 N 0.99 0.98 -0.61 3.43 0.00 -0.88 -0.66 119.26 122.50 1fui h ALA 68 Ca 0.08 -0.14 -0.07 0.00 0.00 0.00 0.00 54.91 54.77 1fui h ALA 68 Cb 0.84 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 1fui h ALA 68 CO 0.07 0.53 0.09 0.00 0.00 0.00 0.00 179.25 179.94 1fui h ALA 69 N 1.20 1.00 -0.23 0.00 0.00 -0.57 -1.13 119.26 119.52 1fui h ALA 69 Ca 0.26 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1fui h ALA 69 Cb 0.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1fui h ALA 69 CO -0.04 0.63 0.09 0.00 0.00 0.00 0.00 179.25 179.94 1fui h ALA 70 N 1.15 0.30 -0.37 0.00 0.00 -0.91 -1.76 119.26 117.68 1fui h ALA 70 Ca 0.19 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1fui h ALA 70 Cb 0.42 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1fui h ALA 70 CO 0.01 -0.11 0.11 0.00 0.00 0.00 0.00 179.25 179.27 1fui h GLU 72 N 0.26 0.89 -0.42 0.00 4.57 -0.99 0.13 114.58 119.02 1fui h GLU 72 Ca 0.17 -0.05 -0.00 0.00 -1.18 0.00 0.00 59.36 58.30 1fui h GLU 72 Cb 0.16 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 1fui h GLU 72 CO -0.19 0.59 0.26 1.49 -1.18 0.00 0.00 179.01 179.98 1fui h GLU 73 N 0.92 0.57 -0.57 1.92 4.81 -0.88 -0.69 114.58 120.66 1fui h GLU 73 Ca 0.34 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.50 1fui h GLU 73 Cb 0.14 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 1fui h GLU 73 CO -0.16 0.41 0.24 -0.22 -0.73 0.00 0.00 179.01 178.55 1fui h LYS 74 N 0.56 0.85 -0.09 1.92 3.64 -0.62 -3.22 116.57 119.60 1fui h LYS 74 Ca 0.15 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 1fui h LYS 74 Cb -0.02 -0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 31.65 1fui h LYS 74 CO -0.03 0.72 0.02 0.74 -2.27 0.00 0.00 179.45 178.63 1fui h PHE 75 N 0.78 0.16 -0.23 1.91 -1.00 -0.65 -3.09 116.94 114.81 1fui h PHE 75 Ca 0.19 -0.02 0.07 0.00 2.81 0.00 0.00 57.97 61.02 1fui h PHE 75 Cb 0.18 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 39.69 1fui h PHE 75 CO 0.01 0.34 0.25 0.66 -1.61 0.00 0.00 178.31 177.95 1fui h SER 76 N -0.06 0.00 0.11 2.17 4.64 -1.14 0.04 113.55 119.30 1fui h SER 76 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1fui h SER 76 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1fui h SER 76 CO 0.00 0.00 -0.41 -1.54 -0.87 0.00 0.00 176.83 174.01 1fui n SER 77 N -3.82 1.50 -0.84 4.97 3.41 -1.20 -4.06 113.62 113.58 1fui n SER 77 Ca 0.03 -1.18 0.07 0.00 -0.26 0.00 0.00 58.87 57.53 1fui n SER 77 Cb 0.38 0.35 0.20 0.00 -0.26 0.00 0.00 64.21 64.89 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 -0.42 2.85 -3.71 4.33 1.13 -0.02 -5.01 117.38 116.54 1fui n GLN 78 Ca 0.10 -2.23 -0.23 0.00 -1.94 0.00 0.00 57.00 52.71 1fui n GLN 78 Cb 0.41 -1.36 0.04 0.00 0.11 0.00 0.00 30.24 29.44 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 0.80 -2.27 -4.73 1.08 4.05 -1.10 -4.57 115.26 108.52 1fui n ASN 79 Ca 0.15 -0.77 -0.41 0.00 0.45 0.00 0.00 54.58 54.00 1fui n ASN 79 Cb 0.49 -4.20 -0.04 0.00 1.23 0.00 0.00 39.78 37.25 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 -3.54 4.77 -0.46 3.44 -7.23 -1.21 -1.48 120.40 114.70 1fui s VAL 80 Ca 0.17 1.79 0.20 0.00 -1.81 0.00 0.00 61.98 62.33 1fui s VAL 80 Cb -0.08 -4.19 -0.27 0.00 0.56 0.00 0.00 36.38 32.40 1fui s VAL 80 CO 0.80 0.28 0.63 0.61 -0.31 0.00 0.00 175.10 177.12 1fui n GLY 81 N 2.61 -0.90 3.33 2.32 0.00 0.35 -4.83 105.19 108.08 1fui n GLY 81 Ca 0.01 -0.52 -0.15 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 -3.70 0.37 0.12 0.99 -0.00 -1.24 -3.89 118.68 111.32 1fui s LEU 82 Ca -0.00 0.29 0.09 0.00 -0.00 0.00 0.00 54.13 54.51 1fui s LEU 82 Cb 0.14 1.67 -0.04 0.00 -0.00 0.00 0.00 46.19 47.96 1fui s LEU 82 CO 0.83 -0.50 -0.21 0.42 -0.00 0.00 0.00 176.35 176.89 1fui s THR 83 N -1.27 1.84 -0.10 5.48 -4.23 -0.66 -1.11 115.64 115.58 1fui s THR 83 Ca -0.13 -1.66 -0.01 0.00 -1.18 0.00 0.00 61.69 58.72 1fui s THR 83 Cb -0.04 -1.70 0.03 0.00 1.34 0.00 0.00 72.50 72.14 1fui s THR 83 CO 0.06 -0.09 -0.05 -0.63 -0.54 0.00 0.00 174.62 173.37 1fui s ILE 84 N -1.32 0.83 -0.23 2.99 1.01 -0.31 -1.46 121.20 122.71 1fui s ILE 84 Ca 0.10 -0.18 -0.11 0.00 0.00 0.00 0.00 60.65 60.45 1fui s ILE 84 Cb -0.09 -0.91 -0.05 0.00 0.01 0.00 0.00 42.46 41.42 1fui s ILE 84 CO 0.05 0.32 0.18 -0.89 0.00 0.00 0.00 174.94 174.60 1fui s THR 85 N 1.79 5.35 0.11 2.92 2.01 -0.07 -0.50 115.64 127.25 1fui s THR 85 Ca 0.05 0.24 0.10 0.00 0.31 0.00 0.00 61.69 62.39 1fui s THR 85 Cb -0.13 -3.52 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 1fui s THR 85 CO -0.07 0.35 -0.26 0.68 -0.69 0.00 0.00 174.62 174.63 1fui s VAL 86 N 0.95 2.30 -0.24 3.82 -7.23 -0.60 -0.47 120.40 118.92 1fui s VAL 86 Ca 0.09 -1.65 -0.26 0.00 -1.81 0.00 0.00 61.98 58.34 1fui s VAL 86 Cb -0.13 -1.99 0.12 0.00 0.56 0.00 0.00 36.38 34.94 1fui s VAL 86 CO 0.04 0.15 1.02 0.28 -0.31 0.00 0.00 175.10 176.28 1fui s THR 87 N -1.01 0.00 -1.39 5.32 -1.32 -1.04 -1.21 115.64 114.99 1fui s THR 87 Ca 0.14 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.78 1fui s THR 87 Cb -0.10 -1.00 0.44 0.00 -1.51 0.00 0.00 72.50 70.33 1fui s THR 87 CO 0.06 0.00 1.37 -0.81 -2.21 0.00 0.00 174.62 173.02 1fui n PRO 88 N 1.79 2.77 -2.96 7.08 -0.04 -1.26 -1.35 135.00 141.03 1fui n PRO 88 Ca -0.12 -2.29 -0.09 0.00 -0.04 0.00 0.00 63.50 60.96 1fui n PRO 88 Cb 0.56 -1.40 -0.02 0.00 -0.04 0.00 0.00 33.50 32.61 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 -3.59 3.93 0.22 0.00 -0.11 -1.26 -4.26 118.94 113.87 1fui s TRP 90 Ca 0.17 1.88 -0.00 0.00 1.22 0.00 0.00 56.10 59.37 1fui s TRP 90 Cb -0.00 -3.02 -0.04 0.00 -1.50 0.00 0.00 33.47 28.91 1fui s TRP 90 CO 0.12 0.32 0.13 0.00 -4.62 0.00 0.00 176.95 172.91 1fui s TYR 92 N -4.06 3.18 0.00 0.00 2.02 -1.26 -4.93 117.35 112.29 1fui s TYR 92 Ca 0.39 -1.79 0.00 0.00 -0.37 0.00 0.00 57.07 55.29 1fui s TYR 92 Cb 0.07 -4.46 0.00 0.00 -0.40 0.00 0.00 41.96 37.17 1fui s TYR 92 CO 0.13 -1.56 0.00 0.41 -1.57 0.00 0.00 175.55 172.96 1fui n GLY 93 N 4.87 0.00 0.22 0.71 0.00 -1.26 -1.01 105.19 108.72 1fui n GLY 93 Ca 0.38 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.55 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 1.15 1.61 4.64 -1.93 -2.10 113.55 116.92 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 -0.20 -0.62 -0.87 0.00 0.00 176.83 175.14 1fui n GLU 95 N -2.65 0.20 -0.00 4.77 1.02 -0.18 -4.24 120.64 119.56 1fui n GLU 95 Ca -0.00 0.12 0.01 0.00 -0.02 0.00 0.00 57.16 57.27 1fui n GLU 95 Cb 0.16 -1.69 -0.01 0.00 -0.02 0.00 0.00 31.44 29.88 1fui n GLU 95 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1fui n THR 96 N -2.01 0.00 -1.90 2.62 -2.24 -0.82 -3.24 114.28 106.70 1fui n THR 96 Ca 0.05 -0.29 -0.33 0.00 -2.27 0.00 0.00 64.05 61.21 1fui n THR 96 Cb 0.41 0.78 0.03 0.00 -2.10 0.00 0.00 70.33 69.45 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 -1.54 3.46 -0.46 2.28 -4.36 -1.05 -4.97 121.20 114.55 1fui s ILE 97 Ca 0.00 0.70 -0.29 0.00 -0.26 0.00 0.00 60.65 60.80 1fui s ILE 97 Cb 0.01 -3.22 0.02 0.00 1.25 0.00 0.00 42.46 40.52 1fui s ILE 97 CO 0.07 -0.40 1.25 -0.62 0.24 0.00 0.00 174.94 175.47 1fui s ASP 98 N -2.60 6.50 0.00 4.36 2.15 -1.26 -4.90 116.67 120.92 1fui s ASP 98 Ca 0.66 0.57 0.30 0.00 0.43 0.00 0.00 52.55 54.51 1fui s ASP 98 Cb -0.19 -2.55 1.51 0.00 -0.30 0.00 0.00 42.92 41.40 1fui s ASP 98 CO 0.39 -1.34 2.03 0.23 -0.17 0.00 0.00 175.17 176.30 1fui n MET 99 N 7.99 0.67 -1.68 4.34 2.81 -1.26 -4.90 117.12 125.09 1fui n MET 99 Ca 0.13 -0.10 -0.44 0.00 -1.81 0.00 0.00 57.70 55.49 1fui n MET 99 Cb 0.49 -1.50 -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 -3.47 1.51 0.00 0.00 175.97 174.01 1fui n ASP 100 N -1.08 3.91 0.24 7.83 2.03 -1.26 -4.89 116.55 123.34 1fui n ASP 100 Ca 0.17 0.97 0.14 0.00 0.52 0.00 0.00 54.79 56.58 1fui n ASP 100 Cb 0.22 -1.50 0.44 0.00 -0.72 0.00 0.00 41.12 39.56 1fui n ASP 100 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1fui h PRO 101 N 9.05 0.00 0.00 -0.67 0.13 -1.98 -3.37 132.00 135.15 1fui h PRO 101 Ca -0.48 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.28 1fui h PRO 101 Cb 1.24 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.30 1fui h PRO 101 CO 0.94 0.05 -2.42 0.25 -0.23 0.00 0.00 178.00 176.59 1fui n THR 102 N -3.14 1.43 -2.31 1.56 -2.24 -1.26 -4.98 114.28 103.34 1fui n THR 102 Ca 0.02 -0.71 -0.38 0.00 -2.27 0.00 0.00 64.05 60.71 1fui n THR 102 Cb 0.42 -0.93 -0.02 0.00 -2.10 0.00 0.00 70.33 67.70 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 -2.50 4.05 0.24 -0.78 1.70 -1.26 -4.97 118.95 115.43 1fui s ARG 103 Ca -0.22 1.82 -0.30 0.00 -0.47 0.00 0.00 55.73 56.55 1fui s ARG 103 Cb 0.07 -2.66 -0.10 0.00 -0.57 0.00 0.00 34.95 31.69 1fui s ARG 103 CO 0.71 -0.31 1.51 -2.14 -1.08 0.00 0.00 175.30 173.98 1fui s PRO 104 N -2.32 4.22 0.02 3.89 0.02 -1.25 -4.89 135.00 134.68 1fui s PRO 104 Ca 0.57 2.39 0.03 0.00 0.02 0.00 0.00 61.00 64.02 1fui s PRO 104 Cb -0.30 -3.09 -0.02 0.00 0.02 0.00 0.00 34.50 31.11 1fui s PRO 104 CO 0.38 -0.52 -0.11 0.15 -0.33 0.00 0.00 177.00 176.57 1fui s LYS 105 N -0.10 0.77 0.05 5.54 1.02 -1.26 -1.66 119.74 124.10 1fui s LYS 105 Ca 0.63 -0.56 0.01 0.00 0.02 0.00 0.00 55.97 56.07 1fui s LYS 105 Cb -0.44 -0.73 -0.03 0.00 -0.52 0.00 0.00 37.83 36.11 1fui s LYS 105 CO 0.42 0.19 -0.06 0.00 -0.92 0.00 0.00 175.35 174.98 1fui s ALA 106 N -0.64 0.54 -0.08 5.17 0.00 -0.53 -0.57 121.76 125.64 1fui s ALA 106 Ca 0.01 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.07 1fui s ALA 106 Cb -0.06 0.12 0.02 0.00 0.00 0.00 0.00 23.12 23.20 1fui s ALA 106 CO 0.00 -0.14 -0.08 0.42 0.00 0.00 0.00 175.76 175.96 1fui s ILE 107 N -2.18 0.91 -0.29 0.00 1.01 -0.61 -0.89 121.20 119.15 1fui s ILE 107 Ca -0.05 -0.28 -0.04 0.00 0.00 0.00 0.00 60.65 60.28 1fui s ILE 107 Cb -0.05 -0.90 0.03 0.00 0.01 0.00 0.00 42.46 41.55 1fui s ILE 107 CO -0.02 0.33 0.01 0.86 0.00 0.00 0.00 174.94 176.12 1fui s TRP 108 N 1.21 3.18 -0.24 3.97 -0.00 0.38 -1.19 118.94 126.24 1fui s TRP 108 Ca -0.05 -1.51 -0.09 0.00 -0.00 0.00 0.00 56.10 54.45 1fui s TRP 108 Cb -0.14 -2.15 -0.04 0.00 -0.00 0.00 0.00 33.47 31.14 1fui s TRP 108 CO -0.02 -0.72 0.13 0.20 -0.00 0.00 0.00 176.95 176.53 1fui s GLY 109 N 1.35 1.89 0.24 5.86 0.00 -1.09 -2.50 107.32 113.08 1fui s GLY 109 Ca -0.01 -0.99 -0.31 0.00 0.00 0.00 0.00 44.72 43.40 1fui s GLY 109 CO -0.01 0.45 1.63 0.33 0.00 0.00 0.00 173.10 175.50 1fui n PHE 110 N 4.56 2.70 -2.99 1.90 7.35 -0.46 -4.40 117.46 126.11 1fui n PHE 110 Ca -0.15 0.18 -0.44 0.00 -0.76 0.00 0.00 57.45 56.28 1fui n PHE 110 Cb 0.52 -2.61 -0.00 0.00 0.35 0.00 0.00 39.48 37.73 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 0.81 7.05 0.34 -2.13 3.84 -1.26 -2.60 114.94 120.98 1fui s ASN 111 Ca 0.71 -2.96 0.03 0.00 0.21 0.00 0.00 52.86 50.85 1fui s ASN 111 Cb -0.53 -2.38 -0.05 0.00 -0.55 0.00 0.00 41.25 37.74 1fui s ASN 111 CO 0.41 -0.73 0.08 -0.83 -2.79 0.00 0.00 177.10 173.24 1fui s GLY 112 N 2.74 2.17 -0.27 1.21 0.00 -1.03 -0.68 107.32 111.46 1fui s GLY 112 Ca 0.40 -1.80 -0.15 0.00 0.00 0.00 0.00 44.72 43.17 1fui s GLY 112 CO -0.02 -1.78 -0.24 -1.30 0.00 0.00 0.00 173.10 169.75 1fui n THR 113 N -0.71 1.53 0.19 0.90 -2.24 -1.26 -3.81 114.28 108.88 1fui n THR 113 Ca -0.03 -0.33 0.05 0.00 -2.27 0.00 0.00 64.05 61.48 1fui n THR 113 Cb 0.66 -1.90 0.35 0.00 -2.10 0.00 0.00 70.33 67.34 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 -0.97 0.00 -3.28 -0.78 3.07 -1.96 -3.33 114.58 107.34 1fui h GLU 114 Ca -0.64 0.00 -0.74 0.00 -0.50 0.00 0.00 59.36 57.48 1fui h GLU 114 Cb 1.57 0.00 -0.32 0.00 -0.84 0.00 0.00 28.75 29.15 1fui h GLU 114 CO -0.38 0.38 0.17 0.54 -1.40 0.00 0.00 179.01 178.32 1fui n ARG 115 N -3.60 3.17 -0.71 2.33 5.12 -1.26 -4.99 116.66 116.71 1fui n ARG 115 Ca -0.01 -4.50 -0.13 0.00 -1.93 0.00 0.00 57.85 51.29 1fui n ARG 115 Cb 0.49 -2.46 -0.09 0.00 -1.16 0.00 0.00 32.46 29.24 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 2.21 1.62 -0.03 5.56 -0.04 -1.20 -2.45 135.00 140.66 1fui n PRO 116 Ca 0.24 -0.91 -0.01 0.00 -0.04 0.00 0.00 63.50 62.77 1fui n PRO 116 Cb 0.37 -2.01 0.27 0.00 -0.04 0.00 0.00 33.50 32.09 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 6.05 0.63 2.00 0.55 0.00 -1.51 -2.22 103.07 108.57 1fui h GLY 117 Ca 0.25 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.18 1fui h GLY 117 CO 0.64 0.35 -0.08 0.00 0.00 0.00 0.00 176.54 177.46 1fui h ALA 118 N 1.46 1.60 -0.18 3.60 0.00 -1.70 -1.63 119.26 122.40 1fui h ALA 118 Ca 0.12 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.80 1fui h ALA 118 Cb 0.34 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1fui h ALA 118 CO 0.01 0.09 -0.57 0.28 0.00 0.00 0.00 179.25 179.06 1fui h VAL 119 N 0.00 1.32 -0.09 0.00 2.07 -1.74 -2.52 116.25 115.29 1fui h VAL 119 Ca -0.00 -1.83 -0.04 0.00 0.82 0.00 0.00 66.70 65.65 1fui h VAL 119 Cb 0.16 1.81 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1fui h VAL 119 CO 0.01 0.57 -0.10 0.22 0.02 0.00 0.00 177.57 178.29 1fui h TYR 120 N 0.42 0.27 -0.77 1.57 3.20 -1.39 -2.85 116.97 117.42 1fui h TYR 120 Ca 0.00 -0.08 0.09 0.00 3.14 0.00 0.00 58.73 61.87 1fui h TYR 120 Cb 1.12 -0.06 -0.11 0.00 1.54 0.00 0.00 36.73 39.22 1fui h TYR 120 CO 0.05 0.67 -0.53 1.25 -1.64 0.00 0.00 178.16 177.95 1fui h LEU 121 N -0.20 -1.88 -0.98 2.82 6.46 -1.26 0.51 115.31 120.77 1fui h LEU 121 Ca 0.01 0.29 0.04 0.00 -0.12 0.00 0.00 57.88 58.10 1fui h LEU 121 Cb 0.62 0.83 -0.06 0.00 -0.73 0.00 0.00 40.66 41.33 1fui h LEU 121 CO 0.02 -0.30 0.64 0.00 -0.62 0.00 0.00 178.44 178.18 1fui h ALA 122 N 0.48 1.31 -0.24 1.25 0.00 -1.50 -0.10 119.26 120.46 1fui h ALA 122 Ca 0.16 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 1fui h ALA 122 Cb 0.51 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1fui h ALA 122 CO -0.81 0.52 -0.28 0.00 0.00 0.00 0.00 179.25 178.67 1fui h ALA 123 N 1.41 0.36 -0.51 0.00 0.00 -0.83 -2.28 119.26 117.41 1fui h ALA 123 Ca 0.40 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1fui h ALA 123 Cb 0.02 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1fui h ALA 123 CO -0.13 0.37 0.18 0.00 0.00 0.00 0.00 179.25 179.68 1fui h ALA 124 N 0.67 0.67 -0.78 0.00 0.00 0.30 -1.94 119.26 118.18 1fui h ALA 124 Ca 0.03 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1fui h ALA 124 Cb 0.85 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1fui h ALA 124 CO 0.07 0.30 0.32 -0.07 0.00 0.00 0.00 179.25 179.87 1fui h LEU 125 N 0.69 1.06 -0.67 0.00 3.38 -1.03 -0.41 115.31 118.34 1fui h LEU 125 Ca 0.17 -0.16 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1fui h LEU 125 Cb 0.23 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 1fui h LEU 125 CO -0.01 0.94 0.34 0.00 0.09 0.00 0.00 178.44 179.79 1fui h ALA 126 N 1.21 0.86 -0.61 1.53 0.00 -1.12 0.04 119.26 121.17 1fui h ALA 126 Ca 0.26 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1fui h ALA 126 Cb 0.20 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1fui h ALA 126 CO -0.02 0.40 0.28 0.00 0.00 0.00 0.00 179.25 179.90 1fui h ALA 127 N 1.16 0.79 -0.34 0.00 0.00 -0.76 0.57 119.26 120.68 1fui h ALA 127 Ca 0.23 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1fui h ALA 127 Cb 0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1fui h ALA 127 CO -0.03 0.37 0.17 0.45 0.00 0.00 0.00 179.25 180.21 1fui h HIS 128 N 0.84 0.32 -0.12 0.00 -0.00 -0.50 -0.61 115.15 115.07 1fui h HIS 128 Ca 0.21 0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.47 1fui h HIS 128 Cb 0.15 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 27.45 1fui h HIS 128 CO 0.00 0.17 -0.48 0.77 -0.00 0.00 0.00 177.93 178.40 1fui h SER 129 N 0.36 0.33 0.68 2.45 0.02 -0.69 -0.47 113.55 116.22 1fui h SER 129 Ca 0.14 -0.16 -0.13 0.00 -0.84 0.00 0.00 61.79 60.81 1fui h SER 129 Cb 0.05 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 1fui h SER 129 CO -0.10 0.76 -0.63 -0.61 -1.14 0.00 0.00 176.83 175.11 1fui h GLN 130 N 0.25 0.00 -0.39 3.45 4.15 -0.65 -3.10 115.11 118.82 1fui h GLN 130 Ca 0.01 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1fui h GLN 130 Cb 0.93 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.62 1fui h GLN 130 CO 0.08 0.63 0.00 1.63 -1.93 0.00 0.00 178.83 179.24 1fui n LYS 131 N -3.74 2.28 -1.82 1.69 5.02 -0.26 -4.98 118.16 116.36 1fui n LYS 131 Ca -0.01 -1.96 -0.10 0.00 -2.02 0.00 0.00 58.31 54.23 1fui n LYS 131 Cb 0.63 -1.47 -0.02 0.00 -0.02 0.00 0.00 35.03 34.15 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 1.40 0.44 2.70 0.72 0.00 -0.79 -4.98 105.19 104.67 1fui n GLY 132 Ca 0.19 -0.53 -0.28 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.43 1.72 0.31 -0.61 -4.36 -0.25 -5.03 121.20 110.54 1fui s ILE 133 Ca 0.00 -3.28 -0.29 0.00 -0.26 0.00 0.00 60.65 56.82 1fui s ILE 133 Cb 0.00 -2.16 -0.13 0.00 1.25 0.00 0.00 42.46 41.42 1fui s ILE 133 CO 0.00 -1.03 1.22 -2.65 0.24 0.00 0.00 174.94 172.72 1fui n PRO 134 N 2.72 1.86 -4.13 0.37 -0.02 -1.26 -4.51 135.00 130.03 1fui n PRO 134 Ca 0.19 0.65 -0.13 0.00 -2.02 0.00 0.00 63.50 62.19 1fui n PRO 134 Cb 0.38 -2.18 -0.11 0.00 -0.02 0.00 0.00 33.50 31.57 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 -0.90 0.90 0.40 3.55 0.00 -1.26 -4.66 121.76 119.79 1fui s ALA 135 Ca 0.59 -1.07 -0.13 0.00 0.00 0.00 0.00 51.96 51.35 1fui s ALA 135 Cb -0.63 0.06 -0.07 0.00 0.00 0.00 0.00 23.12 22.48 1fui s ALA 135 CO 0.59 -0.06 0.80 -0.06 0.00 0.00 0.00 175.76 177.03 1fui s PHE 136 N -2.28 3.44 -0.11 0.00 0.40 0.26 -0.82 117.98 118.87 1fui s PHE 136 Ca 0.01 1.16 0.00 0.00 -0.60 0.00 0.00 56.93 57.51 1fui s PHE 136 Cb -0.04 -2.53 -0.02 0.00 0.51 0.00 0.00 43.02 40.95 1fui s PHE 136 CO -0.01 -0.10 -0.12 0.45 0.70 0.00 0.00 175.22 176.14 1fui s SER 137 N -2.91 4.13 -0.32 1.36 0.15 -1.26 -1.58 113.70 113.26 1fui s SER 137 Ca 0.53 -0.26 0.02 0.00 0.70 0.00 0.00 55.95 56.94 1fui s SER 137 Cb -0.10 -1.44 0.10 0.00 -1.71 0.00 0.00 66.02 62.87 1fui s SER 137 CO 0.27 0.22 0.07 -0.63 1.20 0.00 0.00 173.24 174.37 1fui s ILE 138 N 0.05 1.67 -0.12 6.45 1.01 -0.33 -4.94 121.20 124.99 1fui s ILE 138 Ca -0.04 -1.91 0.00 0.00 0.00 0.00 0.00 60.65 58.70 1fui s ILE 138 Cb -0.14 -2.23 0.02 0.00 0.01 0.00 0.00 42.46 40.12 1fui s ILE 138 CO 0.04 -0.61 -0.11 -0.47 0.00 0.00 0.00 174.94 173.79 1fui s TYR 139 N 1.22 1.75 0.55 3.97 5.04 -1.26 -2.66 117.35 125.96 1fui s TYR 139 Ca 0.10 -0.89 -0.19 0.00 -2.44 0.00 0.00 57.07 53.65 1fui s TYR 139 Cb -0.18 -1.35 -0.05 0.00 0.35 0.00 0.00 41.96 40.72 1fui s TYR 139 CO -0.15 -0.53 1.11 0.20 -1.34 0.00 0.00 175.55 174.84 1fui s GLY 140 N 1.44 2.55 0.04 8.97 0.00 -1.26 -4.92 107.32 114.13 1fui s GLY 140 Ca 0.01 0.75 -0.20 0.00 0.00 0.00 0.00 44.72 45.29 1fui s GLY 140 CO -0.07 1.10 1.30 0.45 0.00 0.00 0.00 173.10 175.89 1fui h HIS 141 N 1.09 0.50 -3.01 1.90 3.86 -1.99 -3.46 115.15 114.04 1fui h HIS 141 Ca -0.49 -0.17 -0.67 0.00 -1.16 0.00 0.00 60.37 57.87 1fui h HIS 141 Cb 1.25 -0.10 -0.11 0.00 1.06 0.00 0.00 27.41 29.51 1fui h HIS 141 CO 0.53 0.85 -0.55 -0.51 0.86 0.00 0.00 177.93 179.10 1fui s ASP 142 N -6.28 5.78 0.34 2.45 1.01 -1.26 -5.09 116.67 113.63 1fui s ASP 142 Ca -0.14 0.29 -0.29 0.00 0.71 0.00 0.00 52.55 53.12 1fui s ASP 142 Cb 0.05 -1.77 -0.11 0.00 1.01 0.00 0.00 42.92 42.10 1fui s ASP 142 CO 0.77 0.38 1.48 -0.69 0.21 0.00 0.00 175.17 177.32 1fui s VAL 143 N -0.87 2.21 0.18 -1.27 1.01 -1.26 -4.88 120.40 115.52 1fui s VAL 143 Ca 0.13 0.20 0.09 0.00 0.00 0.00 0.00 61.98 62.40 1fui s VAL 143 Cb -0.12 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 1fui s VAL 143 CO 0.03 0.04 -0.07 -1.10 0.00 0.00 0.00 175.10 174.00 1fui s GLN 144 N -1.53 2.15 0.41 2.72 -0.21 0.14 -5.02 119.66 118.31 1fui s GLN 144 Ca 0.55 -1.24 -0.23 0.00 0.02 0.00 0.00 55.36 54.47 1fui s GLN 144 Cb -0.45 -2.20 -0.10 0.00 1.00 0.00 0.00 33.01 31.25 1fui s GLN 144 CO 0.56 0.44 0.97 -0.51 -2.12 0.00 0.00 175.29 174.63 1fui s ASP 145 N -2.89 6.93 0.58 5.90 1.01 -1.26 -4.47 116.67 122.46 1fui s ASP 145 Ca 0.26 1.81 0.28 0.00 0.71 0.00 0.00 52.55 55.61 1fui s ASP 145 Cb -0.09 -2.56 1.52 0.00 1.01 0.00 0.00 42.92 42.81 1fui s ASP 145 CO 0.16 -0.37 1.97 0.00 0.21 0.00 0.00 175.17 177.14 1fui h ALA 146 N 2.24 2.10 -0.01 5.23 0.00 -1.99 0.35 119.26 127.18 1fui h ALA 146 Ca -0.48 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1fui h ALA 146 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1fui h ALA 146 CO 0.62 -0.59 -0.35 -0.40 0.00 0.00 0.00 179.25 178.53 1fui n ASP 147 N -3.80 1.41 -4.69 0.00 5.68 -1.26 -4.90 116.55 108.99 1fui n ASP 147 Ca 0.06 -1.14 -0.42 0.00 -0.50 0.00 0.00 54.79 52.80 1fui n ASP 147 Cb 0.56 0.27 -0.03 0.00 -1.14 0.00 0.00 41.12 40.79 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 -2.49 7.05 0.00 -1.12 -1.08 0.11 -4.92 116.67 114.21 1fui s ASP 148 Ca 0.22 1.87 0.11 0.00 -0.52 0.00 0.00 52.55 54.23 1fui s ASP 148 Cb 0.19 -2.56 0.09 0.00 -1.46 0.00 0.00 42.92 39.17 1fui s ASP 148 CO 0.54 -0.56 0.84 0.35 0.52 0.00 0.00 175.17 176.86 1fui n THR 149 N 4.46 0.02 -1.79 1.71 -2.24 -1.26 -4.88 114.28 110.29 1fui n THR 149 Ca 0.11 -0.51 -0.31 0.00 -2.27 0.00 0.00 64.05 61.07 1fui n THR 149 Cb 0.46 1.21 0.02 0.00 -2.10 0.00 0.00 70.33 69.92 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 -0.89 5.95 -0.30 3.42 1.04 -1.26 -5.03 113.70 116.62 1fui s SER 150 Ca 0.13 1.50 -0.07 0.00 0.48 0.00 0.00 55.95 57.99 1fui s SER 150 Cb 0.09 -2.48 0.01 0.00 0.10 0.00 0.00 66.02 63.74 1fui s SER 150 CO 0.13 -1.06 0.09 -0.63 0.98 0.00 0.00 173.24 172.75 1fui s ILE 151 N -3.10 3.99 0.78 -1.02 1.01 -1.26 -5.09 121.20 116.51 1fui s ILE 151 Ca 0.56 -0.74 -0.14 0.00 0.00 0.00 0.00 60.65 60.33 1fui s ILE 151 Cb -0.12 -3.09 0.05 0.00 0.01 0.00 0.00 42.46 39.31 1fui s ILE 151 CO 0.53 0.04 1.06 -2.65 0.00 0.00 0.00 174.94 173.92 1fui n PRO 152 N 4.87 0.32 -0.20 2.79 -0.02 -1.26 -4.73 135.00 136.77 1fui n PRO 152 Ca -0.14 0.17 -0.01 0.00 -2.02 0.00 0.00 63.50 61.51 1fui n PRO 152 Cb 0.48 -2.32 0.10 0.00 -0.02 0.00 0.00 33.50 31.73 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 -0.63 0.76 -0.29 3.55 0.00 -1.99 0.24 119.26 120.89 1fui h ALA 153 Ca -0.47 0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 1fui h ALA 153 Cb 1.31 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 1fui h ALA 153 CO 0.46 -0.17 -0.06 0.38 0.00 0.00 0.00 179.25 179.86 1fui h ASP 154 N 0.42 0.44 -0.14 0.00 2.03 -2.00 -0.76 116.42 116.41 1fui h ASP 154 Ca 0.29 -0.09 -0.22 0.00 -0.73 0.00 0.00 57.03 56.28 1fui h ASP 154 Cb 0.33 -0.12 0.01 0.00 -0.83 0.00 0.00 39.33 38.73 1fui h ASP 154 CO -0.28 0.55 -0.77 0.58 -1.03 0.00 0.00 179.24 178.29 1fui h VAL 155 N 0.44 1.28 -0.48 4.15 2.07 -1.75 -2.94 116.25 119.03 1fui h VAL 155 Ca 0.09 -1.97 0.00 0.00 0.82 0.00 0.00 66.70 65.65 1fui h VAL 155 Cb 0.38 2.02 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1fui h VAL 155 CO 0.02 0.62 0.32 -0.08 0.02 0.00 0.00 177.57 178.47 1fui h GLU 156 N 0.50 0.64 -0.45 1.57 4.81 -0.54 -1.43 114.58 119.67 1fui h GLU 156 Ca -0.06 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.15 1fui h GLU 156 Cb 1.40 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.61 1fui h GLU 156 CO 0.16 0.42 0.28 1.49 -0.73 0.00 0.00 179.01 180.63 1fui h GLU 157 N 0.66 0.54 -0.60 1.92 4.81 -1.15 -0.43 114.58 120.33 1fui h GLU 157 Ca 0.18 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.29 1fui h GLU 157 Cb -0.07 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 29.16 1fui h GLU 157 CO -0.04 0.36 0.03 0.87 -0.73 0.00 0.00 179.01 179.50 1fui h LYS 158 N 0.56 1.03 -0.24 1.92 1.57 -1.31 -0.09 116.57 120.00 1fui h LYS 158 Ca 0.18 -0.30 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 1fui h LYS 158 Cb -0.01 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.18 1fui h LYS 158 CO -0.07 0.99 0.09 -0.07 -0.57 0.00 0.00 179.45 179.82 1fui h LEU 159 N 0.95 0.34 -0.50 2.94 3.38 -0.94 -0.29 115.31 121.19 1fui h LEU 159 Ca 0.18 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1fui h LEU 159 Cb 0.51 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.15 1fui h LEU 159 CO 0.02 0.43 0.11 -0.07 0.09 0.00 0.00 178.44 179.02 1fui h LEU 160 N 0.23 0.77 -0.59 1.67 3.38 -0.96 -1.11 115.31 118.70 1fui h LEU 160 Ca 0.08 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.77 1fui h LEU 160 Cb 0.20 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1fui h LEU 160 CO -0.01 0.81 0.21 -0.09 0.09 0.00 0.00 178.44 179.46 1fui h ARG 161 N 0.69 0.89 -0.36 1.13 2.43 -0.80 0.15 114.38 118.51 1fui h ARG 161 Ca 0.16 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 59.11 1fui h ARG 161 Cb 0.35 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.75 1fui h ARG 161 CO 0.00 0.78 0.06 0.35 -1.51 0.00 0.00 179.97 179.65 1fui h PHE 162 N 0.82 0.63 -0.28 2.20 3.57 -0.91 -2.47 116.94 120.50 1fui h PHE 162 Ca 0.19 -0.09 -0.03 0.00 3.53 0.00 0.00 57.97 61.58 1fui h PHE 162 Cb 0.23 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 1fui h PHE 162 CO 0.01 0.65 0.07 0.00 -2.23 0.00 0.00 178.31 176.81 1fui h ALA 163 N 0.91 0.36 -0.21 2.41 0.00 -1.00 0.11 119.26 121.83 1fui h ALA 163 Ca 0.11 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1fui h ALA 163 Cb 0.36 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1fui h ALA 163 CO 0.01 0.03 -0.01 -0.09 0.00 0.00 0.00 179.25 179.18 1fui h ARG 164 N 0.28 0.05 -0.27 0.00 2.43 -0.95 0.17 114.38 116.08 1fui h ARG 164 Ca 0.09 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.19 1fui h ARG 164 Cb 0.29 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1fui h ARG 164 CO 0.00 0.03 -0.10 0.00 -1.51 0.00 0.00 179.97 178.40 1fui h ALA 165 N 1.19 0.38 -0.99 2.80 0.00 -1.40 -2.58 119.26 118.66 1fui h ALA 165 Ca 0.10 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1fui h ALA 165 Cb 0.14 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 1fui h ALA 165 CO -0.18 0.22 0.65 0.78 0.00 0.00 0.00 179.25 180.71 1fui h GLY 166 N 0.29 1.43 1.04 0.00 0.00 -0.50 -1.90 103.07 103.42 1fui h GLY 166 Ca 0.06 -0.50 -0.06 0.00 0.00 0.00 0.00 47.33 46.84 1fui h GLY 166 CO 0.03 0.44 0.22 1.41 0.00 0.00 0.00 176.54 178.64 1fui h LEU 167 N 1.27 1.03 -0.40 3.11 3.38 -0.59 -1.67 115.31 121.44 1fui h LEU 167 Ca 0.39 -0.21 0.04 0.00 0.09 0.00 0.00 57.88 58.18 1fui h LEU 167 Cb -0.03 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.41 1fui h LEU 167 CO -0.11 0.97 0.18 0.00 0.09 0.00 0.00 178.44 179.56 1fui h ALA 168 N 1.10 0.49 0.07 1.53 0.00 -0.98 0.15 119.26 121.62 1fui h ALA 168 Ca 0.23 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1fui h ALA 168 Cb 0.31 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1fui h ALA 168 CO -0.01 -0.19 -0.08 0.28 0.00 0.00 0.00 179.25 179.26 1fui h VAL 169 N 0.37 0.82 -0.23 0.00 2.07 -1.12 -2.53 116.25 115.63 1fui h VAL 169 Ca 0.18 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.67 1fui h VAL 169 Cb 0.11 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 1fui h VAL 169 CO -0.14 0.00 0.04 0.00 0.02 0.00 0.00 177.57 177.49 1fui h ALA 170 N 0.75 1.64 0.00 1.67 0.00 -0.94 -2.88 119.26 119.50 1fui h ALA 170 Ca 0.01 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 1fui h ALA 170 Cb 0.17 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1fui h ALA 170 CO -0.03 0.28 -0.62 0.77 0.00 0.00 0.00 179.25 179.65 1fui h SER 171 N 0.33 0.00 0.43 0.00 0.02 -0.30 -3.22 113.55 110.81 1fui h SER 171 Ca 0.08 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.76 1fui h SER 171 Cb 0.16 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.72 1fui h SER 171 CO -0.00 0.62 -1.17 0.24 -1.14 0.00 0.00 176.83 175.37 1fui h MET 172 N 0.00 0.39 -6.17 3.45 2.86 -1.27 -3.44 114.93 110.75 1fui h MET 172 Ca -0.01 -0.56 -0.73 0.00 -2.06 0.00 0.00 59.70 56.35 1fui h MET 172 Cb 1.13 0.19 0.02 0.00 0.06 0.00 0.00 31.60 33.00 1fui h MET 172 CO 0.08 1.23 0.79 1.17 1.06 0.00 0.00 176.91 181.24 1fui n LYS 173 N -3.66 1.14 0.00 1.72 4.81 -1.13 -1.61 118.16 119.43 1fui n LYS 173 Ca -0.09 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.76 1fui n LYS 173 Cb 0.97 -2.09 0.00 0.00 0.02 0.00 0.00 35.03 33.93 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 3.79 2.46 3.94 3.14 0.00 0.29 -5.00 105.19 113.81 1fui n GLY 174 Ca 0.25 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.99 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 -0.50 1.56 0.21 1.61 -0.14 -0.63 -4.74 119.74 117.11 1fui s LYS 175 Ca 0.00 -0.41 0.08 0.00 -1.36 0.00 0.00 55.97 54.28 1fui s LYS 175 Cb 0.00 -2.06 -0.04 0.00 -1.68 0.00 0.00 37.83 34.05 1fui s LYS 175 CO 0.00 -1.71 0.04 -1.12 -0.76 0.00 0.00 175.35 171.80 1fui s SER 176 N -4.69 4.88 -0.20 2.83 0.01 -0.54 -0.90 113.70 115.10 1fui s SER 176 Ca 0.66 -0.43 -0.04 0.00 1.31 0.00 0.00 55.95 57.46 1fui s SER 176 Cb -0.08 -1.06 -0.02 0.00 0.21 0.00 0.00 66.02 65.08 1fui s SER 176 CO 0.48 0.04 -0.04 -0.47 0.41 0.00 0.00 173.24 173.66 1fui s TYR 177 N -1.97 2.97 -0.41 2.43 5.04 0.38 -1.47 117.35 124.32 1fui s TYR 177 Ca 0.30 -0.69 -0.19 0.00 -2.44 0.00 0.00 57.07 54.05 1fui s TYR 177 Cb -0.08 -2.05 0.02 0.00 0.35 0.00 0.00 41.96 40.19 1fui s TYR 177 CO 0.20 -0.36 0.56 -1.17 -1.34 0.00 0.00 175.55 173.44 1fui s LEU 178 N 1.09 4.54 -0.84 6.97 2.96 -0.21 -1.49 118.68 131.70 1fui s LEU 178 Ca 0.01 -0.33 -0.19 0.00 -0.22 0.00 0.00 54.13 53.41 1fui s LEU 178 Cb -0.15 -2.61 0.12 0.00 0.50 0.00 0.00 46.19 44.06 1fui s LEU 178 CO 0.00 -0.65 1.03 -0.55 -1.32 0.00 0.00 176.35 174.86 1fui s SER 179 N 1.88 6.50 -0.95 3.68 0.15 0.15 -1.16 113.70 123.95 1fui s SER 179 Ca 0.19 -1.82 -0.19 0.00 0.70 0.00 0.00 55.95 54.83 1fui s SER 179 Cb -0.15 -2.38 0.12 0.00 -1.71 0.00 0.00 66.02 61.89 1fui s SER 179 CO 0.16 -1.11 1.19 -0.22 1.20 0.00 0.00 173.24 174.46 1fui s LEU 180 N 2.80 4.76 0.00 3.45 0.20 -0.30 -1.36 118.68 128.23 1fui s LEU 180 Ca 0.27 -1.95 0.00 0.00 0.69 0.00 0.00 54.13 53.15 1fui s LEU 180 Cb -0.10 -2.43 0.00 0.00 -0.43 0.00 0.00 46.19 43.23 1fui s LEU 180 CO -0.04 -1.14 0.00 0.61 -0.29 0.00 0.00 176.35 175.49 1fui n GLY 181 N 5.74 -0.65 0.00 7.98 0.00 0.12 -0.92 105.19 117.45 1fui n GLY 181 Ca 0.26 -2.22 0.00 0.00 0.00 0.00 0.00 46.02 44.06 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 -0.10 1.93 3.73 -0.02 0.00 -1.26 -4.72 105.19 104.75 1fui n GLY 182 Ca 0.00 -0.02 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 3.27 4.34 -0.29 1.61 1.01 -1.25 -4.76 120.40 124.34 1fui s VAL 183 Ca 0.00 2.04 -0.05 0.00 0.00 0.00 0.00 61.98 63.97 1fui s VAL 183 Cb 0.00 -4.30 0.02 0.00 0.00 0.00 0.00 36.38 32.10 1fui s VAL 183 CO 0.00 0.36 0.05 -0.55 0.00 0.00 0.00 175.10 174.95 1fui s SER 184 N -0.28 4.97 -1.53 3.32 0.15 -1.26 -4.76 113.70 114.30 1fui s SER 184 Ca 0.46 -0.88 -0.07 0.00 0.70 0.00 0.00 55.95 56.16 1fui s SER 184 Cb -0.24 -1.82 0.06 0.00 -1.71 0.00 0.00 66.02 62.31 1fui s SER 184 CO 0.31 -0.21 0.52 0.23 1.20 0.00 0.00 173.24 175.29 1fui n MET 185 N 4.79 -3.04 -1.33 5.44 2.81 -1.26 -1.33 117.12 123.20 1fui n MET 185 Ca -0.14 0.36 -0.11 0.00 -1.81 0.00 0.00 57.70 56.00 1fui n MET 185 Cb 0.47 -4.66 -0.05 0.00 -0.71 0.00 0.00 33.22 28.27 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 -1.82 1.10 3.63 3.03 0.00 -1.26 -4.94 105.19 104.93 1fui n GLY 186 Ca -0.16 -0.04 -0.43 0.00 0.00 0.00 0.00 46.02 45.39 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 -2.02 3.90 0.25 -0.61 1.01 -0.44 -4.92 121.20 118.37 1fui s ILE 187 Ca 0.00 1.01 -0.09 0.00 0.00 0.00 0.00 60.65 61.57 1fui s ILE 187 Cb 0.00 -3.94 0.34 0.00 0.01 0.00 0.00 42.46 38.87 1fui s ILE 187 CO 0.00 -0.41 1.60 0.00 0.00 0.00 0.00 174.94 176.13 1fui h ALA 188 N 10.16 0.66 0.00 9.38 0.00 -1.92 0.14 119.26 137.68 1fui h ALA 188 Ca -0.30 0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fui h ALA 188 Cb 1.13 0.57 0.00 0.00 0.00 0.00 0.00 17.79 19.49 1fui h ALA 188 CO 1.02 -0.43 0.00 0.78 0.00 0.00 0.00 179.25 180.63 1fui h GLY 189 N 0.02 0.00 0.66 0.00 0.00 -1.92 0.23 103.07 102.07 1fui h GLY 189 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1fui h GLY 189 CO -0.81 0.00 -0.19 -1.14 0.00 0.00 0.00 176.54 174.40 1fui n SER 190 N -2.98 0.69 -4.34 0.19 3.41 0.49 -2.01 113.62 109.06 1fui n SER 190 Ca -0.03 -0.65 -0.44 0.00 -0.26 0.00 0.00 58.87 57.50 1fui n SER 190 Cb 0.07 0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.04 1fui n SER 190 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1fui n ILE 191 N -0.88 4.30 -1.67 -1.33 5.41 0.07 -3.83 119.36 121.43 1fui n ILE 191 Ca 0.13 -4.70 -0.55 0.00 1.00 0.00 0.00 62.75 58.62 1fui n ILE 191 Cb 0.31 -2.44 -0.07 0.00 -0.71 0.00 0.00 39.64 36.73 1fui n ILE 191 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1fui n VAL 192 N 4.25 0.34 -2.96 1.39 0.31 -1.26 -4.94 118.33 115.47 1fui n VAL 192 Ca 0.37 -0.09 -0.44 0.00 -0.01 0.00 0.00 64.34 64.17 1fui n VAL 192 Cb 0.41 -1.39 -0.04 0.00 -0.91 0.00 0.00 33.84 31.92 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 4.17 6.19 0.25 4.52 -1.08 -1.26 -4.91 116.67 124.54 1fui s ASP 193 Ca 0.99 -1.20 -0.06 0.00 -0.52 0.00 0.00 52.55 51.76 1fui s ASP 193 Cb -0.98 -2.37 0.26 0.00 -1.46 0.00 0.00 42.92 38.37 1fui s ASP 193 CO 0.61 -1.30 1.91 0.45 0.52 0.00 0.00 175.17 177.37 1fui h HIS 194 N 9.39 1.21 -0.67 -5.34 3.86 -2.01 -2.48 115.15 119.11 1fui h HIS 194 Ca -0.28 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 58.93 1fui h HIS 194 Cb 1.08 -0.41 -0.03 0.00 1.06 0.00 0.00 27.41 29.11 1fui h HIS 194 CO 0.92 0.74 0.29 -0.97 0.86 0.00 0.00 177.93 179.77 1fui h ASN 195 N 1.28 0.87 -0.14 2.45 -1.24 -1.99 -1.90 115.58 114.92 1fui h ASN 195 Ca 0.36 -0.11 -0.00 0.00 0.71 0.00 0.00 56.30 57.27 1fui h ASN 195 Cb -0.10 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 38.71 1fui h ASN 195 CO -0.09 0.76 0.09 0.15 -1.29 0.00 0.00 177.43 177.05 1fui h PHE 196 N 0.95 0.18 -0.67 0.67 3.57 -1.87 0.76 116.94 120.54 1fui h PHE 196 Ca 0.23 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.74 1fui h PHE 196 Cb 0.14 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 38.78 1fui h PHE 196 CO 0.01 0.15 0.44 0.74 -2.23 0.00 0.00 178.31 177.42 1fui h PHE 197 N 0.17 0.84 -0.05 0.41 0.04 -1.40 -1.44 116.94 115.51 1fui h PHE 197 Ca 0.05 0.02 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 1fui h PHE 197 Cb 0.01 -0.28 -0.00 0.00 2.20 0.00 0.00 35.95 37.88 1fui h PHE 197 CO -0.06 0.54 -0.06 0.93 -0.60 0.00 0.00 178.31 179.05 1fui h GLU 198 N 0.91 0.13 0.13 1.51 5.08 -1.09 -0.14 114.58 121.11 1fui h GLU 198 Ca 0.24 -0.07 -0.30 0.00 -1.00 0.00 0.00 59.36 58.23 1fui h GLU 198 Cb -0.10 0.01 0.03 0.00 0.50 0.00 0.00 28.75 29.18 1fui h GLU 198 CO -0.05 0.61 -1.26 0.77 -1.00 0.00 0.00 179.01 178.08 1fui h SER 199 N -0.35 0.79 0.06 1.42 0.02 -0.84 -2.87 113.55 111.79 1fui h SER 199 Ca 0.01 -0.75 -0.31 0.00 -0.84 0.00 0.00 61.79 59.90 1fui h SER 199 Cb 0.60 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 1fui h SER 199 CO 0.01 1.57 -1.67 0.79 -1.14 0.00 0.00 176.83 176.39 1fui n TRP 200 N -3.74 1.07 1.00 3.45 8.01 -0.55 -1.55 117.44 125.13 1fui n TRP 200 Ca -0.13 0.34 0.10 0.00 -1.31 0.00 0.00 57.50 56.50 1fui n TRP 200 Cb 1.00 -1.12 -0.11 0.00 -2.01 0.00 0.00 31.31 29.07 1fui n TRP 200 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.69 177.96 1fui n LEU 201 N -3.97 0.98 -1.44 -0.99 4.77 -1.10 -4.52 117.00 110.73 1fui n LEU 201 Ca -0.33 -0.48 -0.13 0.00 -0.03 0.00 0.00 56.01 55.03 1fui n LEU 201 Cb 0.86 -0.01 -0.02 0.00 -2.33 0.00 0.00 43.42 41.93 1fui n LEU 201 CO 0.29 0.24 -0.16 0.61 -1.33 0.00 0.00 177.39 177.04 1fui n GLY 202 N 1.50 0.09 3.92 -0.72 0.00 -0.35 -4.01 105.19 105.62 1fui n GLY 202 Ca 0.04 -0.34 -0.23 0.00 0.00 0.00 0.00 46.02 45.50 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 -4.40 2.37 0.22 1.61 1.00 -0.21 -0.55 119.30 119.34 1fui s MET 203 Ca 0.00 -1.76 0.11 0.00 0.00 0.00 0.00 55.69 54.04 1fui s MET 203 Cb 0.00 -2.31 -0.05 0.00 0.00 0.00 0.00 34.83 32.48 1fui s MET 203 CO 0.00 -0.49 -0.21 0.15 0.00 0.00 0.00 175.02 174.47 1fui s LYS 204 N -4.29 1.52 -0.11 2.03 1.02 -0.08 -3.32 119.74 116.51 1fui s LYS 204 Ca 0.45 -1.60 0.02 0.00 0.02 0.00 0.00 55.97 54.85 1fui s LYS 204 Cb -0.03 -1.67 -0.01 0.00 -0.52 0.00 0.00 37.83 35.59 1fui s LYS 204 CO 0.27 0.33 -0.16 0.08 -0.92 0.00 0.00 175.35 174.95 1fui s VAL 205 N -2.16 2.76 -0.23 3.17 1.01 -1.26 -0.47 120.40 123.23 1fui s VAL 205 Ca 0.24 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.43 1fui s VAL 205 Cb -0.06 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.22 1fui s VAL 205 CO 0.11 0.54 -0.10 -1.58 0.00 0.00 0.00 175.10 174.07 1fui s GLN 206 N 0.21 2.92 -0.12 2.72 2.00 -0.56 -4.93 119.66 121.89 1fui s GLN 206 Ca -0.10 -0.91 -0.13 0.00 -2.00 0.00 0.00 55.36 52.22 1fui s GLN 206 Cb -0.16 -2.87 -0.05 0.00 0.80 0.00 0.00 33.01 30.73 1fui s GLN 206 CO 0.06 -0.33 0.30 0.00 -0.50 0.00 0.00 175.29 174.82 1fui s ALA 207 N 1.32 3.65 -0.04 1.58 0.00 -1.26 -0.67 121.76 126.33 1fui s ALA 207 Ca 0.02 -0.42 -0.01 0.00 0.00 0.00 0.00 51.96 51.55 1fui s ALA 207 Cb -0.16 -2.34 0.03 0.00 0.00 0.00 0.00 23.12 20.65 1fui s ALA 207 CO -0.07 0.23 0.02 0.08 0.00 0.00 0.00 175.76 176.02 1fui s VAL 208 N -0.02 0.14 0.45 0.00 1.01 -0.46 -4.96 120.40 116.56 1fui s VAL 208 Ca 0.18 0.18 -0.23 0.00 0.00 0.00 0.00 61.98 62.11 1fui s VAL 208 Cb -0.14 -0.29 -0.08 0.00 0.00 0.00 0.00 36.38 35.88 1fui s VAL 208 CO 0.06 0.17 1.13 -0.62 0.00 0.00 0.00 175.10 175.84 1fui s ASP 209 N 1.48 6.29 0.51 3.32 -1.08 -1.26 -0.71 116.67 125.22 1fui s ASP 209 Ca -0.03 2.21 0.34 0.00 -0.52 0.00 0.00 52.55 54.55 1fui s ASP 209 Cb -0.13 -2.59 1.76 0.00 -1.46 0.00 0.00 42.92 40.50 1fui s ASP 209 CO -0.03 -0.83 2.04 0.24 0.52 0.00 0.00 175.17 177.12 1fui h MET 210 N 2.07 0.00 -0.00 4.34 2.86 -1.92 -1.07 114.93 121.20 1fui h MET 210 Ca -0.49 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.15 1fui h MET 210 Cb 1.24 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.90 1fui h MET 210 CO 0.60 0.00 0.01 1.79 1.06 0.00 0.00 176.91 180.37 1fui h THR 211 N 0.00 0.60 -0.20 2.22 1.35 -2.00 0.54 112.91 115.43 1fui h THR 211 Ca 0.00 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.81 1fui h THR 211 Cb 0.13 1.00 -0.01 0.00 -1.73 0.00 0.00 68.15 67.53 1fui h THR 211 CO 0.00 0.00 -0.10 -0.08 -0.25 0.00 0.00 175.52 175.09 1fui h GLU 212 N 0.00 0.31 -0.28 4.72 4.57 -1.56 -0.32 114.58 122.02 1fui h GLU 212 Ca 0.00 -0.07 -0.14 0.00 -1.18 0.00 0.00 59.36 57.97 1fui h GLU 212 Cb 0.01 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 28.56 1fui h GLU 212 CO -0.00 0.43 -0.36 1.25 -1.18 0.00 0.00 179.01 179.14 1fui h LEU 213 N 0.30 0.81 -1.06 1.64 6.46 -1.08 -2.09 115.31 120.28 1fui h LEU 213 Ca 0.06 -0.50 0.02 0.00 -0.12 0.00 0.00 57.88 57.34 1fui h LEU 213 Cb 0.37 -0.23 -0.05 0.00 -0.73 0.00 0.00 40.66 40.02 1fui h LEU 213 CO 0.02 1.14 0.63 -0.09 -0.62 0.00 0.00 178.44 179.53 1fui h ARG 214 N 0.49 1.23 -0.38 1.25 9.65 -1.15 -2.14 114.38 123.33 1fui h ARG 214 Ca 0.03 -0.07 -0.06 0.00 -1.10 0.00 0.00 59.98 58.77 1fui h ARG 214 Cb 0.95 -0.28 -0.01 0.00 -1.39 0.00 0.00 29.97 29.24 1fui h ARG 214 CO 0.09 0.82 -0.01 -0.09 2.80 0.00 0.00 179.97 183.57 1fui h ARG 215 N 1.27 0.69 -0.54 0.20 2.43 -0.79 -0.27 114.38 117.37 1fui h ARG 215 Ca 0.36 -0.23 -0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1fui h ARG 215 Cb -0.10 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.37 1fui h ARG 215 CO -0.09 0.79 0.11 0.00 -1.51 0.00 0.00 179.97 179.28 1fui h ARG 216 N 0.51 0.84 -0.01 0.20 2.47 -1.13 0.00 114.38 117.25 1fui h ARG 216 Ca 0.11 -0.18 -0.01 0.00 -1.26 0.00 0.00 59.98 58.64 1fui h ARG 216 Cb 0.49 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 28.69 1fui h ARG 216 CO 0.02 0.77 -0.03 0.82 0.56 0.00 0.00 179.97 182.10 1fui h ILE 217 N 0.80 1.48 -0.21 2.04 2.04 -1.20 0.42 117.51 122.88 1fui h ILE 217 Ca 0.17 -1.45 -0.09 0.00 1.00 0.00 0.00 64.86 64.49 1fui h ILE 217 Cb 0.32 2.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.81 1fui h ILE 217 CO 0.00 0.38 -0.27 0.44 0.00 0.00 0.00 178.15 178.70 1fui h ASP 218 N -0.54 0.41 -0.55 1.72 3.32 -1.01 -3.03 116.42 116.74 1fui h ASP 218 Ca -0.00 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.91 1fui h ASP 218 Cb 0.64 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.08 1fui h ASP 218 CO 0.01 0.68 0.00 0.00 -1.72 0.00 0.00 179.24 178.20 1fui n GLN 219 N -4.12 2.87 -3.61 3.56 6.02 -0.02 -4.95 117.38 117.14 1fui n GLN 219 Ca -0.01 -2.22 -0.25 0.00 -0.01 0.00 0.00 57.00 54.51 1fui n GLN 219 Cb 0.41 -1.65 0.06 0.00 1.02 0.00 0.00 30.24 30.08 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 1.00 -6.98 -2.34 -1.09 4.01 -1.10 -4.91 118.16 106.75 1fui n LYS 220 Ca 0.20 0.78 -0.43 0.00 -0.51 0.00 0.00 58.31 58.35 1fui n LYS 220 Cb 0.64 -5.77 0.00 0.00 -0.51 0.00 0.00 35.03 29.40 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 -4.86 4.24 -3.72 -0.18 5.41 0.12 -4.83 119.36 115.54 1fui n ILE 221 Ca 0.00 -4.28 -0.01 0.00 1.00 0.00 0.00 62.75 59.46 1fui n ILE 221 Cb 0.56 -2.39 -0.01 0.00 -0.71 0.00 0.00 39.64 37.09 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 0.85 -0.07 -0.45 1.39 -0.85 -1.26 -4.83 117.35 112.12 1fui s TYR 222 Ca 0.41 -0.15 -0.29 0.00 -0.52 0.00 0.00 57.07 56.52 1fui s TYR 222 Cb 0.09 0.60 0.03 0.00 0.38 0.00 0.00 41.96 43.06 1fui s TYR 222 CO -0.00 -0.58 1.11 0.34 -1.52 0.00 0.00 175.55 174.90 1fui s ASP 223 N -3.03 6.67 0.27 -0.18 -1.08 -1.26 -4.92 116.67 113.13 1fui s ASP 223 Ca 0.14 0.52 -0.00 0.00 -0.52 0.00 0.00 52.55 52.69 1fui s ASP 223 Cb 0.01 -2.54 0.37 0.00 -1.46 0.00 0.00 42.92 39.30 1fui s ASP 223 CO -0.00 -1.18 1.75 -0.33 0.52 0.00 0.00 175.17 175.93 1fui h GLU 224 N 9.04 0.69 -0.61 4.34 5.08 -2.00 -2.66 114.58 128.46 1fui h GLU 224 Ca -0.23 -0.20 -0.05 0.00 -1.00 0.00 0.00 59.36 57.88 1fui h GLU 224 Cb 1.06 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.21 1fui h GLU 224 CO 1.10 0.76 0.17 0.00 -1.00 0.00 0.00 179.01 180.05 1fui h ALA 225 N 1.28 1.15 -0.32 3.43 0.00 -2.00 -2.48 119.26 120.32 1fui h ALA 225 Ca 0.12 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1fui h ALA 225 Cb 0.51 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1fui h ALA 225 CO 0.03 0.58 -0.30 1.49 0.00 0.00 0.00 179.25 181.05 1fui h GLU 226 N 0.90 0.67 -0.08 0.00 4.81 -1.92 -2.23 114.58 116.74 1fui h GLU 226 Ca 0.20 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1fui h GLU 226 Cb 0.29 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1fui h GLU 226 CO -0.01 0.89 0.05 1.25 -0.73 0.00 0.00 179.01 180.46 1fui h LEU 227 N 0.57 0.09 -0.43 1.64 5.85 -1.14 0.34 115.31 122.23 1fui h LEU 227 Ca 0.07 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.85 1fui h LEU 227 Cb 0.80 -0.02 -0.08 0.00 0.37 0.00 0.00 40.66 41.72 1fui h LEU 227 CO 0.07 0.09 -0.09 -0.33 -0.34 0.00 0.00 178.44 177.83 1fui h GLU 228 N 0.08 0.02 -0.70 1.25 5.08 -1.28 -0.76 114.58 118.27 1fui h GLU 228 Ca 0.03 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 1fui h GLU 228 Cb 0.01 -0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1fui h GLU 228 CO -0.01 0.01 0.28 1.98 -1.00 0.00 0.00 179.01 180.27 1fui h MET 229 N 0.02 1.04 -0.28 2.33 4.05 -0.81 -1.77 114.93 119.51 1fui h MET 229 Ca 0.21 -0.18 -0.03 0.00 -0.28 0.00 0.00 59.70 59.42 1fui h MET 229 Cb 0.32 -0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 30.93 1fui h MET 229 CO -0.43 0.85 0.05 0.00 0.23 0.00 0.00 176.91 177.61 1fui h ALA 230 N 1.28 0.37 -0.65 0.39 0.00 0.82 -1.83 119.26 119.63 1fui h ALA 230 Ca 0.24 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 1fui h ALA 230 Cb 0.20 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 1fui h ALA 230 CO -0.02 0.05 0.31 -0.07 0.00 0.00 0.00 179.25 179.51 1fui h LEU 231 N 0.28 0.86 -0.38 0.00 3.38 -0.95 -0.00 115.31 118.51 1fui h LEU 231 Ca 0.09 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.95 1fui h LEU 231 Cb 0.32 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.81 1fui h LEU 231 CO 0.00 0.76 0.16 0.00 0.09 0.00 0.00 178.44 179.46 1fui h ALA 232 N 1.14 0.46 -0.53 1.53 0.00 -1.18 0.98 119.26 121.65 1fui h ALA 232 Ca 0.22 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1fui h ALA 232 Cb 0.13 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1fui h ALA 232 CO -0.03 -0.22 0.34 2.35 0.00 0.00 0.00 179.25 181.70 1fui h TRP 233 N 0.34 0.68 -0.16 0.00 7.01 -0.95 -0.98 115.95 121.89 1fui h TRP 233 Ca 0.17 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.17 1fui h TRP 233 Cb 0.11 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 26.93 1fui h TRP 233 CO -0.12 0.44 0.05 0.00 -2.79 0.00 0.00 178.44 176.02 1fui h ALA 234 N 1.18 0.20 -0.75 2.65 0.00 -0.30 -0.95 119.26 121.29 1fui h ALA 234 Ca 0.19 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1fui h ALA 234 Cb -0.06 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.61 1fui h ALA 234 CO -0.04 -0.19 0.46 -0.44 0.00 0.00 0.00 179.25 179.04 1fui h ASP 235 N 0.08 0.73 1.19 0.00 3.32 -0.68 0.77 116.42 121.83 1fui h ASP 235 Ca 0.05 0.01 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 1fui h ASP 235 Cb 0.20 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.61 1fui h ASP 235 CO -0.00 0.48 -0.12 0.50 -1.72 0.00 0.00 179.24 178.38 1fui h LYS 236 N 0.86 0.00 0.00 3.56 1.63 -0.97 -3.39 116.57 118.26 1fui h LYS 236 Ca 0.32 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.12 1fui h LYS 236 Cb 0.11 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.74 1fui h LYS 236 CO -0.15 0.12 -0.73 0.09 -3.45 0.00 0.00 179.45 175.33 1fui n ASN 237 N -3.21 3.67 -4.68 4.20 3.02 -0.38 -5.06 115.26 112.82 1fui n ASN 237 Ca 0.01 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.14 1fui n ASN 237 Cb 0.42 0.62 -0.03 0.00 -0.61 0.00 0.00 39.78 40.18 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 -1.55 2.51 -0.27 3.10 0.40 0.23 -4.79 117.98 117.61 1fui s PHE 238 Ca 0.00 0.54 -0.12 0.00 -0.60 0.00 0.00 56.93 56.76 1fui s PHE 238 Cb 0.00 -3.79 -0.05 0.00 0.51 0.00 0.00 43.02 39.69 1fui s PHE 238 CO 0.00 -3.11 0.22 0.50 0.70 0.00 0.00 175.22 173.53 1fui s ARG 239 N 3.00 3.99 0.20 0.44 3.52 -1.26 -4.97 118.95 123.87 1fui s ARG 239 Ca 0.68 -0.24 -0.08 0.00 -0.13 0.00 0.00 55.73 55.96 1fui s ARG 239 Cb -0.33 -3.63 -0.07 0.00 -1.56 0.00 0.00 34.95 29.36 1fui s ARG 239 CO 0.28 -0.14 0.49 0.71 -0.81 0.00 0.00 175.30 175.82 1fui s TYR 240 N 1.65 3.44 0.44 5.12 2.02 -1.26 -0.32 117.35 128.44 1fui s TYR 240 Ca 0.09 0.75 0.08 0.00 -0.37 0.00 0.00 57.07 57.62 1fui s TYR 240 Cb -0.15 -2.16 0.01 0.00 -0.40 0.00 0.00 41.96 39.26 1fui s TYR 240 CO 0.09 0.32 0.54 0.20 -1.57 0.00 0.00 175.55 175.14 1fui s GLY 241 N -2.42 1.99 0.24 0.71 0.00 0.21 -4.75 107.32 103.30 1fui s GLY 241 Ca 0.45 -1.77 -0.30 0.00 0.00 0.00 0.00 44.72 43.10 1fui s GLY 241 CO 0.23 -1.59 1.36 -0.54 0.00 0.00 0.00 173.10 172.56 1fui s GLU 242 N -4.32 4.34 -0.28 2.90 0.41 -1.26 -4.75 118.70 115.73 1fui s GLU 242 Ca 0.53 2.17 -0.29 0.00 -0.41 0.00 0.00 54.97 56.97 1fui s GLU 242 Cb -0.07 -3.14 0.01 0.00 -1.78 0.00 0.00 34.13 29.14 1fui s GLU 242 CO 0.32 -0.30 1.15 0.34 -0.49 0.00 0.00 175.26 176.28 1fui s ASP 243 N 0.22 6.89 -0.15 -0.19 -1.08 -1.26 -4.70 116.67 116.40 1fui s ASP 243 Ca 0.56 1.23 0.13 0.00 -0.52 0.00 0.00 52.55 53.96 1fui s ASP 243 Cb -0.39 -2.54 0.66 0.00 -1.46 0.00 0.00 42.92 39.18 1fui s ASP 243 CO 0.42 -0.88 1.53 -0.62 0.52 0.00 0.00 175.17 176.13 1fui n GLU 244 N 6.87 3.83 -2.05 4.34 1.02 -1.26 -4.98 120.64 128.40 1fui n GLU 244 Ca 0.13 -2.54 -0.32 0.00 -0.02 0.00 0.00 57.16 54.41 1fui n GLU 244 Cb 0.46 -1.99 0.00 0.00 -0.02 0.00 0.00 31.44 29.90 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 -0.73 6.14 0.74 1.62 0.01 -1.26 -5.02 114.94 116.44 1fui s ASN 245 Ca 0.45 1.59 -0.15 0.00 -0.71 0.00 0.00 52.86 54.03 1fui s ASN 245 Cb 0.32 -2.50 0.02 0.00 0.41 0.00 0.00 41.25 39.50 1fui s ASN 245 CO 0.17 -0.92 1.03 -3.20 -1.51 0.00 0.00 177.10 172.67 1fui n ASN 246 N -2.24 0.67 -0.32 -1.22 2.85 -1.26 -4.85 115.26 108.90 1fui n ASN 246 Ca 0.07 0.65 0.01 0.00 -0.11 0.00 0.00 54.58 55.20 1fui n ASN 246 Cb 0.54 -1.44 0.08 0.00 1.24 0.00 0.00 39.78 40.20 1fui n ASN 246 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 1fui h LYS 247 N -0.37 -0.03 0.00 1.20 1.79 -2.00 -2.30 116.57 114.87 1fui h LYS 247 Ca -0.47 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.00 1fui h LYS 247 Cb 1.32 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.98 1fui h LYS 247 CO 0.47 -0.02 0.00 1.96 -1.08 0.00 0.00 179.45 180.78 1fui h GLN 248 N -0.03 0.00 -0.01 3.15 4.20 -2.05 -3.30 115.11 117.08 1fui h GLN 248 Ca 0.37 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.08 1fui h GLN 248 Cb 0.62 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.40 1fui h GLN 248 CO -0.90 0.00 -0.32 0.66 -0.67 0.00 0.00 178.83 177.59 1fui n TYR 249 N -2.73 0.00 -2.45 2.96 4.01 -0.86 -4.93 117.16 113.15 1fui n TYR 249 Ca 0.03 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.37 1fui n TYR 249 Cb 0.35 -0.14 -0.04 0.00 -0.31 0.00 0.00 39.34 39.20 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 -2.61 4.44 0.17 -0.72 -0.21 -1.24 -4.98 119.66 114.51 1fui s GLN 250 Ca 0.21 1.75 0.09 0.00 0.02 0.00 0.00 55.36 57.44 1fui s GLN 250 Cb 0.19 -2.97 -0.04 0.00 1.00 0.00 0.00 33.01 31.19 1fui s GLN 250 CO 0.56 0.05 -0.13 -0.98 -2.12 0.00 0.00 175.29 172.67 1fui s ARG 251 N -1.81 1.95 0.26 2.91 1.70 -1.26 -5.05 118.95 117.64 1fui s ARG 251 Ca 0.49 -1.28 0.00 0.00 -0.47 0.00 0.00 55.73 54.47 1fui s ARG 251 Cb -0.30 -2.11 0.00 0.00 -0.57 0.00 0.00 34.95 31.97 1fui s ARG 251 CO 0.38 0.44 0.00 0.27 -1.08 0.00 0.00 175.30 175.31 1fui n ASN 252 N 0.21 -2.27 -4.20 -2.89 0.23 -1.26 -4.63 115.26 100.45 1fui n ASN 252 Ca -0.12 0.49 -0.05 0.00 -0.53 0.00 0.00 54.58 54.37 1fui n ASN 252 Cb 0.55 2.34 -0.04 0.00 -2.08 0.00 0.00 39.78 40.55 1fui n ASN 252 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1fui n ALA 253 N -3.01 0.39 -1.41 -2.53 0.00 -1.26 -1.70 120.51 110.98 1fui n ALA 253 Ca 0.00 -1.43 -0.15 0.00 0.00 0.00 0.00 53.44 51.86 1fui n ALA 253 Cb 0.00 -1.49 -0.06 0.00 0.00 0.00 0.00 19.45 17.89 1fui n ALA 253 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1fui n GLU 254 N 5.77 -1.41 -0.01 0.00 2.13 -1.26 -4.84 120.64 121.02 1fui n GLU 254 Ca 0.14 0.90 -0.10 0.00 0.66 0.00 0.00 57.16 58.77 1fui n GLU 254 Cb 0.49 -5.18 -0.14 0.00 0.27 0.00 0.00 31.44 26.88 1fui n GLU 254 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 1fui h GLN 255 N 0.00 0.03 0.00 5.31 4.20 -1.67 -3.34 115.11 119.64 1fui h GLN 255 Ca -0.30 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.24 1fui h GLN 255 Cb 1.03 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.81 1fui h GLN 255 CO 0.44 0.63 -0.54 0.77 -0.67 0.00 0.00 178.83 179.47 1fui h SER 256 N 0.01 0.00 -0.98 1.46 0.02 -1.82 -2.94 113.55 109.29 1fui h SER 256 Ca -0.27 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.72 1fui h SER 256 Cb 1.99 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 64.47 1fui h SER 256 CO 0.09 0.54 0.64 -0.09 -1.14 0.00 0.00 176.83 176.87 1fui h ARG 257 N 0.00 1.19 -0.55 3.45 9.65 -1.89 -0.55 114.38 125.69 1fui h ARG 257 Ca -0.01 -0.07 -0.07 0.00 -1.10 0.00 0.00 59.98 58.73 1fui h ARG 257 Cb 0.98 -0.27 -0.02 0.00 -1.39 0.00 0.00 29.97 29.27 1fui h ARG 257 CO 0.07 0.79 0.07 0.00 2.80 0.00 0.00 179.97 183.70 1fui h ALA 258 N 1.43 1.08 -0.34 2.80 0.00 -1.65 0.16 119.26 122.74 1fui h ALA 258 Ca 0.39 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 55.01 1fui h ALA 258 Cb 0.02 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1fui h ALA 258 CO -0.13 0.59 0.05 0.28 0.00 0.00 0.00 179.25 180.05 1fui h VAL 259 N 0.85 1.24 0.19 0.00 2.07 -1.13 -1.97 116.25 117.49 1fui h VAL 259 Ca 0.17 -0.84 -0.01 0.00 0.82 0.00 0.00 66.70 66.84 1fui h VAL 259 Cb 0.40 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.32 1fui h VAL 259 CO 0.01 0.28 -0.09 0.25 0.02 0.00 0.00 177.57 178.04 1fui h LEU 260 N 0.39 -0.21 -0.28 2.57 7.12 -0.87 0.86 115.31 124.89 1fui h LEU 260 Ca 0.10 0.01 0.05 0.00 0.13 0.00 0.00 57.88 58.17 1fui h LEU 260 Cb 0.36 0.06 -0.05 0.00 -0.53 0.00 0.00 40.66 40.50 1fui h LEU 260 CO 0.01 -0.15 -0.02 -0.09 -0.13 0.00 0.00 178.44 178.06 1fui h ARG 261 N -0.26 0.06 -0.52 1.25 2.43 -0.67 -0.11 114.38 116.56 1fui h ARG 261 Ca -0.03 -0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.05 1fui h ARG 261 Cb 0.20 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 1fui h ARG 261 CO 0.04 0.04 -0.04 1.49 -1.51 0.00 0.00 179.97 179.99 1fui h GLU 262 N 0.06 0.91 -0.42 0.20 4.81 -1.21 -1.58 114.58 117.34 1fui h GLU 262 Ca 0.14 -0.28 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1fui h GLU 262 Cb 0.19 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1fui h GLU 262 CO -0.25 0.93 0.27 0.77 -0.73 0.00 0.00 179.01 180.00 1fui h SER 263 N 0.83 0.50 -0.65 1.04 0.02 -0.05 0.19 113.55 115.43 1fui h SER 263 Ca 0.15 -0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 61.01 1fui h SER 263 Cb 0.55 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 1fui h SER 263 CO 0.03 0.39 0.22 -0.07 -1.14 0.00 0.00 176.83 176.26 1fui h LEU 264 N 0.57 0.92 -1.13 5.07 3.38 -0.87 -2.50 115.31 120.74 1fui h LEU 264 Ca 0.15 -0.19 0.03 0.00 0.09 0.00 0.00 57.88 57.96 1fui h LEU 264 Cb -0.03 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 40.43 1fui h LEU 264 CO -0.03 0.87 0.59 -0.07 0.09 0.00 0.00 178.44 179.89 1fui h LEU 265 N 0.92 0.97 -1.12 1.67 3.38 -0.71 -1.68 115.31 118.74 1fui h LEU 265 Ca 0.21 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.18 1fui h LEU 265 Cb 0.26 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.74 1fui h LEU 265 CO -0.01 0.67 0.60 0.24 0.09 0.00 0.00 178.44 180.02 1fui h MET 266 N 1.13 1.17 -0.27 1.13 2.86 -0.53 0.01 114.93 120.42 1fui h MET 266 Ca 0.36 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.89 1fui h MET 266 Cb 0.02 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.40 1fui h MET 266 CO -0.11 0.77 0.04 0.00 1.06 0.00 0.00 176.91 178.68 1fui h ALA 267 N 1.44 0.36 0.26 6.32 0.00 -1.09 -1.62 119.26 124.93 1fui h ALA 267 Ca 0.33 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1fui h ALA 267 Cb -0.12 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1fui h ALA 267 CO -0.08 0.05 -0.12 0.52 0.00 0.00 0.00 179.25 179.62 1fui h MET 268 N 0.26 -0.33 -0.84 0.00 2.07 -0.88 -1.59 114.93 113.62 1fui h MET 268 Ca 0.08 0.02 -0.04 0.00 -2.07 0.00 0.00 59.70 57.70 1fui h MET 268 Cb 0.34 0.08 -0.04 0.00 -1.87 0.00 0.00 31.60 30.10 1fui h MET 268 CO 0.01 -0.21 0.37 0.00 1.07 0.00 0.00 176.91 178.15 1fui h ILE 270 N 1.20 1.24 -0.54 0.00 2.04 -1.23 -0.27 117.51 119.95 1fui h ILE 270 Ca 0.28 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.27 1fui h ILE 270 Cb 0.16 0.97 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 1fui h ILE 270 CO -0.03 0.31 0.36 -0.09 0.00 0.00 0.00 178.15 178.69 1fui h ARG 271 N 0.58 0.72 -0.49 2.37 2.43 -0.96 -1.53 114.38 117.50 1fui h ARG 271 Ca 0.13 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.23 1fui h ARG 271 Cb 0.37 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.74 1fui h ARG 271 CO 0.01 0.48 0.21 -0.44 -1.51 0.00 0.00 179.97 178.72 1fui h ASP 272 N 0.74 0.62 0.11 -3.80 3.32 -0.65 -1.74 116.42 115.01 1fui h ASP 272 Ca 0.20 -0.06 -0.15 0.00 0.02 0.00 0.00 57.03 57.04 1fui h ASP 272 Cb -0.08 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 1fui h ASP 272 CO -0.04 0.55 -0.53 0.24 -1.72 0.00 0.00 179.24 177.75 1fui h MET 273 N 0.69 0.46 0.20 3.56 2.86 -0.30 0.23 114.93 122.63 1fui h MET 273 Ca 0.17 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 1fui h MET 273 Cb 0.12 0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.80 1fui h MET 273 CO -0.02 0.87 -0.10 0.52 1.06 0.00 0.00 176.91 179.25 1fui h MET 274 N 0.36 -0.26 -0.01 1.72 2.86 -0.66 0.89 114.93 119.83 1fui h MET 274 Ca 0.01 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1fui h MET 274 Cb 1.04 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.76 1fui h MET 274 CO 0.09 0.13 -0.06 0.00 1.06 0.00 0.00 176.91 178.13 1fui n GLN 275 N -5.00 0.93 0.00 1.72 10.64 -0.72 -1.10 117.38 123.85 1fui n GLN 275 Ca -0.09 -0.87 0.00 0.00 -1.83 0.00 0.00 57.00 54.21 1fui n GLN 275 Cb 0.26 -1.13 0.00 0.00 -0.86 0.00 0.00 30.24 28.51 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 0.62 -1.35 3.19 2.61 0.00 0.83 -4.76 105.19 106.33 1fui n GLY 276 Ca 0.05 -1.59 0.04 0.00 0.00 0.00 0.00 46.02 44.51 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 -3.98 -1.31 0.57 1.61 3.84 0.59 -4.68 114.94 111.58 1fui s ASN 277 Ca 0.00 0.89 0.26 0.00 0.21 0.00 0.00 52.86 54.22 1fui s ASN 277 Cb 0.00 2.13 1.65 0.00 -0.55 0.00 0.00 41.25 44.47 1fui s ASN 277 CO 0.00 -0.25 2.21 0.77 -2.79 0.00 0.00 177.10 177.04 1fui h SER 278 N 8.00 0.00 0.04 -4.21 4.64 -1.96 -1.95 113.55 118.11 1fui h SER 278 Ca -0.22 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1fui h SER 278 Cb 1.16 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1fui h SER 278 CO 0.23 0.00 -0.02 0.11 -0.87 0.00 0.00 176.83 176.28 1fui h LYS 279 N 0.00 0.00 0.00 4.77 1.79 -1.96 -0.40 116.57 120.77 1fui h LYS 279 Ca 0.01 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.40 1fui h LYS 279 Cb 0.06 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 1fui h LYS 279 CO -0.00 0.02 -0.39 -0.07 -1.08 0.00 0.00 179.45 177.93 1fui h LEU 280 N 0.00 0.00 -0.89 2.94 3.38 -1.65 -2.54 115.31 116.54 1fui h LEU 280 Ca -0.00 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 1fui h LEU 280 Cb 0.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 1fui h LEU 280 CO 0.00 0.39 -0.30 0.00 0.09 0.00 0.00 178.44 178.62 1fui h ALA 281 N 1.61 1.06 -0.27 1.53 0.00 -1.18 0.22 119.26 122.23 1fui h ALA 281 Ca -0.00 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 1fui h ALA 281 Cb 0.74 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1fui h ALA 281 CO 0.05 0.58 0.02 -0.44 0.00 0.00 0.00 179.25 179.46 1fui h ASP 282 N 0.39 0.37 -0.47 0.00 3.32 -1.42 -1.12 116.42 117.49 1fui h ASP 282 Ca 0.05 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1fui h ASP 282 Cb 0.73 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1fui h ASP 282 CO 0.06 0.41 0.00 2.30 -1.72 0.00 0.00 179.24 180.29 1fui n ILE 283 N -4.34 1.56 -0.76 0.35 -5.35 -1.13 -4.92 119.36 104.77 1fui n ILE 283 Ca 0.01 -0.92 0.00 0.00 -0.27 0.00 0.00 62.75 61.57 1fui n ILE 283 Cb 0.20 -0.07 0.00 0.00 -1.74 0.00 0.00 39.64 38.03 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 0.81 0.64 2.85 3.28 0.00 -0.42 -4.99 105.19 107.36 1fui n GLY 284 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.69 4.79 -0.12 1.61 3.00 0.77 -4.86 116.66 119.16 1fui n ARG 285 Ca 0.00 -4.61 -0.12 0.00 -0.01 0.00 0.00 57.85 53.11 1fui n ARG 285 Cb 0.00 -2.49 -0.03 0.00 0.00 0.00 0.00 32.46 29.95 1fui n ARG 285 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.63 177.24 1fui h VAL 286 N 2.96 1.29 -0.44 1.55 -1.51 -1.82 -1.94 116.25 116.33 1fui h VAL 286 Ca 0.32 -1.33 0.00 0.00 -1.23 0.00 0.00 66.70 64.47 1fui h VAL 286 Cb 0.50 1.38 -0.02 0.00 -2.13 0.00 0.00 31.29 31.02 1fui h VAL 286 CO 1.26 0.44 0.29 -0.08 -1.23 0.00 0.00 177.57 178.25 1fui h GLU 287 N 0.55 0.59 -0.15 5.19 4.81 -1.95 -2.81 114.58 120.81 1fui h GLU 287 Ca 0.08 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.21 1fui h GLU 287 Cb 0.75 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1fui h GLU 287 CO 0.06 0.40 -0.18 0.93 -0.73 0.00 0.00 179.01 179.48 1fui h GLU 288 N 0.60 0.25 0.00 1.92 3.07 -1.95 -2.98 114.58 115.49 1fui h GLU 288 Ca 0.16 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.94 1fui h GLU 288 Cb -0.06 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 27.82 1fui h GLU 288 CO -0.03 0.43 -0.06 0.66 -1.40 0.00 0.00 179.01 178.60 1fui h SER 289 N 0.23 0.00 -0.60 1.42 4.64 -1.07 -3.16 113.55 115.01 1fui h SER 289 Ca 0.04 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.34 1fui h SER 289 Cb 0.46 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.52 1fui h SER 289 CO 0.03 0.06 0.30 -0.07 -0.87 0.00 0.00 176.83 176.28 1fui h LEU 290 N 0.00 0.79 0.00 5.97 3.38 -1.58 0.17 115.31 124.03 1fui h LEU 290 Ca -0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1fui h LEU 290 Cb 0.11 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1fui h LEU 290 CO 0.01 0.66 0.00 0.61 0.09 0.00 0.00 178.44 179.81 1fui n GLY 291 N -1.16 -2.23 0.08 0.83 0.00 -1.20 -4.16 105.19 97.36 1fui n GLY 291 Ca 0.06 -1.54 0.01 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.34 0.06 -3.57 1.61 4.01 0.31 -4.87 117.16 114.37 1fui n TYR 292 Ca 0.00 -0.50 -0.25 0.00 -0.16 0.00 0.00 57.90 56.98 1fui n TYR 292 Cb 0.00 -0.05 0.06 0.00 -0.31 0.00 0.00 39.34 39.04 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 -0.38 -5.95 -4.75 7.72 5.15 -0.99 -4.62 115.26 111.44 1fui n ASN 293 Ca 0.02 -0.55 -0.38 0.00 -0.60 0.00 0.00 54.58 53.06 1fui n ASN 293 Cb 0.28 -4.72 -0.06 0.00 -0.53 0.00 0.00 39.78 34.75 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 -3.28 3.50 -1.71 5.20 0.00 -0.26 -1.46 121.76 123.74 1fui s ALA 294 Ca 0.56 -0.08 0.19 0.00 0.00 0.00 0.00 51.96 52.62 1fui s ALA 294 Cb -0.26 -2.67 -0.01 0.00 0.00 0.00 0.00 23.12 20.18 1fui s ALA 294 CO 0.69 0.12 0.96 1.51 0.00 0.00 0.00 175.76 179.04 1fui n ILE 295 N 3.06 0.00 -3.53 0.00 3.06 -0.54 -4.58 119.36 116.82 1fui n ILE 295 Ca -0.07 -0.30 -0.15 0.00 -2.50 0.00 0.00 62.75 59.72 1fui n ILE 295 Cb 0.51 1.22 -0.05 0.00 0.54 0.00 0.00 39.64 41.86 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 -2.16 -1.81 0.23 1.51 0.00 -1.24 -4.52 121.76 113.77 1fui s ALA 296 Ca 0.15 1.34 -0.07 0.00 0.00 0.00 0.00 51.96 53.39 1fui s ALA 296 Cb 0.15 -0.14 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 1fui s ALA 296 CO 0.48 -0.38 0.31 0.00 0.00 0.00 0.00 175.76 176.17 1fui s ALA 297 N -1.34 0.49 -0.01 0.00 0.00 0.20 -1.05 121.76 120.05 1fui s ALA 297 Ca -0.08 -1.31 -0.01 0.00 0.00 0.00 0.00 51.96 50.57 1fui s ALA 297 Cb -0.00 1.23 0.00 0.00 0.00 0.00 0.00 23.12 24.35 1fui s ALA 297 CO 0.06 -0.73 0.03 0.20 0.00 0.00 0.00 175.76 175.33 1fui s GLY 298 N -3.10 -0.01 -0.28 0.00 0.00 -0.31 -0.13 107.32 103.50 1fui s GLY 298 Ca 0.31 0.05 0.01 0.00 0.00 0.00 0.00 44.72 45.09 1fui s GLY 298 CO 0.11 0.03 -0.06 -0.12 0.00 0.00 0.00 173.10 173.05 1fui s PHE 299 N -0.13 3.28 0.15 1.90 5.36 -0.69 -1.15 117.98 126.70 1fui s PHE 299 Ca -0.02 -2.17 -0.25 0.00 -0.96 0.00 0.00 56.93 53.53 1fui s PHE 299 Cb -0.01 -2.02 0.01 0.00 -0.34 0.00 0.00 43.02 40.66 1fui s PHE 299 CO 0.00 -0.85 1.59 0.37 -1.46 0.00 0.00 175.22 174.87 1fui h GLN 300 N 7.86 -0.32 0.00 10.12 4.15 -1.30 -2.44 115.11 133.18 1fui h GLN 300 Ca -0.20 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.25 1fui h GLN 300 Cb 1.05 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.81 1fui h GLN 300 CO 0.49 -0.21 0.00 0.41 -1.93 0.00 0.00 178.83 177.59 1fui n GLY 301 N -1.42 1.13 3.78 2.39 0.00 -1.26 -3.99 105.19 105.82 1fui n GLY 301 Ca -0.01 0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.97 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 3.99 -0.13 1.61 -0.21 -1.26 -1.72 119.66 121.93 1fui s GLN 302 Ca 0.00 1.59 0.07 0.00 0.02 0.00 0.00 55.36 57.04 1fui s GLN 302 Cb 0.00 -2.45 -0.23 0.00 1.00 0.00 0.00 33.01 31.33 1fui s GLN 302 CO 0.00 -0.31 0.31 0.54 -2.12 0.00 0.00 175.29 173.71 1fui n ARG 303 N -0.30 0.68 -0.28 2.91 5.12 -1.26 -4.12 116.66 119.41 1fui n ARG 303 Ca 0.06 0.19 0.13 0.00 -1.93 0.00 0.00 57.85 56.31 1fui n ARG 303 Cb 0.49 -1.67 0.39 0.00 -1.16 0.00 0.00 32.46 30.51 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 0.02 0.82 0.00 -1.55 3.86 -1.97 -0.89 115.15 115.43 1fui h HIS 304 Ca -0.43 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 58.76 1fui h HIS 304 Cb 2.06 -0.26 -0.01 0.00 1.06 0.00 0.00 27.41 30.26 1fui h HIS 304 CO 0.02 0.27 -0.33 2.35 0.86 0.00 0.00 177.93 181.10 1fui h TRP 305 N 0.66 0.00 -0.00 2.45 2.91 -1.67 -3.37 115.95 116.94 1fui h TRP 305 Ca 0.48 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.50 1fui h TRP 305 Cb 0.82 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 29.47 1fui h TRP 305 CO -0.00 0.73 0.00 1.79 -1.03 0.00 0.00 178.44 179.93 1fui h THR 306 N -1.00 0.06 0.00 2.65 1.35 -1.43 0.11 112.91 114.64 1fui h THR 306 Ca -0.07 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 1fui h THR 306 Cb 0.75 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 1fui h THR 306 CO -0.04 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.70 1fui n ASP 307 N -3.16 0.00 0.00 5.36 8.00 -0.35 -1.74 116.55 124.66 1fui n ASP 307 Ca -0.03 -0.55 0.00 0.00 0.71 0.00 0.00 54.79 54.92 1fui n ASP 307 Cb 0.07 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1fui n ASP 307 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fui n GLN 308 N -1.07 1.05 -4.48 -1.24 10.64 -0.58 -4.56 117.38 117.12 1fui n GLN 308 Ca 0.16 0.00 -0.24 0.00 -1.83 0.00 0.00 57.00 55.09 1fui n GLN 308 Cb 0.11 -0.31 -0.10 0.00 -0.86 0.00 0.00 30.24 29.08 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 -0.71 2.23 0.33 2.61 2.02 0.26 -4.46 117.35 119.64 1fui s TYR 309 Ca 0.00 -0.47 -0.28 0.00 -0.37 0.00 0.00 57.07 55.95 1fui s TYR 309 Cb 0.00 -1.14 -0.13 0.00 -0.40 0.00 0.00 41.96 40.29 1fui s TYR 309 CO 0.00 0.57 1.16 -2.30 -1.57 0.00 0.00 175.55 173.42 1fui n PRO 310 N -0.66 1.77 -1.38 -1.71 -0.02 -1.17 -3.84 135.00 127.99 1fui n PRO 310 Ca -0.05 0.62 -0.29 0.00 -2.02 0.00 0.00 63.50 61.76 1fui n PRO 310 Cb 0.62 -2.13 0.19 0.00 -0.02 0.00 0.00 33.50 32.16 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 -0.45 2.27 -0.05 2.55 2.20 0.09 -4.81 114.94 116.75 1fui s ASN 311 Ca 0.57 0.73 0.09 0.00 -0.94 0.00 0.00 52.86 53.32 1fui s ASN 311 Cb -0.61 -1.09 0.35 0.00 -2.00 0.00 0.00 41.25 37.90 1fui s ASN 311 CO 0.61 -3.30 1.20 0.61 -2.94 0.00 0.00 177.10 173.28 1fui n GLY 312 N -1.84 1.34 0.27 0.45 0.00 -1.26 -4.53 105.19 99.61 1fui n GLY 312 Ca 0.10 -0.42 -0.11 0.00 0.00 0.00 0.00 46.02 45.60 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 2.05 -0.71 -0.18 1.61 3.32 -1.89 -0.68 116.42 119.95 1fui h ASP 313 Ca 0.00 0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 1fui h ASP 313 Cb 0.80 0.29 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 1fui h ASP 313 CO 0.10 -0.30 0.06 0.74 -1.72 0.00 0.00 179.24 178.12 1fui h THR 314 N -0.36 1.17 -0.07 0.35 2.02 -1.77 -0.53 112.91 113.73 1fui h THR 314 Ca 0.07 -0.53 0.02 0.00 0.77 0.00 0.00 66.41 66.74 1fui h THR 314 Cb 0.45 1.20 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1fui h THR 314 CO -0.23 0.17 -0.07 0.00 0.37 0.00 0.00 175.52 175.76 1fui h ALA 315 N 0.89 -0.01 -0.63 6.16 0.00 -1.68 0.11 119.26 124.10 1fui h ALA 315 Ca 0.06 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1fui h ALA 315 Cb 0.20 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1fui h ALA 315 CO -0.00 -0.54 0.31 0.93 0.00 0.00 0.00 179.25 179.94 1fui h GLU 316 N -0.09 0.90 -0.24 0.00 5.08 -1.09 0.17 114.58 119.30 1fui h GLU 316 Ca 0.05 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1fui h GLU 316 Cb 0.17 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1fui h GLU 316 CO -0.13 0.71 0.10 0.00 -1.00 0.00 0.00 179.01 178.70 1fui h ALA 317 N 1.14 0.31 -0.10 3.43 0.00 -0.74 -1.95 119.26 121.34 1fui h ALA 317 Ca 0.22 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.99 1fui h ALA 317 Cb 0.11 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1fui h ALA 317 CO -0.03 -0.10 -0.04 0.82 0.00 0.00 0.00 179.25 179.90 1fui h ILE 318 N 0.25 1.30 -0.73 0.00 1.08 -0.72 -2.85 117.51 115.84 1fui h ILE 318 Ca 0.08 -1.00 -0.01 0.00 -0.39 0.00 0.00 64.86 63.54 1fui h ILE 318 Cb 0.16 1.76 -0.04 0.00 -3.07 0.00 0.00 36.82 35.63 1fui h ILE 318 CO -0.01 0.28 0.42 -0.07 -0.69 0.00 0.00 178.15 178.09 1fui h LEU 319 N -0.13 0.88 -0.05 1.44 3.38 -0.68 -2.00 115.31 118.15 1fui h LEU 319 Ca 0.03 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1fui h LEU 319 Cb 0.46 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1fui h LEU 319 CO 0.01 0.69 0.00 0.59 0.09 0.00 0.00 178.44 179.83 1fui n ASN 320 N -4.38 0.42 -4.86 -0.43 3.02 -0.74 -0.63 115.26 107.66 1fui n ASN 320 Ca 0.07 0.55 -0.29 0.00 -0.03 0.00 0.00 54.58 54.88 1fui n ASN 320 Cb 0.08 -0.66 0.10 0.00 -0.61 0.00 0.00 39.78 38.70 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 -3.79 4.25 -0.14 6.41 0.01 -0.75 -4.35 113.70 115.35 1fui s SER 321 Ca 0.11 0.87 0.11 0.00 1.31 0.00 0.00 55.95 58.35 1fui s SER 321 Cb 0.15 -1.42 0.55 0.00 0.21 0.00 0.00 66.02 65.51 1fui s SER 321 CO 0.53 -2.08 1.37 -1.20 0.41 0.00 0.00 173.24 172.28 1fui n SER 322 N -3.44 4.05 -3.58 2.44 7.64 -1.26 -3.96 113.62 115.51 1fui n SER 322 Ca 0.07 -2.54 -0.07 0.00 1.01 0.00 0.00 58.87 57.34 1fui n SER 322 Cb 0.60 -0.58 -0.02 0.00 -1.01 0.00 0.00 64.21 63.20 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 -2.08 -0.28 0.00 1.43 -0.12 -1.26 -0.87 117.98 114.80 1fui s PHE 323 Ca 0.37 0.09 0.00 0.00 -0.05 0.00 0.00 56.93 57.34 1fui s PHE 323 Cb 0.27 0.57 0.00 0.00 -0.63 0.00 0.00 43.02 43.23 1fui s PHE 323 CO 0.13 -0.63 0.00 -0.40 -0.05 0.00 0.00 175.22 174.27 1fui n ASP 324 N -0.32 0.00 0.28 1.98 5.68 -0.99 -4.89 116.55 118.29 1fui n ASP 324 Ca -0.08 -0.56 0.16 0.00 -0.50 0.00 0.00 54.79 53.81 1fui n ASP 324 Cb 0.61 0.00 0.78 0.00 -1.14 0.00 0.00 41.12 41.38 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 0.56 0.00 -0.42 2.11 0.09 -1.94 0.71 115.95 117.07 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 -3.05 2.55 0.00 0.11 3.02 -1.26 -5.01 115.26 111.62 1fui n ASN 326 Ca 0.00 -1.94 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1fui n ASN 326 Cb 0.45 -0.28 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 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 1.28 -1.91 3.78 7.41 0.00 0.24 -4.96 105.19 111.04 1fui n GLY 327 Ca 0.17 -2.00 -0.37 0.00 0.00 0.00 0.00 46.02 43.82 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 -0.08 4.10 0.33 1.61 -7.23 -1.26 -2.34 120.40 115.52 1fui s VAL 328 Ca 0.00 1.70 -0.12 0.00 -1.81 0.00 0.00 61.98 61.75 1fui s VAL 328 Cb 0.00 -3.92 0.02 0.00 0.56 0.00 0.00 36.38 33.04 1fui s VAL 328 CO 0.00 0.10 0.61 0.00 -0.31 0.00 0.00 175.10 175.51 1fui s ARG 329 N -2.17 1.93 0.17 4.82 1.70 -0.05 -4.95 118.95 120.40 1fui s ARG 329 Ca 0.52 -1.45 -0.31 0.00 -0.47 0.00 0.00 55.73 54.03 1fui s ARG 329 Cb -0.19 0.53 -0.09 0.00 -0.57 0.00 0.00 34.95 34.64 1fui s ARG 329 CO 0.25 -0.85 1.36 -2.00 -1.08 0.00 0.00 175.30 172.97 1fui s GLU 330 N -3.11 4.34 0.63 3.89 2.12 -1.26 -4.38 118.70 120.93 1fui s GLU 330 Ca 0.21 2.09 -0.16 0.00 0.36 0.00 0.00 54.97 57.47 1fui s GLU 330 Cb -0.03 -3.21 -0.01 0.00 0.26 0.00 0.00 34.13 31.14 1fui s GLU 330 CO 0.13 -0.35 1.13 -1.25 -0.54 0.00 0.00 175.26 174.38 1fui s PRO 331 N 0.40 2.89 0.52 4.30 0.04 -1.25 -4.91 135.00 136.99 1fui s PRO 331 Ca 0.60 1.52 0.01 0.00 0.04 0.00 0.00 61.00 63.18 1fui s PRO 331 Cb -0.37 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.24 1fui s PRO 331 CO 0.35 -1.20 0.74 -0.06 0.04 0.00 0.00 177.00 176.87 1fui s PHE 332 N -2.09 2.94 -0.37 0.56 0.08 0.19 -5.01 117.98 114.28 1fui s PHE 332 Ca 0.70 0.02 0.01 0.00 0.12 0.00 0.00 56.93 57.79 1fui s PHE 332 Cb -0.23 -2.64 0.11 0.00 -0.57 0.00 0.00 43.02 39.69 1fui s PHE 332 CO 0.37 -0.74 0.12 0.08 -0.10 0.00 0.00 175.22 174.95 1fui s VAL 333 N -2.70 2.69 -0.23 -0.44 1.01 -1.26 -4.25 120.40 115.23 1fui s VAL 333 Ca 0.55 -2.26 0.02 0.00 0.00 0.00 0.00 61.98 60.29 1fui s VAL 333 Cb -0.10 -2.92 0.05 0.00 0.00 0.00 0.00 36.38 33.41 1fui s VAL 333 CO 0.38 -0.64 -0.11 -0.69 0.00 0.00 0.00 175.10 174.04 1fui s VAL 334 N 0.96 1.89 -0.07 2.92 1.01 -1.26 -0.62 120.40 125.23 1fui s VAL 334 Ca 0.10 -1.28 -0.27 0.00 0.00 0.00 0.00 61.98 60.53 1fui s VAL 334 Cb -0.21 -1.97 -0.03 0.00 0.00 0.00 0.00 36.38 34.18 1fui s VAL 334 CO -0.06 0.10 0.89 0.00 0.00 0.00 0.00 175.10 176.03 1fui s ALA 335 N 1.27 3.31 0.56 5.51 0.00 0.82 -4.94 121.76 128.29 1fui s ALA 335 Ca -0.04 0.32 -0.17 0.00 0.00 0.00 0.00 51.96 52.07 1fui s ALA 335 Cb -0.18 -3.24 -0.05 0.00 0.00 0.00 0.00 23.12 19.65 1fui s ALA 335 CO -0.07 -0.34 1.06 -0.08 0.00 0.00 0.00 175.76 176.32 1fui s THR 336 N 1.35 3.76 -1.99 0.00 -1.32 -1.26 -1.71 115.64 114.47 1fui s THR 336 Ca 0.45 0.92 0.00 0.00 -1.21 0.00 0.00 61.69 61.85 1fui s THR 336 Cb -0.19 -3.39 0.00 0.00 -1.51 0.00 0.00 72.50 67.41 1fui s THR 336 CO 0.21 -0.41 0.00 -0.62 -2.21 0.00 0.00 174.62 171.59 1fui n GLU 337 N -1.70 -1.49 -3.33 7.08 1.02 -0.95 -2.23 120.64 119.03 1fui n GLU 337 Ca 0.09 1.11 -0.23 0.00 -0.02 0.00 0.00 57.16 58.11 1fui n GLU 337 Cb 0.53 -5.53 -0.00 0.00 -0.02 0.00 0.00 31.44 26.42 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 -1.36 -3.80 -4.56 1.62 5.15 -1.00 -4.30 115.26 107.00 1fui n ASN 338 Ca -0.20 -0.37 -0.40 0.00 -0.60 0.00 0.00 54.58 53.00 1fui n ASN 338 Cb 0.65 -3.14 -0.03 0.00 -0.53 0.00 0.00 39.78 36.73 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 -2.71 6.45 0.42 1.20 -1.08 -0.95 -3.78 116.67 116.22 1fui s ASP 339 Ca 0.39 -1.62 0.12 0.00 -0.52 0.00 0.00 52.55 50.91 1fui s ASP 339 Cb -0.20 -2.57 0.96 0.00 -1.46 0.00 0.00 42.92 39.64 1fui s ASP 339 CO 0.48 -1.56 1.97 0.77 0.52 0.00 0.00 175.17 177.35 1fui h SER 340 N 9.40 0.44 0.21 -0.34 4.64 -1.74 -0.99 113.55 125.17 1fui h SER 340 Ca 0.25 0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.47 1fui h SER 340 Cb 0.98 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.97 1fui h SER 340 CO 1.42 0.27 -0.39 -0.07 -0.87 0.00 0.00 176.83 177.18 1fui h LEU 341 N 0.49 0.25 -0.24 5.97 3.38 -1.88 0.86 115.31 124.15 1fui h LEU 341 Ca 0.29 -0.10 -0.20 0.00 0.09 0.00 0.00 57.88 57.95 1fui h LEU 341 Cb 0.48 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1fui h LEU 341 CO -0.09 0.63 -0.91 -1.13 0.09 0.00 0.00 178.44 177.03 1fui h ASN 342 N 0.21 0.22 -0.76 -0.43 -1.24 -1.58 -2.77 115.58 109.23 1fui h ASN 342 Ca 0.02 -0.19 -0.04 0.00 0.71 0.00 0.00 56.30 56.80 1fui h ASN 342 Cb 0.79 -0.07 -0.03 0.00 0.73 0.00 0.00 38.32 39.73 1fui h ASN 342 CO 0.06 1.02 0.32 1.23 -1.29 0.00 0.00 177.43 178.76 1fui h GLY 343 N 1.97 1.21 1.01 1.57 0.00 -0.52 -0.08 103.07 108.25 1fui h GLY 343 Ca -0.04 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.59 1fui h GLY 343 CO 0.14 0.61 0.25 -2.08 0.00 0.00 0.00 176.54 175.46 1fui h VAL 344 N 1.10 1.24 -0.66 4.60 2.07 -0.80 0.96 116.25 124.76 1fui h VAL 344 Ca 0.26 -0.78 -0.07 0.00 0.82 0.00 0.00 66.70 66.93 1fui h VAL 344 Cb 0.20 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.46 1fui h VAL 344 CO -0.02 0.30 0.13 0.00 0.02 0.00 0.00 177.57 178.00 1fui h ALA 345 N 1.10 0.98 -0.52 1.67 0.00 -1.16 -1.17 119.26 120.18 1fui h ALA 345 Ca 0.22 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1fui h ALA 345 Cb 0.23 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1fui h ALA 345 CO -0.01 0.65 -0.05 0.52 0.00 0.00 0.00 179.25 180.35 1fui h MET 346 N 1.00 0.91 -0.24 0.00 2.86 -0.63 -1.27 114.93 117.55 1fui h MET 346 Ca 0.20 -0.29 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1fui h MET 346 Cb 0.40 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 1fui h MET 346 CO 0.01 0.93 0.11 1.25 1.06 0.00 0.00 176.91 180.27 1fui h LEU 347 N 0.83 0.32 -0.01 1.22 6.46 -0.32 -0.20 115.31 123.60 1fui h LEU 347 Ca 0.15 -0.13 -0.00 0.00 -0.12 0.00 0.00 57.88 57.78 1fui h LEU 347 Cb 0.56 -0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 40.41 1fui h LEU 347 CO 0.03 0.36 0.00 0.24 -0.62 0.00 0.00 178.44 178.45 1fui h MET 348 N 0.26 0.01 -0.85 1.25 2.86 -1.08 0.92 114.93 118.30 1fui h MET 348 Ca 0.08 -0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.75 1fui h MET 348 Cb 0.12 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.73 1fui h MET 348 CO -0.01 0.06 0.56 0.78 1.06 0.00 0.00 176.91 179.35 1fui h GLY 349 N -0.04 1.23 1.04 8.32 0.00 -1.11 -0.83 103.07 111.68 1fui h GLY 349 Ca 0.00 -0.43 -0.15 0.00 0.00 0.00 0.00 47.33 46.75 1fui h GLY 349 CO -0.00 0.38 -0.42 0.84 0.00 0.00 0.00 176.54 177.35 1fui h HIS 350 N 1.10 0.96 -0.17 5.60 6.17 -0.85 -1.65 115.15 126.31 1fui h HIS 350 Ca 0.33 -0.32 -0.07 0.00 0.71 0.00 0.00 60.37 61.02 1fui h HIS 350 Cb -0.04 -0.19 -0.01 0.00 2.52 0.00 0.00 27.41 29.69 1fui h HIS 350 CO -0.02 1.11 -0.19 1.96 0.71 0.00 0.00 177.93 181.51 1fui h GLN 351 N 0.53 0.29 0.03 5.26 1.08 -0.50 0.40 115.11 122.21 1fui h GLN 351 Ca 0.03 -0.08 -0.22 0.00 -1.45 0.00 0.00 58.65 56.92 1fui h GLN 351 Cb 1.01 -0.03 -0.02 0.00 -0.05 0.00 0.00 27.48 28.39 1fui h GLN 351 CO 0.10 0.48 -1.04 -0.07 -0.95 0.00 0.00 178.83 177.34 1fui h LEU 352 N 0.27 0.13 0.00 1.46 3.38 -1.07 -3.40 115.31 116.08 1fui h LEU 352 Ca 0.05 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1fui h LEU 352 Cb 0.49 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1fui h LEU 352 CO 0.03 1.08 -1.04 0.35 0.09 0.00 0.00 178.44 178.95 1fui n THR 353 N -3.44 0.00 -1.04 0.22 -2.24 -0.63 -5.00 114.28 102.15 1fui n THR 353 Ca -0.03 -0.13 -0.01 0.00 -2.27 0.00 0.00 64.05 61.61 1fui n THR 353 Cb 0.94 0.49 -0.01 0.00 -2.10 0.00 0.00 70.33 69.65 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 2.13 0.47 3.86 3.38 0.00 0.14 -4.64 105.19 110.54 1fui n GLY 354 Ca -0.01 -0.18 -0.21 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.83 3.18 0.46 2.61 -4.23 -1.26 -3.68 115.64 110.89 1fui s THR 355 Ca 0.00 -1.37 -0.23 0.00 -1.18 0.00 0.00 61.69 58.91 1fui s THR 355 Cb 0.00 -3.10 -0.07 0.00 1.34 0.00 0.00 72.50 70.66 1fui s THR 355 CO 0.00 -0.11 1.18 0.00 -0.54 0.00 0.00 174.62 175.15 1fui s ALA 356 N -2.37 2.98 -0.04 3.99 0.00 -1.26 -4.50 121.76 120.55 1fui s ALA 356 Ca 0.44 0.96 0.02 0.00 0.00 0.00 0.00 51.96 53.37 1fui s ALA 356 Cb -0.05 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 1fui s ALA 356 CO 0.27 -0.68 -0.06 -0.65 0.00 0.00 0.00 175.76 174.63 1fui s GLN 357 N -2.68 2.69 -0.32 0.00 -1.52 -1.26 -4.77 119.66 111.80 1fui s GLN 357 Ca 0.63 -0.61 -0.11 0.00 -1.95 0.00 0.00 55.36 53.32 1fui s GLN 357 Cb -0.29 -2.57 -0.02 0.00 -0.22 0.00 0.00 33.01 29.91 1fui s GLN 357 CO 0.36 0.64 0.20 0.08 -0.25 0.00 0.00 175.29 176.32 1fui s VAL 358 N -0.88 5.09 -0.02 1.09 1.01 -0.96 -4.36 120.40 121.37 1fui s VAL 358 Ca 0.14 -0.18 -0.26 0.00 0.00 0.00 0.00 61.98 61.69 1fui s VAL 358 Cb -0.11 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.67 1fui s VAL 358 CO 0.04 0.08 0.79 0.12 0.00 0.00 0.00 175.10 176.13 1fui s PHE 359 N 1.70 3.64 0.00 5.22 2.19 -1.26 -1.54 117.98 127.93 1fui s PHE 359 Ca 0.06 1.43 -0.06 0.00 0.33 0.00 0.00 56.93 58.68 1fui s PHE 359 Cb -0.17 -2.90 -0.00 0.00 -1.31 0.00 0.00 43.02 38.64 1fui s PHE 359 CO 0.09 0.10 0.12 0.00 1.83 0.00 0.00 175.22 177.37 1fui s ALA 360 N 0.66 -0.28 -0.12 11.12 0.00 -0.76 -4.24 121.76 128.14 1fui s ALA 360 Ca 0.42 -0.17 -0.15 0.00 0.00 0.00 0.00 51.96 52.05 1fui s ALA 360 Cb -0.19 0.11 -0.05 0.00 0.00 0.00 0.00 23.12 22.99 1fui s ALA 360 CO 0.22 -0.20 0.37 -0.51 0.00 0.00 0.00 175.76 175.64 1fui s ASP 361 N -1.36 6.57 -1.11 0.00 1.01 -1.07 -1.10 116.67 119.61 1fui s ASP 361 Ca -0.15 0.68 -0.18 0.00 0.71 0.00 0.00 52.55 53.61 1fui s ASP 361 Cb -0.08 -2.23 0.11 0.00 1.01 0.00 0.00 42.92 41.74 1fui s ASP 361 CO 0.01 0.10 1.43 -0.69 0.21 0.00 0.00 175.17 176.23 1fui s VAL 362 N 0.30 4.49 -0.08 -1.27 1.01 -0.12 -1.90 120.40 122.83 1fui s VAL 362 Ca 0.21 -1.76 -0.26 0.00 0.00 0.00 0.00 61.98 60.17 1fui s VAL 362 Cb -0.14 -4.98 -0.25 0.00 0.00 0.00 0.00 36.38 31.01 1fui s VAL 362 CO 0.07 -1.76 0.94 -0.09 0.00 0.00 0.00 175.10 174.26 1fui h ARG 363 N 8.30 0.12 -3.28 2.72 2.43 -1.49 -3.48 114.38 119.71 1fui h ARG 363 Ca 0.28 -0.16 -0.16 0.00 -0.81 0.00 0.00 59.98 59.13 1fui h ARG 363 Cb 0.94 0.05 -0.24 0.00 -0.42 0.00 0.00 29.97 30.30 1fui h ARG 363 CO 1.30 0.97 -0.46 0.99 -1.51 0.00 0.00 179.97 181.26 1fui s THR 364 N -2.79 0.03 -0.26 0.20 2.01 -1.18 -4.98 115.64 108.67 1fui s THR 364 Ca -0.17 -0.23 -0.09 0.00 0.31 0.00 0.00 61.69 61.51 1fui s THR 364 Cb -0.00 -0.37 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 1fui s THR 364 CO 0.73 -0.13 0.13 -0.47 -0.69 0.00 0.00 174.62 174.19 1fui s TYR 365 N -0.43 3.17 -0.37 4.92 5.04 -1.26 -0.18 117.35 128.24 1fui s TYR 365 Ca -0.05 -0.11 -0.09 0.00 -2.44 0.00 0.00 57.07 54.38 1fui s TYR 365 Cb -0.04 -2.29 0.04 0.00 0.35 0.00 0.00 41.96 40.03 1fui s TYR 365 CO 0.01 -0.21 0.18 -1.58 -1.34 0.00 0.00 175.55 172.62 1fui s TRP 366 N 1.54 3.27 0.57 4.97 0.52 0.23 -4.99 118.94 125.05 1fui s TRP 366 Ca 0.06 -1.25 -0.15 0.00 0.02 0.00 0.00 56.10 54.79 1fui s TRP 366 Cb -0.15 -2.49 -0.05 0.00 -1.15 0.00 0.00 33.47 29.63 1fui s TRP 366 CO 0.07 -0.72 1.02 -1.54 0.02 0.00 0.00 176.95 175.80 1fui s SER 367 N 1.61 6.22 0.48 2.95 1.04 -1.26 -1.26 113.70 123.47 1fui s SER 367 Ca 0.01 1.60 0.14 0.00 0.48 0.00 0.00 55.95 58.18 1fui s SER 367 Cb -0.20 -2.50 1.14 0.00 0.10 0.00 0.00 66.02 64.55 1fui s SER 367 CO 0.04 -0.87 2.10 1.55 0.98 0.00 0.00 173.24 177.04 1fui h PRO 368 N 0.38 0.19 -0.44 4.02 0.13 -1.88 -1.06 132.00 133.34 1fui h PRO 368 Ca -0.46 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 64.59 1fui h PRO 368 Cb 1.20 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.27 1fui h PRO 368 CO 0.60 0.13 0.00 0.93 -0.23 0.00 0.00 178.00 179.43 1fui h GLU 369 N 0.20 0.78 -0.66 0.86 3.07 -1.98 -2.34 114.58 114.51 1fui h GLU 369 Ca 0.09 -0.25 -0.08 0.00 -0.50 0.00 0.00 59.36 58.62 1fui h GLU 369 Cb 0.10 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 1fui h GLU 369 CO -0.02 0.84 0.10 0.00 -1.40 0.00 0.00 179.01 178.54 1fui h ALA 370 N 0.91 0.94 0.02 3.43 0.00 -1.74 -1.50 119.26 121.32 1fui h ALA 370 Ca 0.12 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1fui h ALA 370 Cb 0.49 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1fui h ALA 370 CO 0.02 0.66 -0.01 0.82 0.00 0.00 0.00 179.25 180.74 1fui h ILE 371 N 1.01 1.05 -0.26 0.00 1.08 -1.11 -2.34 117.51 116.95 1fui h ILE 371 Ca 0.20 -0.23 -0.00 0.00 -0.39 0.00 0.00 64.86 64.43 1fui h ILE 371 Cb 0.43 1.21 -0.01 0.00 -3.07 0.00 0.00 36.82 35.38 1fui h ILE 371 CO 0.01 0.06 0.14 -0.08 -0.69 0.00 0.00 178.15 177.59 1fui h GLU 372 N -0.13 0.36 -0.37 2.37 4.81 -1.35 0.22 114.58 120.50 1fui h GLU 372 Ca -0.00 -0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.26 1fui h GLU 372 Cb 0.12 -0.07 -0.07 0.00 0.63 0.00 0.00 28.75 29.36 1fui h GLU 372 CO 0.00 0.32 -0.12 -0.09 -0.73 0.00 0.00 179.01 178.40 1fui h ARG 373 N 0.31 -0.03 0.00 1.92 2.43 -1.17 0.80 114.38 118.64 1fui h ARG 373 Ca 0.09 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.21 1fui h ARG 373 Cb 0.06 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.61 1fui h ARG 373 CO -0.01 -0.02 -0.60 -0.39 -1.51 0.00 0.00 179.97 177.43 1fui h VAL 374 N -0.03 0.31 0.00 0.20 -1.51 -1.27 -3.39 116.25 110.56 1fui h VAL 374 Ca 0.18 -1.48 0.00 0.00 -1.23 0.00 0.00 66.70 64.17 1fui h VAL 374 Cb 0.31 1.99 0.00 0.00 -2.13 0.00 0.00 31.29 31.46 1fui h VAL 374 CO -0.40 0.17 -0.41 0.35 -1.23 0.00 0.00 177.57 176.06 1fui n THR 375 N -3.00 0.00 0.00 7.19 -2.24 0.05 -5.02 114.28 111.26 1fui n THR 375 Ca 0.00 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 1fui n THR 375 Cb 0.64 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.59 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 1.45 2.88 3.78 3.38 0.00 0.28 -5.00 105.19 111.96 1fui n GLY 376 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1fui n GLY 376 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1fui s HIS 377 N -0.99 3.05 -0.25 1.61 3.76 -1.26 -4.87 115.29 116.33 1fui s HIS 377 Ca 0.00 1.59 -0.10 0.00 -0.15 0.00 0.00 55.06 56.40 1fui s HIS 377 Cb 0.00 -3.20 -0.05 0.00 1.11 0.00 0.00 32.58 30.44 1fui s HIS 377 CO 0.00 -1.00 0.15 0.21 -0.85 0.00 0.00 174.74 173.26 1fui s LYS 378 N -2.76 3.96 -0.22 1.40 2.20 -1.26 -3.77 119.74 119.29 1fui s LYS 378 Ca 0.63 -0.32 -0.29 0.00 -0.36 0.00 0.00 55.97 55.62 1fui s LYS 378 Cb -0.23 -3.54 0.01 0.00 -1.51 0.00 0.00 37.83 32.56 1fui s LYS 378 CO 0.28 -0.05 1.09 -1.17 -0.36 0.00 0.00 175.35 175.13 1fui s LEU 379 N 1.36 4.10 0.47 5.43 2.96 -1.26 -5.05 118.68 126.69 1fui s LEU 379 Ca 0.07 1.41 0.04 0.00 -0.22 0.00 0.00 54.13 55.43 1fui s LEU 379 Cb -0.15 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1fui s LEU 379 CO 0.07 -0.70 0.05 1.51 -1.32 0.00 0.00 176.35 175.95 1fui s ASP 380 N 1.39 4.10 0.20 3.68 1.47 -1.26 -4.02 116.67 122.23 1fui s ASP 380 Ca 0.46 -1.48 0.00 0.00 1.18 0.00 0.00 52.55 52.71 1fui s ASP 380 Cb -0.16 0.11 0.00 0.00 -0.34 0.00 0.00 42.92 42.53 1fui s ASP 380 CO 0.08 -0.70 0.00 0.61 0.68 0.00 0.00 175.17 175.84 1fui n GLY 381 N -1.19 0.34 0.32 2.12 0.00 -1.26 -3.41 105.19 102.11 1fui n GLY 381 Ca -0.12 -0.93 0.06 0.00 0.00 0.00 0.00 46.02 45.04 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 0.45 -0.05 0.99 -0.00 -1.99 -1.58 115.31 113.13 1fui h LEU 382 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 1fui h LEU 382 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 40.56 1fui h LEU 382 CO 0.00 0.31 0.00 0.00 -0.00 0.00 0.00 178.44 178.75 1fui n ALA 383 N -2.49 2.67 -0.25 1.53 0.00 -1.22 -4.28 120.51 116.48 1fui n ALA 383 Ca 0.05 -0.20 0.23 0.00 0.00 0.00 0.00 53.44 53.52 1fui n ALA 383 Cb 0.16 -1.47 0.56 0.00 0.00 0.00 0.00 19.45 18.70 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 0.11 0.29 -0.52 0.00 4.81 -1.36 -2.26 114.58 115.65 1fui h GLU 384 Ca 0.00 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1fui h GLU 384 Cb 0.02 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 29.34 1fui h GLU 384 CO 0.00 0.20 0.00 0.72 -0.73 0.00 0.00 179.01 179.20 1fui n HIS 385 N -4.47 0.68 0.00 0.92 8.25 -1.26 -4.83 115.22 114.51 1fui n HIS 385 Ca 0.21 -0.34 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 1fui n HIS 385 Cb 0.82 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.93 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 1.57 2.93 3.17 -1.41 0.00 -0.85 -4.37 105.19 106.23 1fui n GLY 386 Ca 0.21 -2.00 -0.11 0.00 0.00 0.00 0.00 46.02 44.12 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 -2.20 0.10 -0.14 -0.61 2.07 -0.39 -4.72 121.20 115.31 1fui s ILE 387 Ca 0.00 -0.81 0.01 0.00 -1.41 0.00 0.00 60.65 58.44 1fui s ILE 387 Cb 0.00 -0.76 -0.01 0.00 0.13 0.00 0.00 42.46 41.82 1fui s ILE 387 CO 0.00 -0.45 -0.16 -0.63 -1.91 0.00 0.00 174.94 171.79 1fui s ILE 388 N -2.15 2.70 -0.37 2.00 1.01 -0.12 -0.60 121.20 123.66 1fui s ILE 388 Ca -0.08 -0.78 -0.22 0.00 0.00 0.00 0.00 60.65 59.57 1fui s ILE 388 Cb -0.03 -2.12 0.01 0.00 0.01 0.00 0.00 42.46 40.33 1fui s ILE 388 CO -0.02 0.53 0.74 -2.28 0.00 0.00 0.00 174.94 173.91 1fui s HIS 389 N 0.56 3.11 -0.30 3.97 5.65 0.75 -1.08 115.29 127.96 1fui s HIS 389 Ca -0.10 0.47 -0.07 0.00 0.25 0.00 0.00 55.06 55.60 1fui s HIS 389 Cb -0.16 -3.35 0.01 0.00 -1.18 0.00 0.00 32.58 27.89 1fui s HIS 389 CO 0.04 -0.73 0.10 -0.51 -0.65 0.00 0.00 174.74 172.99 1fui s LEU 390 N 3.01 3.91 -0.09 8.88 1.43 -0.68 -1.30 118.68 133.84 1fui s LEU 390 Ca 0.29 -0.68 -0.03 0.00 -1.03 0.00 0.00 54.13 52.68 1fui s LEU 390 Cb -0.13 -1.91 0.05 0.00 0.03 0.00 0.00 46.19 44.23 1fui s LEU 390 CO 0.17 -0.20 0.14 -0.63 0.23 0.00 0.00 176.35 176.06 1fui s ILE 391 N 1.52 -0.22 0.41 -0.59 1.01 -0.80 -1.84 121.20 120.70 1fui s ILE 391 Ca 0.03 0.29 -0.20 0.00 0.00 0.00 0.00 60.65 60.77 1fui s ILE 391 Cb -0.17 -0.32 -0.11 0.00 0.01 0.00 0.00 42.46 41.87 1fui s ILE 391 CO 0.03 0.09 0.91 0.21 0.00 0.00 0.00 174.94 176.18 1fui s ASN 392 N 2.25 6.91 0.00 3.58 2.47 -1.25 -2.59 114.94 126.30 1fui s ASN 392 Ca 0.04 1.62 -0.01 0.00 0.42 0.00 0.00 52.86 54.92 1fui s ASN 392 Cb -0.13 -2.51 -0.05 0.00 -1.45 0.00 0.00 41.25 37.11 1fui s ASN 392 CO -0.06 -0.34 1.11 -1.54 -3.72 0.00 0.00 177.10 172.55 1fui n SER 393 N -0.60 1.49 0.00 -4.21 3.41 -1.26 -4.27 113.62 108.17 1fui n SER 393 Ca 0.06 -1.65 0.00 0.00 -0.26 0.00 0.00 58.87 57.03 1fui n SER 393 Cb 0.54 -0.37 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 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 2.52 1.16 3.18 5.00 0.00 -1.26 -5.00 105.19 110.79 1fui n GLY 394 Ca 0.08 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.64 1.39 -0.27 1.61 1.04 -1.26 -1.29 113.70 114.28 1fui s SER 395 Ca 0.00 -0.90 -0.27 0.00 0.48 0.00 0.00 55.95 55.26 1fui s SER 395 Cb 0.00 0.03 0.17 0.00 0.10 0.00 0.00 66.02 66.32 1fui s SER 395 CO 0.00 -0.34 1.28 0.00 0.98 0.00 0.00 173.24 175.16 1fui s ALA 396 N -2.94 -2.11 0.11 5.32 0.00 -1.26 -4.59 121.76 116.29 1fui s ALA 396 Ca 0.09 1.76 -0.34 0.00 0.00 0.00 0.00 51.96 53.47 1fui s ALA 396 Cb 0.00 -1.48 -0.14 0.00 0.00 0.00 0.00 23.12 21.50 1fui s ALA 396 CO -0.01 -0.20 1.58 0.00 0.00 0.00 0.00 175.76 177.13 1fui n ALA 397 N 1.24 0.91 0.32 0.00 0.00 -1.26 -4.62 120.51 117.10 1fui n ALA 397 Ca -0.08 0.44 0.20 0.00 0.00 0.00 0.00 53.44 54.00 1fui n ALA 397 Cb 0.57 -2.32 1.08 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 6.14 0.00 -2.35 0.00 3.38 -1.88 0.19 115.31 120.79 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 0.88 0.00 -0.00 0.44 0.09 0.00 0.00 178.44 179.85 1fui h ASP 399 N 0.00 0.00 0.00 -0.43 5.19 -1.92 -1.97 116.42 117.29 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 0.00 0.08 1.23 -3.12 0.00 0.00 179.24 177.43 1fui h GLY 400 N 0.01 0.00 2.00 2.75 0.00 -0.96 -1.59 103.07 105.28 1fui h GLY 400 Ca -0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1fui h GLY 400 CO 0.00 0.00 -0.10 1.48 0.00 0.00 0.00 176.54 177.92 1fui h SER 401 N 0.00 0.00 -4.15 0.19 4.64 -1.55 -3.40 113.55 109.28 1fui h SER 401 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 1fui h SER 401 Cb 0.16 0.00 0.09 0.00 -0.31 0.00 0.00 62.40 62.34 1fui h SER 401 CO 0.00 0.10 -0.45 0.00 -0.87 0.00 0.00 176.83 175.60 1fui n LYS 403 N -3.48 0.01 -1.76 0.00 4.76 -1.26 -3.87 118.16 112.55 1fui n LYS 403 Ca -0.00 -0.01 -0.32 0.00 -2.87 0.00 0.00 58.31 55.12 1fui n LYS 403 Cb 0.54 -1.50 0.03 0.00 -1.84 0.00 0.00 35.03 32.27 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 -2.99 3.14 0.06 1.97 -0.21 -1.24 -4.90 119.66 115.48 1fui s GLN 404 Ca 0.12 1.01 0.05 0.00 0.02 0.00 0.00 55.36 56.56 1fui s GLN 404 Cb 0.18 -2.02 -0.03 0.00 1.00 0.00 0.00 33.01 32.15 1fui s GLN 404 CO 0.65 -0.94 -0.15 1.03 -2.12 0.00 0.00 175.29 173.77 1fui s ARG 405 N -4.74 0.90 0.22 2.91 1.81 -1.26 -1.11 118.95 117.68 1fui s ARG 405 Ca 0.59 -0.87 -0.00 0.00 -1.72 0.00 0.00 55.73 53.73 1fui s ARG 405 Cb -0.14 -0.92 0.04 0.00 -0.45 0.00 0.00 34.95 33.48 1fui s ARG 405 CO 0.49 0.22 0.30 -0.40 -0.68 0.00 0.00 175.30 175.23 1fui n ASP 406 N 1.59 0.39 -0.18 0.23 5.68 -0.75 -4.90 116.55 118.62 1fui n ASP 406 Ca -0.19 -1.34 -0.03 0.00 -0.50 0.00 0.00 54.79 52.73 1fui n ASP 406 Cb 0.54 -0.20 0.07 0.00 -1.14 0.00 0.00 41.12 40.39 1fui n ASP 406 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1fui h SER 407 N -0.19 0.31 0.00 -1.12 0.02 -2.02 -1.40 113.55 109.15 1fui h SER 407 Ca -0.10 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1fui h SER 407 Cb 0.37 -0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1fui h SER 407 CO 0.11 0.21 0.00 -0.62 -1.14 0.00 0.00 176.83 175.38 1fui n GLU 408 N -4.93 0.71 -0.66 3.45 1.02 -1.26 -4.88 120.64 114.09 1fui n GLU 408 Ca 0.06 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 1fui n GLU 408 Cb 0.18 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 30.16 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 0.40 0.79 3.80 0.62 0.00 -0.53 -5.06 105.19 105.22 1fui n GLY 409 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.76 6.83 0.27 1.61 0.01 -1.26 -4.71 114.94 114.93 1fui s ASN 410 Ca 0.00 1.82 -0.30 0.00 -0.71 0.00 0.00 52.86 53.67 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 -0.43 1.39 -2.16 -1.51 0.00 0.00 177.10 174.39 1fui s PRO 411 N -2.93 4.30 0.17 -0.60 0.04 -1.26 -1.81 135.00 132.91 1fui s PRO 411 Ca 0.61 2.26 -0.05 0.00 0.04 0.00 0.00 61.00 63.86 1fui s PRO 411 Cb -0.14 -3.10 0.02 0.00 0.04 0.00 0.00 34.50 31.32 1fui s PRO 411 CO 0.18 -0.35 0.32 -2.37 0.04 0.00 0.00 177.00 174.83 1fui n THR 412 N 1.89 0.00 -4.00 1.26 5.66 -0.27 -4.88 114.28 113.94 1fui n THR 412 Ca 0.05 -0.52 -0.21 0.00 -3.05 0.00 0.00 64.05 60.32 1fui n THR 412 Cb 0.41 0.45 -0.17 0.00 -1.55 0.00 0.00 70.33 69.47 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 -2.11 0.72 0.31 1.09 -1.94 -1.26 -3.73 119.30 112.37 1fui s MET 413 Ca 0.08 -0.02 0.11 0.00 -1.71 0.00 0.00 55.69 54.15 1fui s MET 413 Cb -0.02 -0.86 -0.06 0.00 2.01 0.00 0.00 34.83 35.90 1fui s MET 413 CO 0.06 -0.17 -0.12 0.15 -0.01 0.00 0.00 175.02 174.93 1fui s LYS 414 N 1.30 1.82 0.43 2.03 1.02 -1.26 -4.96 119.74 120.13 1fui s LYS 414 Ca -0.05 -1.80 -0.25 0.00 0.02 0.00 0.00 55.97 53.88 1fui s LYS 414 Cb -0.13 -1.79 -0.08 0.00 -0.52 0.00 0.00 37.83 35.30 1fui s LYS 414 CO -0.02 0.24 1.32 -2.14 -0.92 0.00 0.00 175.35 173.83 1fui s PRO 415 N -3.58 3.80 0.60 -1.68 0.02 -1.26 -4.59 135.00 128.30 1fui s PRO 415 Ca 0.32 2.19 0.29 0.00 0.02 0.00 0.00 61.00 63.81 1fui s PRO 415 Cb -0.02 -2.65 1.39 0.00 0.02 0.00 0.00 34.50 33.24 1fui s PRO 415 CO 0.16 -0.64 1.79 1.12 -0.33 0.00 0.00 177.00 179.10 1fui h HIS 416 N 2.42 0.00 0.00 6.54 2.07 -1.86 -0.44 115.15 123.87 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 1.26 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.24 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 -3.60 0.00 0.12 6.12 2.14 -1.26 -2.71 117.44 118.25 1fui n TRP 417 Ca 0.11 0.00 0.05 0.00 2.07 0.00 0.00 57.50 59.73 1fui n TRP 417 Cb 0.82 -0.44 0.10 0.00 -0.81 0.00 0.00 31.31 30.97 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 -1.44 1.73 -3.41 -2.67 1.02 -0.18 -4.97 120.64 110.72 1fui n GLU 418 Ca 0.07 -1.60 -0.38 0.00 -0.02 0.00 0.00 57.16 55.23 1fui n GLU 418 Cb 0.25 -1.23 -0.08 0.00 -0.02 0.00 0.00 31.44 30.37 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 -0.94 5.21 0.31 -3.67 1.01 -1.10 -4.97 121.20 117.05 1fui s ILE 419 Ca 0.17 0.68 -0.02 0.00 0.00 0.00 0.00 60.65 61.48 1fui s ILE 419 Cb 0.10 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1fui s ILE 419 CO 0.14 0.27 0.54 -0.94 0.00 0.00 0.00 174.94 174.95 1fui s SER 420 N 1.00 6.36 0.44 3.58 1.04 -1.26 -4.96 113.70 119.91 1fui s SER 420 Ca 0.18 0.57 0.17 0.00 0.48 0.00 0.00 55.95 57.35 1fui s SER 420 Cb -0.15 -2.08 1.10 0.00 0.10 0.00 0.00 66.02 64.99 1fui s SER 420 CO 0.08 -0.23 1.94 -0.61 0.98 0.00 0.00 173.24 175.39 1fui h GLN 421 N 1.26 0.34 -0.54 4.02 5.75 -1.99 -0.35 115.11 123.60 1fui h GLN 421 Ca -0.49 -0.02 -0.02 0.00 -0.15 0.00 0.00 58.65 57.98 1fui h GLN 421 Cb 1.20 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 29.65 1fui h GLN 421 CO 0.64 0.23 0.27 1.96 -2.65 0.00 0.00 178.83 179.28 1fui h GLN 422 N 0.35 0.78 -0.23 1.69 4.20 -1.99 -1.47 115.11 118.44 1fui h GLN 422 Ca 0.34 -0.11 -0.12 0.00 0.06 0.00 0.00 58.65 58.82 1fui h GLN 422 Cb 0.83 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.45 1fui h GLN 422 CO -0.09 0.63 -0.38 0.93 -0.67 0.00 0.00 178.83 179.25 1fui h GLU 423 N 0.73 0.51 0.13 1.46 5.08 -1.49 -1.52 114.58 119.49 1fui h GLU 423 Ca 0.19 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1fui h GLU 423 Cb 0.10 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.35 1fui h GLU 423 CO -0.03 0.81 -0.06 0.00 -1.00 0.00 0.00 179.01 178.73 1fui h ALA 424 N 1.17 -0.18 -0.73 3.43 0.00 -1.03 -1.99 119.26 119.94 1fui h ALA 424 Ca 0.04 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1fui h ALA 424 Cb 0.85 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 1fui h ALA 424 CO 0.07 -0.57 0.48 -0.44 0.00 0.00 0.00 179.25 178.79 1fui h ASP 425 N -0.23 0.84 -0.78 0.00 3.32 -1.16 -1.72 116.42 116.69 1fui h ASP 425 Ca -0.02 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 1fui h ASP 425 Cb 0.18 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.48 1fui h ASP 425 CO 0.03 0.61 0.34 0.00 -1.72 0.00 0.00 179.24 178.51 1fui h ALA 426 N 1.54 1.11 -0.56 3.45 0.00 -1.04 -0.07 119.26 123.69 1fui h ALA 426 Ca 0.27 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.90 1fui h ALA 426 Cb -0.11 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.35 1fui h ALA 426 CO -0.06 0.65 -0.03 0.00 0.00 0.00 0.00 179.25 179.81 1fui h LEU 428 N 0.91 1.04 -1.83 0.00 6.46 -1.02 -2.79 115.31 118.09 1fui h LEU 428 Ca 0.16 -0.34 -0.02 0.00 -0.12 0.00 0.00 57.88 57.56 1fui h LEU 428 Cb 0.56 -0.28 -0.00 0.00 -0.73 0.00 0.00 40.66 40.21 1fui h LEU 428 CO 0.03 1.13 -0.10 0.00 -0.62 0.00 0.00 178.44 178.89 1fui h ALA 429 N 0.94 1.14 -0.05 1.25 0.00 -0.82 -2.04 119.26 119.69 1fui h ALA 429 Ca 0.15 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1fui h ALA 429 Cb 0.65 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1fui h ALA 429 CO 0.04 0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.42 1fui n ALA 430 N -2.21 2.58 -2.54 0.00 0.00 -0.94 -4.85 120.51 112.56 1fui n ALA 430 Ca -0.01 -0.41 -0.33 0.00 0.00 0.00 0.00 53.44 52.69 1fui n ALA 430 Cb 0.26 -1.21 -0.12 0.00 0.00 0.00 0.00 19.45 18.39 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 -1.94 3.43 -0.09 0.00 2.01 -0.77 -4.53 115.64 113.75 1fui s THR 431 Ca 0.37 -0.61 0.04 0.00 0.31 0.00 0.00 61.69 61.80 1fui s THR 431 Cb 0.20 -2.39 0.00 0.00 0.01 0.00 0.00 72.50 70.32 1fui s THR 431 CO 0.31 0.58 -0.22 -1.61 -0.69 0.00 0.00 174.62 172.99 1fui s GLU 432 N -0.83 2.84 -0.29 4.92 2.02 -0.35 -4.26 118.70 122.75 1fui s GLU 432 Ca 0.12 -0.81 -0.17 0.00 0.02 0.00 0.00 54.97 54.13 1fui s GLU 432 Cb -0.11 -2.17 -0.02 0.00 0.10 0.00 0.00 34.13 31.93 1fui s GLU 432 CO 0.02 0.16 0.47 -1.58 0.02 0.00 0.00 175.26 174.34 1fui s TRP 433 N 0.38 3.23 -0.04 1.61 0.52 0.56 -0.86 118.94 124.35 1fui s TRP 433 Ca -0.18 0.42 0.04 0.00 0.02 0.00 0.00 56.10 56.40 1fui s TRP 433 Cb -0.18 -2.73 -0.03 0.00 -1.15 0.00 0.00 33.47 29.39 1fui s TRP 433 CO 0.08 -0.34 -0.14 0.00 0.02 0.00 0.00 176.95 176.57 1fui n PRO 435 N 2.18 2.57 -2.12 0.00 -0.02 -1.26 -0.28 135.00 136.07 1fui n PRO 435 Ca -0.17 0.90 -0.36 0.00 -2.02 0.00 0.00 63.50 61.85 1fui n PRO 435 Cb 0.52 -2.61 0.01 0.00 -0.02 0.00 0.00 33.50 31.41 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 -1.01 2.74 -0.33 3.55 0.00 -0.33 -4.78 121.76 121.60 1fui s ALA 436 Ca 0.55 0.98 -0.29 0.00 0.00 0.00 0.00 51.96 53.20 1fui s ALA 436 Cb -0.50 -3.42 -0.01 0.00 0.00 0.00 0.00 23.12 19.19 1fui s ALA 436 CO 0.62 -0.94 1.52 0.42 0.00 0.00 0.00 175.76 177.38 1fui s ILE 437 N -1.58 3.81 0.23 0.00 1.01 -1.26 -4.79 121.20 118.61 1fui s ILE 437 Ca 0.71 0.86 -0.12 0.00 0.00 0.00 0.00 60.65 62.11 1fui s ILE 437 Cb -0.30 -3.95 0.31 0.00 0.01 0.00 0.00 42.46 38.53 1fui s ILE 437 CO 0.34 -0.52 1.60 -0.74 0.00 0.00 0.00 174.94 175.62 1fui h HIS 438 N 10.88 -0.40 -0.93 3.97 -0.00 -1.92 -0.72 115.15 126.03 1fui h HIS 438 Ca -0.30 0.07 0.22 0.00 -0.00 0.00 0.00 60.37 60.36 1fui h HIS 438 Cb 1.13 0.30 -0.07 0.00 -0.00 0.00 0.00 27.41 28.77 1fui h HIS 438 CO 0.94 -0.33 0.62 0.93 -0.00 0.00 0.00 177.93 180.09 1fui h GLU 439 N 0.00 0.35 0.03 5.26 3.07 -1.97 -2.29 114.58 119.03 1fui h GLU 439 Ca 0.37 -0.02 -0.36 0.00 -0.50 0.00 0.00 59.36 58.84 1fui h GLU 439 Cb 0.56 -0.08 -0.05 0.00 -0.84 0.00 0.00 28.75 28.34 1fui h GLU 439 CO -0.78 0.23 -2.19 0.66 -1.40 0.00 0.00 179.01 175.53 1fui n TYR 440 N -4.50 0.53 -3.77 4.33 4.01 -0.45 -4.68 117.16 112.63 1fui n TYR 440 Ca 0.20 0.14 -0.28 0.00 -0.16 0.00 0.00 57.90 57.80 1fui n TYR 440 Cb 0.76 -1.08 -0.11 0.00 -0.31 0.00 0.00 39.34 38.60 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 -3.17 2.30 0.19 -0.72 3.72 -0.41 -4.82 117.46 114.55 1fui n PHE 441 Ca -0.34 -4.08 0.17 0.00 -0.05 0.00 0.00 57.45 53.15 1fui n PHE 441 Cb 1.05 -0.42 0.81 0.00 -0.94 0.00 0.00 39.48 39.98 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 5.39 0.00 -0.00 -1.08 3.08 -1.14 -1.04 114.38 119.59 1fui h ARG 442 Ca 0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.23 1fui h ARG 442 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1fui h ARG 442 CO 0.64 0.00 -0.13 0.41 -1.07 0.00 0.00 179.97 179.82 1fui n GLY 443 N -1.43 -1.04 3.72 0.04 0.00 -0.71 -4.82 105.19 100.94 1fui n GLY 443 Ca 0.02 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.79 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 1.33 -1.87 0.00 -0.02 0.00 -0.39 -3.07 105.19 101.17 1fui n GLY 444 Ca 0.13 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.44 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 0.00 1.13 2.77 -0.02 0.00 -1.26 -0.73 105.19 107.09 1fui n GLY 445 Ca 0.00 -1.65 -0.25 0.00 0.00 0.00 0.00 46.02 44.12 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 -1.58 0.93 0.28 1.61 2.02 -1.26 -1.19 117.35 118.16 1fui s TYR 446 Ca 0.00 -0.53 -0.22 0.00 -0.37 0.00 0.00 57.07 55.95 1fui s TYR 446 Cb 0.00 -0.95 -0.09 0.00 -0.40 0.00 0.00 41.96 40.52 1fui s TYR 446 CO 0.00 -0.47 0.83 -1.12 -1.57 0.00 0.00 175.55 173.22 1fui s SER 447 N 1.89 7.16 -0.54 2.29 0.01 0.62 -2.93 113.70 122.21 1fui s SER 447 Ca 0.02 1.60 -0.18 0.00 1.31 0.00 0.00 55.95 58.70 1fui s SER 447 Cb -0.14 -2.49 0.09 0.00 0.21 0.00 0.00 66.02 63.68 1fui s SER 447 CO -0.07 -0.03 0.61 -0.94 0.41 0.00 0.00 173.24 173.22 1fui s SER 448 N -1.68 6.19 -0.23 2.44 1.04 -0.41 -1.32 113.70 119.74 1fui s SER 448 Ca 0.47 -1.27 -0.10 0.00 0.48 0.00 0.00 55.95 55.53 1fui s SER 448 Cb -0.17 -2.27 -0.05 0.00 0.10 0.00 0.00 66.02 63.63 1fui s SER 448 CO 0.22 -0.94 0.14 -0.60 0.98 0.00 0.00 173.24 173.04 1fui s ARG 449 N 2.39 4.04 0.20 4.02 3.52 -0.04 -3.51 118.95 129.57 1fui s ARG 449 Ca 0.11 -0.29 -0.14 0.00 -0.13 0.00 0.00 55.73 55.28 1fui s ARG 449 Cb -0.23 -3.47 0.01 0.00 -1.56 0.00 0.00 34.95 29.70 1fui s ARG 449 CO 0.08 0.10 0.45 -0.59 -0.81 0.00 0.00 175.30 174.53 1fui s PHE 450 N 0.94 0.10 -0.16 5.12 -0.12 -1.26 -1.22 117.98 121.38 1fui s PHE 450 Ca 0.07 -0.46 0.01 0.00 -0.05 0.00 0.00 56.93 56.49 1fui s PHE 450 Cb -0.13 0.24 0.02 0.00 -0.63 0.00 0.00 43.02 42.52 1fui s PHE 450 CO 0.03 -0.88 -0.16 -1.17 -0.05 0.00 0.00 175.22 172.99 1fui s LEU 451 N -2.92 1.88 0.21 -1.99 0.20 -1.26 -1.72 118.68 113.07 1fui s LEU 451 Ca 0.14 -0.57 -0.30 0.00 0.69 0.00 0.00 54.13 54.09 1fui s LEU 451 Cb 0.00 -1.30 -0.09 0.00 -0.43 0.00 0.00 46.19 44.37 1fui s LEU 451 CO 0.00 -0.04 1.39 -0.89 -0.29 0.00 0.00 176.35 176.52 1fui s THR 452 N 1.41 2.96 0.54 3.68 2.01 -0.79 -4.81 115.64 120.63 1fui s THR 452 Ca 0.05 0.77 -0.22 0.00 0.31 0.00 0.00 61.69 62.60 1fui s THR 452 Cb -0.13 -3.49 -0.05 0.00 0.01 0.00 0.00 72.50 68.84 1fui s THR 452 CO -0.11 0.11 1.32 -1.61 -0.69 0.00 0.00 174.62 173.63 1fui s GLU 453 N 0.03 3.20 0.78 4.92 2.02 -1.16 -4.82 118.70 123.67 1fui s GLU 453 Ca 0.60 2.13 -0.11 0.00 0.02 0.00 0.00 54.97 57.61 1fui s GLU 453 Cb -0.39 -2.24 0.06 0.00 0.10 0.00 0.00 34.13 31.66 1fui s GLU 453 CO 0.39 -1.11 1.15 0.20 0.02 0.00 0.00 175.26 175.90 1fui s GLY 454 N -1.07 1.60 -0.39 -1.39 0.00 -1.26 -4.34 107.32 100.47 1fui s GLY 454 Ca 0.71 -0.59 0.00 0.00 0.00 0.00 0.00 44.72 44.84 1fui s GLY 454 CO 0.45 -0.14 0.00 0.61 0.00 0.00 0.00 173.10 174.01 1fui n GLY 455 N -3.21 0.65 3.73 0.20 0.00 0.30 -4.85 105.19 102.01 1fui n GLY 455 Ca 0.08 -0.40 -0.35 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.99 5.31 0.20 1.61 1.01 -1.24 -4.87 120.40 120.43 1fui s VAL 456 Ca 0.00 0.15 -0.30 0.00 0.00 0.00 0.00 61.98 61.83 1fui s VAL 456 Cb 0.00 -3.40 -0.08 0.00 0.00 0.00 0.00 36.38 32.90 1fui s VAL 456 CO 0.00 0.46 1.12 -2.16 0.00 0.00 0.00 175.10 174.53 1fui s PRO 457 N 0.20 4.58 0.07 2.72 0.04 -1.26 -1.04 135.00 140.29 1fui s PRO 457 Ca 0.08 1.77 -0.01 0.00 0.04 0.00 0.00 61.00 62.89 1fui s PRO 457 Cb -0.11 -3.25 -0.04 0.00 0.04 0.00 0.00 34.50 31.13 1fui s PRO 457 CO -0.01 0.06 -0.03 -0.06 0.04 0.00 0.00 177.00 177.00 1fui s PHE 458 N -0.35 0.62 -0.13 0.56 0.08 -0.36 -0.57 117.98 117.84 1fui s PHE 458 Ca 0.49 -1.06 0.00 0.00 0.12 0.00 0.00 56.93 56.49 1fui s PHE 458 Cb -0.31 -0.42 0.02 0.00 -0.57 0.00 0.00 43.02 41.74 1fui s PHE 458 CO 0.36 -0.35 -0.12 0.99 -0.10 0.00 0.00 175.22 176.00 1fui s THR 459 N -3.88 1.37 -0.17 0.64 2.01 -0.15 -0.99 115.64 114.47 1fui s THR 459 Ca 0.10 -0.52 -0.08 0.00 0.31 0.00 0.00 61.69 61.49 1fui s THR 459 Cb 0.07 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.23 1fui s THR 459 CO -0.08 0.42 0.12 -0.32 -0.69 0.00 0.00 174.62 174.07 1fui s MET 460 N 1.45 3.89 0.19 4.92 1.75 0.02 -0.80 119.30 130.73 1fui s MET 460 Ca 0.03 -0.22 0.01 0.00 -1.25 0.00 0.00 55.69 54.25 1fui s MET 460 Cb -0.13 -3.29 -0.05 0.00 2.84 0.00 0.00 34.83 34.20 1fui s MET 460 CO -0.08 0.45 0.06 0.95 -0.65 0.00 0.00 175.02 175.75 1fui s THR 461 N -0.10 0.43 -0.24 10.11 -4.23 -0.01 -0.16 115.64 121.44 1fui s THR 461 Ca 0.09 -1.97 -0.26 0.00 -1.18 0.00 0.00 61.69 58.37 1fui s THR 461 Cb -0.12 -2.30 0.11 0.00 1.34 0.00 0.00 72.50 71.53 1fui s THR 461 CO 0.00 -0.27 0.94 -0.60 -0.54 0.00 0.00 174.62 174.15 1fui s ARG 462 N -4.01 0.63 -0.06 3.99 6.06 -0.79 -0.90 118.95 123.87 1fui s ARG 462 Ca 0.30 0.58 0.03 0.00 -2.50 0.00 0.00 55.73 54.14 1fui s ARG 462 Cb 0.07 0.30 -0.02 0.00 0.06 0.00 0.00 34.95 35.36 1fui s ARG 462 CO 0.07 -0.11 -0.14 0.08 -2.50 0.00 0.00 175.30 172.71 1fui s VAL 463 N -0.06 3.07 0.05 7.11 1.01 -1.26 -0.86 120.40 129.46 1fui s VAL 463 Ca 0.01 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.29 1fui s VAL 463 Cb -0.04 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 1fui s VAL 463 CO -0.02 0.59 -0.07 0.20 0.00 0.00 0.00 175.10 175.79 1fui s ASN 464 N -0.63 0.83 -0.22 3.32 0.01 -0.67 -4.70 114.94 112.88 1fui s ASN 464 Ca 0.09 -0.67 -0.06 0.00 -0.71 0.00 0.00 52.86 51.52 1fui s ASN 464 Cb -0.11 0.06 -0.03 0.00 0.41 0.00 0.00 41.25 41.59 1fui s ASN 464 CO 0.01 -0.29 0.03 -0.63 -1.51 0.00 0.00 177.10 174.71 1fui s ILE 465 N -2.00 4.11 -0.24 0.60 1.01 -1.26 -1.04 121.20 122.37 1fui s ILE 465 Ca -0.05 -0.25 -0.04 0.00 0.00 0.00 0.00 60.65 60.31 1fui s ILE 465 Cb -0.06 -2.89 -0.00 0.00 0.01 0.00 0.00 42.46 39.52 1fui s ILE 465 CO -0.01 0.39 -0.01 -0.63 0.00 0.00 0.00 174.94 174.68 1fui s ILE 466 N 1.25 3.48 0.20 2.92 -1.09 -0.07 -4.98 121.20 122.92 1fui s ILE 466 Ca 0.04 -0.60 -0.32 0.00 -2.23 0.00 0.00 60.65 57.54 1fui s ILE 466 Cb -0.15 -2.66 -0.11 0.00 -1.58 0.00 0.00 42.46 37.96 1fui s ILE 466 CO 0.02 0.31 1.67 -0.75 -1.23 0.00 0.00 174.94 174.95 1fui s LYS 467 N 1.47 4.15 0.00 2.79 2.20 -1.26 -0.37 119.74 128.72 1fui s LYS 467 Ca 0.04 2.53 0.00 0.00 -0.36 0.00 0.00 55.97 58.18 1fui s LYS 467 Cb -0.15 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.07 1fui s LYS 467 CO -0.02 -0.70 0.00 0.41 -0.36 0.00 0.00 175.35 174.68 1fui n GLY 468 N 3.79 0.98 0.75 5.54 0.00 -1.26 -4.77 105.19 110.21 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 0.91 0.00 0.99 0.00 -0.39 -5.16 117.00 113.35 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 0.08 0.00 0.61 0.00 0.00 0.00 177.39 178.08 1fui n GLY 470 N 2.81 -0.48 3.81 -3.96 0.00 0.50 -4.98 105.19 102.89 1fui n GLY 470 Ca 0.00 -2.16 -0.33 0.00 0.00 0.00 0.00 46.02 43.52 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 3.92 0.03 1.61 0.04 -1.26 -0.89 135.00 138.45 1fui s PRO 471 Ca 0.00 1.24 -0.01 0.00 0.04 0.00 0.00 61.00 62.27 1fui s PRO 471 Cb 0.00 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.39 1fui s PRO 471 CO 0.00 -0.31 -0.02 0.14 0.04 0.00 0.00 177.00 176.84 1fui s VAL 472 N -2.13 0.14 -0.04 -0.36 -7.23 -0.21 -4.02 120.40 106.55 1fui s VAL 472 Ca 0.65 -1.15 0.05 0.00 -1.81 0.00 0.00 61.98 59.72 1fui s VAL 472 Cb -0.13 -0.61 -0.02 0.00 0.56 0.00 0.00 36.38 36.17 1fui s VAL 472 CO 0.20 -0.63 -0.18 -0.22 -0.31 0.00 0.00 175.10 173.95 1fui s LEU 473 N -1.86 2.50 -0.05 1.32 2.96 0.08 -1.67 118.68 121.96 1fui s LEU 473 Ca -0.10 -0.30 0.07 0.00 -0.22 0.00 0.00 54.13 53.58 1fui s LEU 473 Cb -0.05 -1.48 -0.01 0.00 0.50 0.00 0.00 46.19 45.15 1fui s LEU 473 CO -0.03 0.33 -0.25 -1.10 -1.32 0.00 0.00 176.35 173.98 1fui s GLN 474 N -0.71 2.36 0.03 1.98 -0.21 -0.04 -1.52 119.66 121.54 1fui s GLN 474 Ca 0.11 -0.89 0.04 0.00 0.02 0.00 0.00 55.36 54.64 1fui s GLN 474 Cb -0.10 -2.07 -0.02 0.00 1.00 0.00 0.00 33.01 31.81 1fui s GLN 474 CO 0.00 0.42 -0.11 0.42 -2.12 0.00 0.00 175.29 173.91 1fui s ILE 475 N -0.28 0.84 -0.27 1.08 1.01 -0.04 -1.88 121.20 121.65 1fui s ILE 475 Ca 0.00 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 59.83 1fui s ILE 475 Cb -0.12 -0.77 0.14 0.00 0.01 0.00 0.00 42.46 41.71 1fui s ILE 475 CO 0.02 -0.03 0.34 0.00 0.00 0.00 0.00 174.94 175.27 1fui s ALA 476 N -0.77 -0.83 0.34 9.38 0.00 0.78 -3.80 121.76 126.86 1fui s ALA 476 Ca -0.01 0.19 -0.21 0.00 0.00 0.00 0.00 51.96 51.93 1fui s ALA 476 Cb -0.07 -1.82 -0.10 0.00 0.00 0.00 0.00 23.12 21.13 1fui s ALA 476 CO 0.01 -1.58 0.87 -1.21 0.00 0.00 0.00 175.76 173.86 1fui s GLU 477 N 2.46 4.30 0.00 0.00 2.02 -1.26 -0.80 118.70 125.42 1fui s GLU 477 Ca 0.10 1.07 0.00 0.00 0.02 0.00 0.00 54.97 56.16 1fui s GLU 477 Cb -0.14 -2.53 0.00 0.00 0.10 0.00 0.00 34.13 31.56 1fui s GLU 477 CO -0.26 0.17 0.00 0.41 0.02 0.00 0.00 175.26 175.60 1fui n GLY 478 N 0.00 1.72 3.12 -1.39 0.00 -0.16 -1.33 105.19 107.15 1fui n GLY 478 Ca 0.03 -0.48 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.63 0.25 0.17 1.61 0.51 -0.14 -1.22 118.94 118.48 1fui s TRP 479 Ca 0.00 -0.60 -0.20 0.00 -2.12 0.00 0.00 56.10 53.18 1fui s TRP 479 Cb 0.00 -0.17 -0.08 0.00 -0.81 0.00 0.00 33.47 32.41 1fui s TRP 479 CO 0.00 -0.38 0.69 -1.54 -0.51 0.00 0.00 176.95 175.21 1fui s SER 480 N -2.30 7.11 0.21 2.95 1.04 -0.21 -0.73 113.70 121.77 1fui s SER 480 Ca -0.02 1.41 0.10 0.00 0.48 0.00 0.00 55.95 57.91 1fui s SER 480 Cb 0.01 -2.41 -0.04 0.00 0.10 0.00 0.00 66.02 63.67 1fui s SER 480 CO -0.06 0.13 -0.12 0.68 0.98 0.00 0.00 173.24 174.85 1fui s VAL 481 N -1.35 3.02 -0.22 5.02 -7.23 0.13 0.11 120.40 119.88 1fui s VAL 481 Ca 0.38 -1.84 -0.06 0.00 -1.81 0.00 0.00 61.98 58.66 1fui s VAL 481 Cb -0.19 -2.52 -0.02 0.00 0.56 0.00 0.00 36.38 34.22 1fui s VAL 481 CO 0.22 -0.18 0.02 -0.70 -0.31 0.00 0.00 175.10 174.14 1fui s GLU 482 N -3.00 3.61 0.00 4.82 2.12 -1.26 -4.42 118.70 120.57 1fui s GLU 482 Ca 0.26 -0.51 -0.05 0.00 0.36 0.00 0.00 54.97 55.02 1fui s GLU 482 Cb -0.08 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 1fui s GLU 482 CO 0.15 -0.07 0.23 -0.51 -0.54 0.00 0.00 175.26 174.53 1fui s LEU 483 N 1.23 4.37 0.24 2.70 1.43 -1.26 -5.02 118.68 122.37 1fui s LEU 483 Ca 0.04 0.48 -0.31 0.00 -1.03 0.00 0.00 54.13 53.30 1fui s LEU 483 Cb -0.15 -2.65 -0.12 0.00 0.03 0.00 0.00 46.19 43.31 1fui s LEU 483 CO 0.02 0.26 1.62 -0.81 0.23 0.00 0.00 176.35 177.66 1fui n PRO 484 N 1.06 2.58 -0.10 1.29 -0.04 -1.26 -4.68 135.00 133.86 1fui n PRO 484 Ca -0.11 0.93 -0.00 0.00 -0.04 0.00 0.00 63.50 64.27 1fui n PRO 484 Cb 0.53 -2.71 0.01 0.00 -0.04 0.00 0.00 33.50 31.28 1fui n PRO 484 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1fui n LYS 485 N 2.90 -0.07 0.00 0.54 -0.00 -1.26 -0.47 118.16 119.80 1fui n LYS 485 Ca 0.12 0.41 -0.06 0.00 -0.00 0.00 0.00 58.31 58.78 1fui n LYS 485 Cb 0.34 -0.61 0.12 0.00 -0.00 0.00 0.00 35.03 34.89 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 0.56 -0.28 -5.58 2.03 -2.00 -2.78 116.42 108.38 1fui h ASP 486 Ca 0.09 -0.24 -0.03 0.00 -0.73 0.00 0.00 57.03 56.11 1fui h ASP 486 Cb 0.16 -0.16 -0.01 0.00 -0.83 0.00 0.00 39.33 38.49 1fui h ASP 486 CO -0.26 0.89 0.04 0.58 -1.03 0.00 0.00 179.24 179.46 1fui h VAL 487 N 0.44 1.23 -0.91 4.15 2.07 -1.12 -2.47 116.25 119.65 1fui h VAL 487 Ca 0.04 -0.80 0.08 0.00 0.82 0.00 0.00 66.70 66.83 1fui h VAL 487 Cb 0.88 1.22 -0.07 0.00 -1.52 0.00 0.00 31.29 31.80 1fui h VAL 487 CO 0.07 0.26 0.57 -0.74 0.02 0.00 0.00 177.57 177.75 1fui h HIS 488 N 0.28 1.04 -0.65 1.57 -0.00 -1.45 -2.16 115.15 113.79 1fui h HIS 488 Ca 0.08 0.03 -0.05 0.00 -0.00 0.00 0.00 60.37 60.43 1fui h HIS 488 Cb 0.34 -0.34 -0.03 0.00 -0.00 0.00 0.00 27.41 27.39 1fui h HIS 488 CO 0.02 0.50 0.20 -0.44 -0.00 0.00 0.00 177.93 178.21 1fui h ASP 489 N 1.00 0.95 0.13 3.26 3.32 -1.21 0.16 116.42 124.02 1fui h ASP 489 Ca 0.41 -0.21 -0.01 0.00 0.02 0.00 0.00 57.03 57.24 1fui h ASP 489 Cb 0.24 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1fui h ASP 489 CO -0.20 0.91 -0.06 0.40 -1.72 0.00 0.00 179.24 178.57 1fui h ILE 490 N 0.94 0.91 -0.56 0.35 1.08 -0.98 -1.67 117.51 117.57 1fui h ILE 490 Ca 0.21 -0.12 -0.10 0.00 -0.39 0.00 0.00 64.86 64.46 1fui h ILE 490 Cb 0.30 0.98 -0.02 0.00 -3.07 0.00 0.00 36.82 35.01 1fui h ILE 490 CO -0.01 0.03 -0.05 -0.07 -0.69 0.00 0.00 178.15 177.36 1fui h LEU 491 N -0.23 1.02 -0.02 1.44 3.38 -1.31 -2.87 115.31 116.72 1fui h LEU 491 Ca -0.02 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1fui h LEU 491 Cb 0.18 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.65 1fui h LEU 491 CO 0.03 1.11 0.00 -1.13 0.09 0.00 0.00 178.44 178.54 1fui h ASN 492 N 0.91 0.03 0.23 -0.43 -1.24 -0.60 -2.42 115.58 112.06 1fui h ASN 492 Ca 0.15 -0.27 -0.05 0.00 0.71 0.00 0.00 56.30 56.84 1fui h ASN 492 Cb 0.62 -0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.65 1fui h ASN 492 CO 0.04 0.30 -0.22 0.07 -1.29 0.00 0.00 177.43 176.32 1fui h LYS 493 N -0.24 0.00 0.00 6.67 2.10 -1.37 -2.29 116.57 121.44 1fui h LYS 493 Ca 0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1fui h LYS 493 Cb 0.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 1fui h LYS 493 CO 0.00 0.22 0.00 -0.09 -2.00 0.00 0.00 179.45 177.58 1fui h ARG 494 N 0.00 0.00 0.00 0.07 2.43 -1.33 -3.42 114.38 112.13 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 0.40 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1fui h ARG 494 CO 0.03 0.00 0.00 2.41 -1.51 0.00 0.00 179.97 180.90 1fui n THR 495 N -2.96 0.00 -2.98 0.20 -1.04 -0.89 -5.05 114.28 101.56 1fui n THR 495 Ca 0.02 0.00 -0.11 0.00 -2.04 0.00 0.00 64.05 61.92 1fui n THR 495 Cb 0.37 -0.46 -0.03 0.00 -1.82 0.00 0.00 70.33 68.39 1fui n THR 495 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1fui s ASN 496 N -0.17 -0.53 0.48 8.00 -0.87 -1.06 -5.03 114.94 115.77 1fui s ASN 496 Ca 0.00 -2.08 0.26 0.00 -1.57 0.00 0.00 52.86 49.47 1fui s ASN 496 Cb 0.00 1.18 1.41 0.00 -0.02 0.00 0.00 41.25 43.82 1fui s ASN 496 CO 0.00 -0.10 1.76 0.77 -2.57 0.00 0.00 177.10 176.97 1fui h SER 497 N 5.34 0.00 -0.11 -1.22 4.64 -1.75 -2.29 113.55 118.16 1fui h SER 497 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 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 0.12 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.43 1fui n THR 498 N -2.53 0.12 -4.10 2.95 -2.24 -1.26 -4.95 114.28 102.26 1fui n THR 498 Ca -0.02 -0.40 -0.28 0.00 -2.27 0.00 0.00 64.05 61.08 1fui n THR 498 Cb 0.22 0.76 -0.07 0.00 -2.10 0.00 0.00 70.33 69.14 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 -1.88 3.07 0.19 4.78 0.51 -0.86 -4.36 118.94 120.39 1fui s TRP 499 Ca 0.34 -0.02 -0.31 0.00 -2.12 0.00 0.00 56.10 54.00 1fui s TRP 499 Cb 0.20 -1.52 -0.10 0.00 -0.81 0.00 0.00 33.47 31.24 1fui s TRP 499 CO 0.31 0.51 1.49 -1.25 -0.51 0.00 0.00 176.95 177.50 1fui s PRO 500 N -2.72 4.25 0.08 4.98 0.04 -1.23 -4.63 135.00 135.77 1fui s PRO 500 Ca 0.29 2.30 0.08 0.00 0.04 0.00 0.00 61.00 63.71 1fui s PRO 500 Cb -0.11 -3.15 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 1fui s PRO 500 CO 0.21 -0.50 -0.17 0.99 0.04 0.00 0.00 177.00 177.56 1fui s THR 501 N 0.64 2.88 -0.11 1.26 2.01 -0.70 -3.91 115.64 117.71 1fui s THR 501 Ca 0.65 -1.35 -0.04 0.00 0.31 0.00 0.00 61.69 61.26 1fui s THR 501 Cb -0.42 -2.28 0.06 0.00 0.01 0.00 0.00 72.50 69.86 1fui s THR 501 CO 0.36 0.20 0.20 -0.89 -0.69 0.00 0.00 174.62 173.80 1fui s THR 502 N -1.06 -0.32 -0.19 -0.82 2.01 -0.77 -1.88 115.64 112.60 1fui s THR 502 Ca 0.17 0.29 -0.18 0.00 0.31 0.00 0.00 61.69 62.28 1fui s THR 502 Cb -0.11 -0.38 -0.03 0.00 0.01 0.00 0.00 72.50 71.99 1fui s THR 502 CO 0.08 0.11 0.50 0.26 -0.69 0.00 0.00 174.62 174.89 1fui s TRP 503 N 2.34 3.39 -0.06 4.92 0.52 -1.26 -1.69 118.94 127.10 1fui s TRP 503 Ca 0.03 0.77 0.06 0.00 0.02 0.00 0.00 56.10 56.97 1fui s TRP 503 Cb -0.12 -2.64 -0.01 0.00 -1.15 0.00 0.00 33.47 29.54 1fui s TRP 503 CO -0.07 -0.06 -0.23 0.12 0.02 0.00 0.00 176.95 176.73 1fui s PHE 504 N 1.49 2.49 -0.20 -1.98 5.36 -0.24 -0.69 117.98 124.20 1fui s PHE 504 Ca 0.24 -0.63 0.01 0.00 -0.96 0.00 0.00 56.93 55.59 1fui s PHE 504 Cb -0.15 -1.61 0.04 0.00 -0.34 0.00 0.00 43.02 40.96 1fui s PHE 504 CO 0.10 -0.16 -0.10 0.00 -1.46 0.00 0.00 175.22 173.60 1fui s ALA 505 N -0.23 1.99 0.33 11.12 0.00 0.09 -0.95 121.76 134.11 1fui s ALA 505 Ca -0.01 -1.22 -0.24 0.00 0.00 0.00 0.00 51.96 50.48 1fui s ALA 505 Cb -0.13 -1.30 -0.10 0.00 0.00 0.00 0.00 23.12 21.59 1fui s ALA 505 CO 0.03 -0.87 0.92 -1.25 0.00 0.00 0.00 175.76 174.59 1fui s PRO 506 N 1.40 4.49 -0.05 0.00 0.04 -1.26 -0.97 135.00 138.64 1fui s PRO 506 Ca -0.02 1.24 -0.30 0.00 0.04 0.00 0.00 61.00 61.96 1fui s PRO 506 Cb -0.17 -2.71 -0.04 0.00 0.04 0.00 0.00 34.50 31.62 1fui s PRO 506 CO -0.08 0.24 1.38 0.50 0.04 0.00 0.00 177.00 179.08 1fui s ARG 507 N -2.23 4.27 0.32 4.56 3.52 -0.44 -4.94 118.95 124.01 1fui s ARG 507 Ca 0.51 1.89 -0.14 0.00 -0.13 0.00 0.00 55.73 57.86 1fui s ARG 507 Cb -0.17 -3.67 -0.08 0.00 -1.56 0.00 0.00 34.95 29.47 1fui s ARG 507 CO 0.22 -0.62 0.72 -0.51 -0.81 0.00 0.00 175.30 174.29 1fui s LEU 508 N 2.84 4.04 -0.00 -0.88 1.43 -1.26 -4.91 118.68 119.94 1fui s LEU 508 Ca 0.62 1.22 0.01 0.00 -1.03 0.00 0.00 54.13 54.95 1fui s LEU 508 Cb -0.28 -4.03 -0.01 0.00 0.03 0.00 0.00 46.19 41.89 1fui s LEU 508 CO 0.24 -0.22 0.04 0.35 0.23 0.00 0.00 176.35 176.98 1fui n THR 509 N -0.47 0.00 -0.14 5.49 -2.24 -0.05 -5.00 114.28 111.88 1fui n THR 509 Ca 0.03 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.46 1fui n THR 509 Cb 0.53 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.62 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 1.41 1.80 3.29 3.38 0.00 -0.33 -4.97 105.19 109.77 1fui n GLY 510 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 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 -0.32 1.15 4.48 1.61 1.02 -1.25 -4.58 119.74 121.84 1fui s LYS 511 Ca 0.00 -1.20 0.00 0.00 0.02 0.00 0.00 55.97 54.79 1fui s LYS 511 Cb 0.00 -1.38 0.00 0.00 -0.52 0.00 0.00 37.83 35.93 1fui s LYS 511 CO 0.00 0.32 0.00 0.41 -0.92 0.00 0.00 175.35 175.16 1fui n GLY 512 N 0.97 2.52 0.03 -3.33 0.00 -1.26 -1.64 105.19 102.48 1fui n GLY 512 Ca -0.19 -0.35 0.05 0.00 0.00 0.00 0.00 46.02 45.53 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 13.45 0.03 -1.12 1.61 -0.02 -1.26 -2.31 135.00 145.39 1fui n PRO 513 Ca 0.00 0.43 -0.18 0.00 -2.02 0.00 0.00 63.50 61.73 1fui n PRO 513 Cb 0.00 -1.59 0.18 0.00 -0.02 0.00 0.00 33.50 32.07 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 -1.65 2.44 -0.05 6.00 3.72 -0.65 -2.17 117.46 125.11 1fui n PHE 514 Ca 0.01 -1.85 -0.15 0.00 -0.05 0.00 0.00 57.45 55.41 1fui n PHE 514 Cb 0.08 -0.82 -0.07 0.00 -0.94 0.00 0.00 39.48 37.72 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 1.02 1.35 -3.53 4.37 2.02 -1.51 0.32 112.91 116.95 1fui h THR 515 Ca 0.50 -1.67 -0.04 0.00 0.77 0.00 0.00 66.41 65.97 1fui h THR 515 Cb 2.35 2.03 -0.09 0.00 -1.74 0.00 0.00 68.15 70.69 1fui h THR 515 CO 0.90 0.50 -0.07 1.51 0.37 0.00 0.00 175.52 178.74 1fui s ASP 516 N -6.55 -0.13 0.43 4.18 1.47 -1.26 -4.45 116.67 110.36 1fui s ASP 516 Ca -0.13 -0.81 0.10 0.00 1.18 0.00 0.00 52.55 52.89 1fui s ASP 516 Cb 0.06 0.59 0.96 0.00 -0.34 0.00 0.00 42.92 44.19 1fui s ASP 516 CO 0.81 -1.13 2.04 0.58 0.68 0.00 0.00 175.17 178.15 1fui h VAL 517 N 2.24 1.10 -0.64 2.11 2.07 -1.90 -2.17 116.25 119.06 1fui h VAL 517 Ca -0.26 -0.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 1fui h VAL 517 Cb 1.25 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 31.86 1fui h VAL 517 CO 0.35 0.12 0.28 0.22 0.02 0.00 0.00 177.57 178.56 1fui h TYR 518 N 0.29 0.94 -0.04 1.57 3.20 -1.93 -2.83 116.97 118.19 1fui h TYR 518 Ca 0.07 -0.06 -0.05 0.00 3.14 0.00 0.00 58.73 61.84 1fui h TYR 518 Cb 0.09 -0.29 -0.01 0.00 1.54 0.00 0.00 36.73 38.06 1fui h TYR 518 CO 0.00 0.73 -0.21 0.77 -1.64 0.00 0.00 178.16 177.80 1fui h SER 519 N 0.88 0.06 -0.06 -2.11 0.02 -1.61 0.69 113.55 111.42 1fui h SER 519 Ca 0.22 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.14 1fui h SER 519 Cb 0.16 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 62.68 1fui h SER 519 CO -0.02 0.28 -0.00 0.58 -1.14 0.00 0.00 176.83 176.52 1fui h VAL 520 N 0.06 1.26 0.39 2.27 2.07 -1.19 -1.31 116.25 119.79 1fui h VAL 520 Ca 0.01 -0.80 -0.02 0.00 0.82 0.00 0.00 66.70 66.71 1fui h VAL 520 Cb 0.41 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.86 1fui h VAL 520 CO 0.03 0.22 -0.19 -0.03 0.02 0.00 0.00 177.57 177.62 1fui h MET 521 N -0.19 -0.51 -0.30 1.57 -1.53 -1.33 -2.60 114.93 110.05 1fui h MET 521 Ca 0.02 0.03 0.09 0.00 -3.44 0.00 0.00 59.70 56.40 1fui h MET 521 Cb 0.35 0.12 -0.01 0.00 -0.55 0.00 0.00 31.60 31.50 1fui h MET 521 CO 0.00 -0.30 0.28 0.00 0.14 0.00 0.00 176.91 177.03 1fui h ALA 522 N -0.00 2.04 -0.20 0.39 0.00 -0.83 -1.13 119.26 119.54 1fui h ALA 522 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1fui h ALA 522 Cb 0.44 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1fui h ALA 522 CO 0.09 -0.43 0.00 0.09 0.00 0.00 0.00 179.25 179.00 1fui n ASN 523 N -3.97 3.13 -4.77 0.00 3.02 -0.50 -4.95 115.26 107.22 1fui n ASN 523 Ca 0.04 -1.97 -0.40 0.00 -0.03 0.00 0.00 54.58 52.22 1fui n ASN 523 Cb 0.43 -0.12 -0.02 0.00 -0.61 0.00 0.00 39.78 39.46 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 -1.77 3.14 -2.05 3.10 -0.11 -0.43 -4.94 118.94 115.89 1fui s TRP 524 Ca 0.33 1.50 0.14 0.00 1.22 0.00 0.00 56.10 59.30 1fui s TRP 524 Cb 0.21 -3.54 0.42 0.00 -1.50 0.00 0.00 33.47 29.06 1fui s TRP 524 CO 0.31 -1.49 1.34 0.41 -4.62 0.00 0.00 176.95 172.90 1fui n GLY 525 N 0.84 0.88 3.79 5.86 0.00 -1.26 -4.95 105.19 110.34 1fui n GLY 525 Ca 0.01 -0.45 -0.09 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.49 -0.65 -2.60 4.61 0.00 -1.26 -5.01 121.76 115.36 1fui s ALA 526 Ca 0.29 -0.81 0.25 0.00 0.00 0.00 0.00 51.96 51.68 1fui s ALA 526 Cb 0.15 0.67 0.64 0.00 0.00 0.00 0.00 23.12 24.59 1fui s ALA 526 CO 0.20 -0.98 1.51 0.27 0.00 0.00 0.00 175.76 176.77 1fui n ASN 527 N -1.50 2.27 -4.37 0.00 6.94 -1.26 -4.91 115.26 112.44 1fui n ASN 527 Ca -0.08 -1.77 -0.21 0.00 -0.02 0.00 0.00 54.58 52.50 1fui n ASN 527 Cb 0.60 -0.06 -0.10 0.00 -2.36 0.00 0.00 39.78 37.85 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 -1.88 1.89 0.24 -2.53 3.76 -1.26 -0.95 115.29 114.56 1fui s HIS 528 Ca 0.34 -0.48 -0.14 0.00 -0.15 0.00 0.00 55.06 54.64 1fui s HIS 528 Cb 0.20 -0.89 0.00 0.00 1.11 0.00 0.00 32.58 33.00 1fui s HIS 528 CO 0.31 0.43 0.48 0.20 -0.85 0.00 0.00 174.74 175.31 1fui s GLY 529 N -3.10 0.42 -0.03 -2.22 0.00 -0.26 -4.87 107.32 97.26 1fui s GLY 529 Ca 0.22 -0.77 0.06 0.00 0.00 0.00 0.00 44.72 44.22 1fui s GLY 529 CO 0.09 -0.57 -0.21 0.14 0.00 0.00 0.00 173.10 172.54 1fui s VAL 530 N -3.99 1.69 -0.22 1.40 1.01 -0.08 -1.82 120.40 118.39 1fui s VAL 530 Ca 0.20 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.24 1fui s VAL 530 Cb -0.01 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 1fui s VAL 530 CO 0.07 0.48 -0.01 -0.76 0.00 0.00 0.00 175.10 174.88 1fui s LEU 531 N -0.31 3.13 -0.08 3.92 1.02 -0.59 -0.83 118.68 124.95 1fui s LEU 531 Ca 0.03 -0.28 0.04 0.00 0.02 0.00 0.00 54.13 53.93 1fui s LEU 531 Cb -0.10 -1.80 -0.02 0.00 0.02 0.00 0.00 46.19 44.29 1fui s LEU 531 CO 0.01 0.01 -0.19 -0.89 0.02 0.00 0.00 176.35 175.31 1fui s THR 532 N 1.30 2.61 0.44 5.49 2.01 0.02 -2.27 115.64 125.24 1fui s THR 532 Ca 0.04 -0.86 -0.25 0.00 0.31 0.00 0.00 61.69 60.92 1fui s THR 532 Cb -0.15 -2.01 -0.09 0.00 0.01 0.00 0.00 72.50 70.26 1fui s THR 532 CO 0.00 0.56 1.41 0.00 -0.69 0.00 0.00 174.62 175.91 1fui n ILE 533 N 2.93 2.72 0.00 1.82 0.13 -1.26 -0.97 119.36 124.73 1fui n ILE 533 Ca -0.18 -0.50 0.00 0.00 -1.10 0.00 0.00 62.75 60.97 1fui n ILE 533 Cb 0.52 -1.81 0.00 0.00 -0.84 0.00 0.00 39.64 37.51 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 0.61 -1.08 3.27 4.50 0.00 0.27 -4.63 105.19 108.13 1fui n GLY 534 Ca 0.05 -1.61 -0.44 0.00 0.00 0.00 0.00 46.02 44.02 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 -1.03 3.78 -0.25 1.61 3.76 -1.26 -2.26 115.29 119.64 1fui s HIS 535 Ca 0.00 -2.31 0.12 0.00 -0.15 0.00 0.00 55.06 52.73 1fui s HIS 535 Cb 0.00 -3.67 0.57 0.00 1.11 0.00 0.00 32.58 30.59 1fui s HIS 535 CO 0.00 -0.94 1.52 1.33 -0.85 0.00 0.00 174.74 175.81 1fui n VAL 536 N 3.58 2.53 -0.37 -0.90 0.24 -1.26 -4.71 118.33 117.43 1fui n VAL 536 Ca 0.15 -2.13 0.00 0.00 -2.04 0.00 0.00 64.34 60.32 1fui n VAL 536 Cb 0.43 -0.30 0.14 0.00 -1.47 0.00 0.00 33.84 32.64 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 1.65 1.46 0.99 7.63 0.00 -1.97 -2.14 103.07 110.68 1fui h GLY 537 Ca 0.15 -0.49 0.04 0.00 0.00 0.00 0.00 47.33 47.02 1fui h GLY 537 CO 0.41 0.42 0.58 0.00 0.00 0.00 0.00 176.54 177.94 1fui h ALA 538 N 1.41 1.47 -0.38 3.60 0.00 -1.88 -0.20 119.26 123.27 1fui h ALA 538 Ca 0.40 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.18 1fui h ALA 538 Cb 0.02 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 1fui h ALA 538 CO -0.13 0.43 -0.10 -0.44 0.00 0.00 0.00 179.25 179.02 1fui h ASP 539 N 1.07 0.75 -0.82 0.00 3.32 -1.77 -2.15 116.42 116.84 1fui h ASP 539 Ca 0.35 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 57.01 1fui h ASP 539 Cb 0.06 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 1fui h ASP 539 CO -0.11 0.95 0.38 -0.26 -1.72 0.00 0.00 179.24 178.48 1fui h PHE 540 N 0.55 1.19 -0.66 4.55 0.04 -0.95 -0.69 116.94 120.97 1fui h PHE 540 Ca 0.10 -0.06 -0.07 0.00 2.80 0.00 0.00 57.97 60.73 1fui h PHE 540 Cb 0.62 -0.37 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 1fui h PHE 540 CO 0.05 0.86 0.12 0.82 -0.60 0.00 0.00 178.31 179.56 1fui h ILE 541 N 1.16 1.26 -0.24 -0.55 2.04 -0.96 0.37 117.51 120.58 1fui h ILE 541 Ca 0.28 -1.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.05 1fui h ILE 541 Cb 0.13 0.62 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 1fui h ILE 541 CO -0.03 0.38 -0.16 0.74 0.00 0.00 0.00 178.15 179.07 1fui h THR 542 N 1.01 1.31 -0.78 -0.27 2.02 -1.01 -2.31 112.91 112.88 1fui h THR 542 Ca 0.20 -1.28 -0.01 0.00 0.77 0.00 0.00 66.41 66.09 1fui h THR 542 Cb 0.41 1.61 -0.04 0.00 -1.74 0.00 0.00 68.15 68.40 1fui h THR 542 CO 0.01 0.40 0.43 0.25 0.37 0.00 0.00 175.52 176.98 1fui h LEU 543 N 0.25 0.97 -0.76 2.58 5.85 -0.95 -2.45 115.31 120.80 1fui h LEU 543 Ca 0.05 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.61 1fui h LEU 543 Cb 0.69 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.44 1fui h LEU 543 CO 0.04 0.79 0.16 0.00 -0.34 0.00 0.00 178.44 179.09 1fui h ALA 544 N 1.22 0.98 -0.22 1.25 0.00 -0.83 -2.01 119.26 119.66 1fui h ALA 544 Ca 0.27 -0.25 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1fui h ALA 544 Cb 0.03 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 1fui h ALA 544 CO -0.04 0.66 -0.11 0.66 0.00 0.00 0.00 179.25 180.41 1fui h SER 545 N 1.05 0.34 0.53 0.00 4.64 -1.06 0.21 113.55 119.26 1fui h SER 545 Ca 0.22 -0.08 -0.08 0.00 -0.47 0.00 0.00 61.79 61.38 1fui h SER 545 Cb 0.37 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1fui h SER 545 CO 0.00 0.49 -0.38 0.24 -0.87 0.00 0.00 176.83 176.32 1fui h MET 546 N 0.34 0.00 -0.02 4.77 2.07 -0.92 -2.84 114.93 118.32 1fui h MET 546 Ca 0.07 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.70 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 0.02 0.38 -0.24 1.28 1.07 0.00 0.00 176.91 179.42 1fui n LEU 547 N -3.85 2.18 -3.59 1.22 4.77 -0.86 -4.88 117.00 111.99 1fui n LEU 547 Ca -0.01 -0.75 -0.22 0.00 -0.03 0.00 0.00 56.01 55.00 1fui n LEU 547 Cb 0.44 -0.02 0.07 0.00 -2.33 0.00 0.00 43.42 41.59 1fui n LEU 547 CO 0.38 0.38 0.15 0.54 -1.33 0.00 0.00 177.39 177.51 1fui n ARG 548 N 0.39 -6.89 -3.80 3.23 3.00 0.60 -4.49 116.66 108.71 1fui n ARG 548 Ca 0.12 0.78 -0.37 0.00 -0.01 0.00 0.00 57.85 58.38 1fui n ARG 548 Cb 0.49 -5.75 -0.13 0.00 0.00 0.00 0.00 32.46 27.06 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 -3.37 3.83 0.45 0.55 1.01 -0.35 -4.82 121.20 118.49 1fui s ILE 549 Ca 0.33 -0.64 -0.25 0.00 0.00 0.00 0.00 60.65 60.09 1fui s ILE 549 Cb -0.15 -2.93 -0.08 0.00 0.01 0.00 0.00 42.46 39.32 1fui s ILE 549 CO 0.75 0.16 1.34 -2.84 0.00 0.00 0.00 174.94 174.35 1fui s PRO 550 N 1.49 3.73 -0.52 2.79 0.02 -1.26 -4.48 135.00 136.78 1fui s PRO 550 Ca 0.03 2.22 -0.17 0.00 0.02 0.00 0.00 61.00 63.11 1fui s PRO 550 Cb -0.17 -2.62 0.09 0.00 0.02 0.00 0.00 34.50 31.82 1fui s PRO 550 CO 0.01 -0.71 0.52 0.08 -0.33 0.00 0.00 177.00 176.58 1fui s VAL 551 N -1.27 5.09 -0.66 3.83 1.01 -1.26 -0.74 120.40 126.40 1fui s VAL 551 Ca 0.61 -1.06 0.26 0.00 0.00 0.00 0.00 61.98 61.79 1fui s VAL 551 Cb -0.39 -4.28 0.29 0.00 0.00 0.00 0.00 36.38 31.99 1fui s VAL 551 CO 0.50 -0.80 1.76 0.00 0.00 0.00 0.00 175.10 176.56 1fui s MET 553 N -3.15 0.69 0.03 0.00 -2.45 -1.24 -5.06 119.30 108.12 1fui s MET 553 Ca 0.09 1.13 -0.28 0.00 -1.25 0.00 0.00 55.69 55.38 1fui s MET 553 Cb 0.11 0.17 0.10 0.00 1.25 0.00 0.00 34.83 36.46 1fui s MET 553 CO 0.58 -0.14 0.88 -3.38 1.05 0.00 0.00 175.02 174.01 1fui s HIS 554 N 1.36 -0.33 -0.17 4.11 -3.43 -1.25 -0.86 115.29 114.72 1fui s HIS 554 Ca -0.08 0.17 0.14 0.00 -0.80 0.00 0.00 55.06 54.48 1fui s HIS 554 Cb -0.05 0.55 0.42 0.00 -1.43 0.00 0.00 32.58 32.07 1fui s HIS 554 CO -0.15 -0.60 1.21 0.27 -2.00 0.00 0.00 174.74 173.47 1fui n ASN 555 N -0.28 1.62 -4.81 7.38 6.94 -1.26 -5.00 115.26 119.86 1fui n ASN 555 Ca -0.09 -3.56 -0.37 0.00 -0.02 0.00 0.00 54.58 50.54 1fui n ASN 555 Cb 0.62 -0.49 -0.06 0.00 -2.36 0.00 0.00 39.78 37.49 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 -2.68 4.54 0.26 3.53 1.01 -1.26 -4.90 120.40 120.90 1fui s VAL 556 Ca 0.37 1.38 -0.31 0.00 0.00 0.00 0.00 61.98 63.42 1fui s VAL 556 Cb 0.37 -3.93 -0.11 0.00 0.00 0.00 0.00 36.38 32.71 1fui s VAL 556 CO -0.09 0.32 1.62 -1.61 0.00 0.00 0.00 175.10 175.34 1fui s GLU 557 N -1.68 4.14 0.44 2.72 2.02 -1.26 -4.89 118.70 120.18 1fui s GLU 557 Ca 0.40 2.56 0.20 0.00 0.02 0.00 0.00 54.97 58.14 1fui s GLU 557 Cb -0.18 -3.05 1.16 0.00 0.10 0.00 0.00 34.13 32.15 1fui s GLU 557 CO 0.22 -0.65 1.86 1.49 0.02 0.00 0.00 175.26 178.20 1fui h GLU 558 N 5.54 0.32 0.00 1.61 4.81 -1.98 0.18 114.58 125.05 1fui h GLU 558 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1fui h GLU 558 Cb 1.21 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1fui h GLU 558 CO 0.85 0.21 0.00 1.79 -0.73 0.00 0.00 179.01 181.13 1fui h THR 559 N 0.33 0.00 -0.01 0.32 1.35 -2.05 -2.87 112.91 109.99 1fui h THR 559 Ca 0.46 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.92 1fui h THR 559 Cb 1.27 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 1fui h THR 559 CO -0.15 0.00 -0.31 0.29 -0.25 0.00 0.00 175.52 175.09 1fui n LYS 560 N -2.69 0.83 -2.63 4.72 5.02 0.62 -4.88 118.16 119.15 1fui n LYS 560 Ca 0.02 -0.52 -0.43 0.00 -2.02 0.00 0.00 58.31 55.35 1fui n LYS 560 Cb 0.29 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.78 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 -2.54 4.65 -0.20 -0.18 -7.23 -1.08 -4.84 120.40 108.97 1fui s VAL 561 Ca 0.22 1.96 0.01 0.00 -1.81 0.00 0.00 61.98 62.36 1fui s VAL 561 Cb 0.19 -4.26 0.04 0.00 0.56 0.00 0.00 36.38 32.91 1fui s VAL 561 CO 0.54 -0.09 -0.10 -0.47 -0.31 0.00 0.00 175.10 174.67 1fui s TYR 562 N 2.67 2.48 0.28 2.82 5.04 -1.26 -5.09 117.35 124.29 1fui s TYR 562 Ca 0.48 -1.65 0.03 0.00 -2.44 0.00 0.00 57.07 53.48 1fui s TYR 562 Cb -0.18 -1.66 -0.04 0.00 0.35 0.00 0.00 41.96 40.43 1fui s TYR 562 CO 0.13 -0.76 0.18 1.03 -1.34 0.00 0.00 175.55 174.79 1fui s ARG 563 N 1.37 1.52 0.59 4.97 0.52 -1.26 -4.18 118.95 122.48 1fui s ARG 563 Ca -0.02 -1.86 -0.20 0.00 -0.52 0.00 0.00 55.73 53.14 1fui s ARG 563 Cb -0.16 0.08 -0.04 0.00 0.52 0.00 0.00 34.95 35.35 1fui s ARG 563 CO -0.08 -0.47 1.18 -2.30 0.02 0.00 0.00 175.30 173.65 1fui n PRO 564 N -0.51 1.21 0.21 3.54 -0.02 -1.26 -4.64 135.00 133.53 1fui n PRO 564 Ca 0.03 0.46 0.15 0.00 -2.02 0.00 0.00 63.50 62.12 1fui n PRO 564 Cb 0.65 -2.39 0.79 0.00 -0.02 0.00 0.00 33.50 32.52 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 0.82 0.00 0.26 2.55 4.64 -1.31 -1.76 113.55 118.74 1fui h SER 565 Ca -0.50 0.00 -0.00 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 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 176.49 1fui h ALA 566 N 1.85 1.05 -0.61 5.18 0.00 -1.88 -2.24 119.26 122.60 1fui h ALA 566 Ca 0.08 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 1fui h ALA 566 Cb 0.37 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1fui h ALA 566 CO -0.00 0.01 0.29 -1.49 0.00 0.00 0.00 179.25 178.06 1fui h TRP 567 N 0.00 0.86 -0.14 0.00 -0.00 -1.66 -2.50 115.95 112.51 1fui h TRP 567 Ca -0.00 -0.03 -0.02 0.00 -0.00 0.00 0.00 58.89 58.84 1fui h TRP 567 Cb 0.14 -0.27 -0.01 0.00 -0.00 0.00 0.00 29.16 29.02 1fui h TRP 567 CO 0.00 0.63 -0.02 0.00 -0.00 0.00 0.00 178.44 179.05 1fui h ALA 568 N 1.45 1.71 0.00 1.49 0.00 -1.61 -0.61 119.26 121.69 1fui h ALA 568 Ca 0.21 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1fui h ALA 568 Cb 0.10 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1fui h ALA 568 CO -0.03 0.22 0.00 0.00 0.00 0.00 0.00 179.25 179.44 1fui h ALA 569 N 1.79 1.00 -0.26 0.00 0.00 -1.59 -1.61 119.26 118.59 1fui h ALA 569 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1fui h ALA 569 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1fui h ALA 569 CO 0.01 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.98 1fui n HIS 570 N -2.90 0.33 0.00 0.00 -0.00 -0.24 -5.01 115.22 107.41 1fui n HIS 570 Ca -0.00 -0.17 0.00 0.00 -0.00 0.00 0.00 57.72 57.55 1fui n HIS 570 Cb 0.23 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.22 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 1.12 3.93 0.13 -1.41 0.00 -0.61 -3.92 105.19 104.43 1fui n GLY 571 Ca 0.15 -1.66 0.01 0.00 0.00 0.00 0.00 46.02 44.51 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 -6.39 1.61 0.00 -1.91 -3.41 114.93 104.83 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 0.60 0.89 0.34 0.00 0.00 0.00 176.91 178.74 1fui s ASP 573 N -6.51 6.78 0.44 1.22 2.15 -1.26 -4.91 116.67 114.57 1fui s ASP 573 Ca 0.03 2.21 0.11 0.00 0.43 0.00 0.00 52.55 55.33 1fui s ASP 573 Cb 0.08 -2.56 1.00 0.00 -0.30 0.00 0.00 42.92 41.14 1fui s ASP 573 CO 0.76 -0.77 2.06 0.40 -0.17 0.00 0.00 175.17 177.45 1fui h ILE 574 N 4.92 1.03 0.05 4.11 1.08 -2.00 -1.04 117.51 125.68 1fui h ILE 574 Ca -0.39 -0.13 -0.24 0.00 -0.39 0.00 0.00 64.86 63.71 1fui h ILE 574 Cb 1.18 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 35.53 1fui h ILE 574 CO 0.91 0.07 -1.26 -0.08 -0.69 0.00 0.00 178.15 177.10 1fui h GLU 575 N 0.39 0.11 -0.77 2.37 4.81 -1.95 -3.32 114.58 116.23 1fui h GLU 575 Ca 0.14 -0.20 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1fui h GLU 575 Cb 0.09 0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.50 1fui h GLU 575 CO -0.03 1.09 0.50 0.78 -0.73 0.00 0.00 179.01 180.62 1fui h GLY 576 N -0.39 1.10 1.39 1.92 0.00 -1.91 -1.29 103.07 103.90 1fui h GLY 576 Ca -0.30 -0.38 -0.01 0.00 0.00 0.00 0.00 47.33 46.64 1fui h GLY 576 CO -0.06 0.34 0.32 0.06 0.00 0.00 0.00 176.54 177.20 1fui h GLN 577 N 0.98 0.80 0.05 4.80 3.07 -1.30 -1.76 115.11 121.75 1fui h GLN 577 Ca 0.30 -0.08 -0.00 0.00 0.09 0.00 0.00 58.65 58.96 1fui h GLN 577 Cb -0.02 -0.16 0.00 0.00 0.08 0.00 0.00 27.48 27.37 1fui h GLN 577 CO -0.10 0.58 -0.02 0.22 0.09 0.00 0.00 178.83 179.60 1fui h ASP 578 N 0.81 -0.05 -0.73 0.06 3.58 -1.36 -0.39 116.42 118.34 1fui h ASP 578 Ca 0.21 -0.40 -0.06 0.00 0.42 0.00 0.00 57.03 57.20 1fui h ASP 578 Cb 0.01 0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.05 1fui h ASP 578 CO -0.04 0.38 0.23 1.88 -2.88 0.00 0.00 179.24 178.81 1fui h TYR 579 N -0.50 1.18 -0.28 0.28 -1.99 -1.31 -0.60 116.97 113.75 1fui h TYR 579 Ca -0.01 -0.12 -0.04 0.00 2.00 0.00 0.00 58.73 60.57 1fui h TYR 579 Cb 0.45 -0.34 -0.01 0.00 2.00 0.00 0.00 36.73 38.83 1fui h TYR 579 CO 0.07 0.93 0.02 0.00 -0.00 0.00 0.00 178.16 179.18 1fui h ARG 580 N 1.09 0.48 -0.11 4.88 3.08 -1.31 -2.29 114.38 120.21 1fui h ARG 580 Ca 0.24 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 60.13 1fui h ARG 580 Cb 0.30 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.30 1fui h ARG 580 CO -0.01 0.62 0.02 0.00 -1.07 0.00 0.00 179.97 179.52 1fui h ALA 581 N 0.85 0.14 -0.53 0.04 0.00 -0.96 -1.80 119.26 117.01 1fui h ALA 581 Ca 0.08 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1fui h ALA 581 Cb 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 1fui h ALA 581 CO 0.01 -0.21 0.34 0.00 0.00 0.00 0.00 179.25 179.39 1fui h GLN 583 N 0.72 0.08 0.45 0.00 4.15 -1.29 -1.32 115.11 117.90 1fui h GLN 583 Ca 0.19 -0.06 -0.02 0.00 0.77 0.00 0.00 58.65 59.53 1fui h GLN 583 Cb -0.07 0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.63 1fui h GLN 583 CO -0.04 0.68 -0.21 -0.97 -1.93 0.00 0.00 178.83 176.35 1fui h ASN 584 N 0.06 -0.51 -0.04 -0.69 -1.24 -0.29 -3.37 115.58 109.50 1fui h ASN 584 Ca -0.01 0.02 -0.16 0.00 0.71 0.00 0.00 56.30 56.86 1fui h ASN 584 Cb 1.12 0.13 -0.01 0.00 0.73 0.00 0.00 38.32 40.29 1fui h ASN 584 CO 0.09 -0.16 -0.51 1.88 -1.29 0.00 0.00 177.43 177.44 1fui h TYR 585 N -1.01 0.76 -0.76 0.67 0.05 -1.23 -3.50 116.97 111.95 1fui h TYR 585 Ca -0.06 -0.25 0.05 0.00 0.05 0.00 0.00 58.73 58.52 1fui h TYR 585 Cb 0.46 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.04 1fui h TYR 585 CO 0.02 0.99 -0.07 0.41 -1.05 0.00 0.00 178.16 178.46 1fui n GLY 586 N 0.20 -1.94 3.75 3.88 0.00 -0.50 -4.85 105.19 105.73 1fui n GLY 586 Ca -0.03 -1.36 -0.38 0.00 0.00 0.00 0.00 46.02 44.26 1fui n GLY 586 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fui s PRO 587 N -0.62 3.17 0.17 1.61 0.04 -1.26 -4.71 135.00 133.40 1fui s PRO 587 Ca 0.00 2.10 -0.14 0.00 0.04 0.00 0.00 61.00 63.00 1fui s PRO 587 Cb 0.00 -2.21 0.07 0.00 0.04 0.00 0.00 34.50 32.40 1fui s PRO 587 CO 0.00 -1.13 1.79 1.25 0.04 0.00 0.00 177.00 178.96 1fui h LEU 588 N 1.41 0.67 0.00 -3.56 5.85 -1.78 -3.35 115.31 114.54 1fui h LEU 588 Ca -0.51 -0.07 -0.25 0.00 0.84 0.00 0.00 57.88 57.89 1fui h LEU 588 Cb 1.29 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 42.11 1fui h LEU 588 CO 0.57 0.55 -1.70 -1.22 -0.34 0.00 0.00 178.44 176.30 1fui n TYR 589 N -4.64 0.85 -3.57 1.25 4.01 -0.59 -4.86 117.16 109.61 1fui n TYR 589 Ca 0.03 0.30 -0.09 0.00 -0.16 0.00 0.00 57.90 57.98 1fui n TYR 589 Cb 0.07 -1.12 -0.04 0.00 -0.31 0.00 0.00 39.34 37.94 1fui n TYR 589 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 1fui s LYS 590 N -2.71 0.55 0.00 -0.72 -2.85 -1.24 -5.01 119.74 107.76 1fui s LYS 590 Ca -0.05 0.04 0.00 0.00 -1.00 0.00 0.00 55.97 54.96 1fui s LYS 590 Cb 0.08 0.26 0.00 0.00 -2.06 0.00 0.00 37.83 36.11 1fui s LYS 590 CO 0.82 -0.19 0.00 -2.13 0.10 0.00 0.00 175.35 173.95