#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 -2.52 -2.76 0.03 5.02 -1.26 -4.76 118.16 111.92 1fui n LYS 2 Ca 0.00 1.99 -0.17 0.00 -2.02 0.00 0.00 58.31 58.11 1fui n LYS 2 Cb 0.00 -2.62 -0.00 0.00 -0.02 0.00 0.00 35.03 32.39 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 -2.77 -2.85 -1.41 1.97 4.01 -1.26 -4.74 118.16 111.12 1fui n LYS 3 Ca -0.03 0.64 -0.22 0.00 -0.51 0.00 0.00 58.31 58.19 1fui n LYS 3 Cb 0.37 -5.31 -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 -3.73 0.24 -2.75 -0.18 -0.00 -1.26 -4.33 119.36 107.35 1fui n ILE 4 Ca -0.11 -0.24 -0.09 0.00 -0.00 0.00 0.00 62.75 62.30 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 17.10 -5.01 -4.78 7.28 7.64 -1.26 -4.91 113.62 129.68 1fui n SER 5 Ca 0.43 0.20 -0.36 0.00 1.01 0.00 0.00 58.87 60.15 1fui n SER 5 Cb 0.46 -1.26 -0.02 0.00 -1.01 0.00 0.00 64.21 62.38 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 -1.11 3.95 0.60 -3.43 1.43 -1.26 -4.99 118.68 113.86 1fui s LEU 6 Ca 0.08 2.16 -0.18 0.00 -1.03 0.00 0.00 54.13 55.16 1fui s LEU 6 Cb -0.01 -4.36 -0.03 0.00 0.03 0.00 0.00 46.19 41.82 1fui s LEU 6 CO 0.19 -0.88 1.15 -2.16 0.23 0.00 0.00 176.35 174.88 1fui s PRO 7 N -2.88 3.04 0.30 1.29 0.04 -1.26 -4.98 135.00 130.55 1fui s PRO 7 Ca 0.65 1.63 0.09 0.00 0.04 0.00 0.00 61.00 63.42 1fui s PRO 7 Cb -0.24 -1.96 -0.05 0.00 0.04 0.00 0.00 34.50 32.29 1fui s PRO 7 CO 0.29 -1.10 -0.00 0.15 0.04 0.00 0.00 177.00 176.38 1fui s LYS 8 N -3.52 2.17 -0.21 4.56 1.02 -0.53 -4.72 119.74 118.50 1fui s LYS 8 Ca 0.73 -1.58 -0.10 0.00 0.02 0.00 0.00 55.97 55.05 1fui s LYS 8 Cb -0.25 -2.05 -0.05 0.00 -0.52 0.00 0.00 37.83 34.96 1fui s LYS 8 CO 0.33 0.26 0.13 0.42 -0.92 0.00 0.00 175.35 175.56 1fui s ILE 9 N -2.42 5.22 -0.16 2.17 1.01 -0.77 -0.27 121.20 125.98 1fui s ILE 9 Ca 0.33 0.12 -0.13 0.00 0.00 0.00 0.00 60.65 60.98 1fui s ILE 9 Cb -0.04 -3.40 -0.05 0.00 0.01 0.00 0.00 42.46 38.99 1fui s ILE 9 CO 0.20 0.40 0.27 -0.83 0.00 0.00 0.00 174.94 174.98 1fui s GLY 10 N 0.69 2.20 -0.20 6.18 0.00 -0.01 -0.53 107.32 115.65 1fui s GLY 10 Ca 0.07 -0.48 -0.03 0.00 0.00 0.00 0.00 44.72 44.27 1fui s GLY 10 CO 0.01 0.34 -0.05 -0.42 0.00 0.00 0.00 173.10 172.98 1fui s ILE 11 N 0.31 3.41 -0.40 0.90 1.01 0.96 -1.08 121.20 126.31 1fui s ILE 11 Ca 0.16 -0.49 -0.04 0.00 0.00 0.00 0.00 60.65 60.27 1fui s ILE 11 Cb -0.13 -2.53 0.10 0.00 0.01 0.00 0.00 42.46 39.92 1fui s ILE 11 CO 0.03 0.44 0.20 -0.13 0.00 0.00 0.00 174.94 175.49 1fui s ARG 12 N 1.19 2.13 -0.30 2.79 0.52 -0.13 -2.27 118.95 122.88 1fui s ARG 12 Ca 0.02 -1.73 -0.28 0.00 -0.52 0.00 0.00 55.73 53.22 1fui s ARG 12 Cb -0.14 -3.59 0.01 0.00 0.52 0.00 0.00 34.95 31.75 1fui s ARG 12 CO -0.01 -1.03 1.04 -1.25 0.02 0.00 0.00 175.30 174.07 1fui s PRO 13 N 1.19 4.09 -0.01 3.54 0.04 -1.26 -0.95 135.00 141.64 1fui s PRO 13 Ca 0.06 1.07 -0.00 0.00 0.04 0.00 0.00 61.00 62.17 1fui s PRO 13 Cb -0.23 -3.72 -0.04 0.00 0.04 0.00 0.00 34.50 30.55 1fui s PRO 13 CO -0.03 -0.84 0.06 0.08 0.04 0.00 0.00 177.00 176.31 1fui s VAL 14 N 3.52 4.60 0.10 -0.36 1.01 -0.48 -0.17 120.40 128.62 1fui s VAL 14 Ca 0.44 -0.44 -0.11 0.00 0.00 0.00 0.00 61.98 61.87 1fui s VAL 14 Cb -0.13 -3.09 0.01 0.00 0.00 0.00 0.00 36.38 33.18 1fui s VAL 14 CO 0.14 0.36 0.26 -0.51 0.00 0.00 0.00 175.10 175.35 1fui s ILE 15 N -1.16 0.12 0.19 2.22 2.07 0.65 -4.59 121.20 120.70 1fui s ILE 15 Ca 0.22 -0.98 -0.31 0.00 -1.41 0.00 0.00 60.65 58.17 1fui s ILE 15 Cb -0.12 -1.26 -0.11 0.00 0.13 0.00 0.00 42.46 41.10 1fui s ILE 15 CO 0.13 -0.54 1.59 -0.62 -1.91 0.00 0.00 174.94 173.58 1fui s ASP 16 N -2.80 6.54 0.44 4.50 -1.08 -1.20 -4.21 116.67 118.86 1fui s ASP 16 Ca 0.04 2.69 0.25 0.00 -0.52 0.00 0.00 52.55 55.01 1fui s ASP 16 Cb 0.04 -2.60 0.52 0.00 -1.46 0.00 0.00 42.92 39.42 1fui s ASP 16 CO -0.11 -0.85 1.68 1.23 0.52 0.00 0.00 175.17 177.64 1fui h GLY 17 N 6.49 0.00 -4.25 2.66 0.00 -1.88 -3.40 103.07 102.70 1fui h GLY 17 Ca -0.43 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.37 1fui h GLY 17 CO 0.90 0.00 0.62 1.09 0.00 0.00 0.00 176.54 179.15 1fui s ARG 18 N -3.27 4.42 0.00 4.80 1.70 -1.26 -4.86 118.95 120.47 1fui s ARG 18 Ca 0.06 1.98 0.00 0.00 -0.47 0.00 0.00 55.73 57.30 1fui s ARG 18 Cb 0.06 -3.22 0.00 0.00 -0.57 0.00 0.00 34.95 31.22 1fui s ARG 18 CO 0.64 -0.21 0.00 0.54 -1.08 0.00 0.00 175.30 175.19 1fui n ARG 19 N 2.75 3.50 -1.67 3.89 5.12 -1.26 -0.91 116.66 128.08 1fui n ARG 19 Ca 0.06 0.00 -0.16 0.00 -1.93 0.00 0.00 57.85 55.82 1fui n ARG 19 Cb 0.44 0.00 -0.05 0.00 -1.16 0.00 0.00 32.46 31.68 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 -1.16 0.00 5.56 1.56 -1.26 -3.10 117.12 118.71 1fui n MET 20 Ca 0.00 1.00 0.00 0.00 -0.27 0.00 0.00 57.70 58.43 1fui n MET 20 Cb 0.00 -5.24 0.00 0.00 2.15 0.00 0.00 33.22 30.13 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 -1.00 3.38 0.00 -5.12 0.00 -1.26 -5.02 105.19 96.17 1fui n GLY 21 Ca -0.17 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1fui n GLY 21 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1fui n VAL 22 N 0.00 0.00 -0.24 1.61 0.31 -1.18 -1.71 118.33 117.12 1fui n VAL 22 Ca 0.00 1.20 0.04 0.00 -0.01 0.00 0.00 64.34 65.57 1fui n VAL 22 Cb 0.00 -1.94 0.17 0.00 -0.91 0.00 0.00 33.84 31.15 1fui n VAL 22 CO 0.00 0.00 0.00 -0.09 -1.32 0.00 0.00 176.83 175.42 1fui h ARG 23 N 0.00 0.40 -0.20 5.55 2.43 -1.24 -1.95 114.38 119.37 1fui h ARG 23 Ca 0.00 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1fui h ARG 23 Cb 0.00 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 1fui h ARG 23 CO 0.00 0.26 0.02 1.05 -1.51 0.00 0.00 179.97 179.80 1fui h GLU 24 N 0.41 0.29 0.00 0.20 9.09 -1.82 -1.48 114.58 121.28 1fui h GLU 24 Ca 0.39 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.76 1fui h GLU 24 Cb 0.58 -0.05 0.00 0.00 -1.65 0.00 0.00 28.75 27.62 1fui h GLU 24 CO -0.39 0.29 0.00 0.66 0.05 0.00 0.00 179.01 179.62 1fui h SER 25 N 0.28 0.00 0.02 3.06 4.64 -0.52 -3.28 113.55 117.75 1fui h SER 25 Ca 0.07 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.35 1fui h SER 25 Cb 0.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1fui h SER 25 CO 0.00 0.00 -2.02 0.18 -0.87 0.00 0.00 176.83 174.12 1fui n LEU 26 N -2.33 0.02 -0.23 5.97 4.32 -0.75 -4.66 117.00 119.34 1fui n LEU 26 Ca 0.05 0.01 -0.01 0.00 -0.02 0.00 0.00 56.01 56.04 1fui n LEU 26 Cb 0.43 0.05 0.06 0.00 -1.62 0.00 0.00 43.42 42.34 1fui n LEU 26 CO 0.30 0.05 0.70 -0.33 -1.22 0.00 0.00 177.39 176.89 1fui h GLU 27 N 0.00 -0.04 -0.13 3.23 4.39 -1.36 -1.61 114.58 119.06 1fui h GLU 27 Ca -0.06 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.63 1fui h GLU 27 Cb 1.13 0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 29.78 1fui h GLU 27 CO 0.00 -0.02 0.02 1.49 -1.16 0.00 0.00 179.01 179.34 1fui h GLU 28 N -0.04 0.21 -0.85 2.33 4.81 -1.83 -2.51 114.58 116.71 1fui h GLU 28 Ca 0.31 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.46 1fui h GLU 28 Cb 0.52 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 1fui h GLU 28 CO -0.72 0.40 0.42 0.37 -0.73 0.00 0.00 179.01 178.76 1fui h GLN 29 N -0.01 1.21 -0.32 1.92 4.15 -1.79 -1.03 115.11 119.24 1fui h GLN 29 Ca 0.04 -0.17 -0.02 0.00 0.77 0.00 0.00 58.65 59.27 1fui h GLN 29 Cb 0.29 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 1fui h GLN 29 CO 0.00 0.92 0.13 1.15 -1.93 0.00 0.00 178.83 179.10 1fui h THR 30 N 1.21 1.18 -0.08 2.39 2.02 -1.28 -1.68 112.91 116.67 1fui h THR 30 Ca 0.29 -0.57 -0.10 0.00 0.77 0.00 0.00 66.41 66.81 1fui h THR 30 Cb 0.09 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.45 1fui h THR 30 CO -0.04 0.20 -0.40 0.24 0.37 0.00 0.00 175.52 175.89 1fui h MET 31 N 0.38 0.18 -0.64 6.66 2.86 -1.27 -2.26 114.93 120.83 1fui h MET 31 Ca 0.11 -0.08 -0.07 0.00 -2.06 0.00 0.00 59.70 57.59 1fui h MET 31 Cb 0.19 -0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 1fui h MET 31 CO -0.01 0.55 0.11 -0.91 1.06 0.00 0.00 176.91 177.71 1fui h ASN 32 N 0.15 1.01 -0.36 1.22 2.35 -0.94 0.63 115.58 119.64 1fui h ASN 32 Ca 0.01 -0.26 0.03 0.00 -0.55 0.00 0.00 56.30 55.53 1fui h ASN 32 Cb 0.77 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.84 1fui h ASN 32 CO 0.06 1.01 0.18 -0.03 -1.65 0.00 0.00 177.43 177.00 1fui h MET 33 N 0.97 0.36 -0.57 0.81 4.05 -0.98 0.38 114.93 119.95 1fui h MET 33 Ca 0.19 -0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.59 1fui h MET 33 Cb 0.43 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.12 1fui h MET 33 CO 0.01 0.24 0.36 0.00 0.23 0.00 0.00 176.91 177.75 1fui h ALA 34 N 1.19 0.73 -0.44 0.39 0.00 -0.94 -0.85 119.26 119.35 1fui h ALA 34 Ca 0.15 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1fui h ALA 34 Cb 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1fui h ALA 34 CO -0.11 0.20 -0.19 0.87 0.00 0.00 0.00 179.25 180.02 1fui h LYS 35 N 0.77 0.91 -0.62 0.00 1.57 -0.40 -1.83 116.57 116.98 1fui h LYS 35 Ca 0.21 -0.39 -0.03 0.00 -1.87 0.00 0.00 60.65 58.57 1fui h LYS 35 Cb -0.04 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 1fui h LYS 35 CO -0.04 1.04 0.26 0.00 -0.57 0.00 0.00 179.45 180.14 1fui h ALA 36 N 0.84 1.29 -0.19 3.86 0.00 0.12 0.09 119.26 125.27 1fui h ALA 36 Ca 0.10 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1fui h ALA 36 Cb 0.75 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1fui h ALA 36 CO 0.06 0.53 -0.03 1.15 0.00 0.00 0.00 179.25 180.96 1fui h THR 37 N 0.88 1.28 -0.61 0.00 2.02 -1.00 -1.99 112.91 113.48 1fui h THR 37 Ca 0.21 -0.97 -0.03 0.00 0.77 0.00 0.00 66.41 66.40 1fui h THR 37 Cb 0.15 1.53 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 1fui h THR 37 CO -0.02 0.29 0.28 0.00 0.37 0.00 0.00 175.52 176.44 1fui h ALA 38 N 0.75 0.79 -0.27 6.16 0.00 -0.95 -2.08 119.26 123.67 1fui h ALA 38 Ca 0.05 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.82 1fui h ALA 38 Cb 0.46 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1fui h ALA 38 CO 0.02 0.37 0.16 0.00 0.00 0.00 0.00 179.25 179.80 1fui h ALA 39 N 1.12 0.33 -0.19 0.00 0.00 -0.92 -1.76 119.26 117.84 1fui h ALA 39 Ca 0.21 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1fui h ALA 39 Cb 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 1fui h ALA 39 CO -0.02 -0.22 0.09 1.25 0.00 0.00 0.00 179.25 180.34 1fui h LEU 40 N 0.33 0.12 -0.00 0.00 5.85 -1.17 -2.18 115.31 118.25 1fui h LEU 40 Ca 0.10 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 1fui h LEU 40 Cb -0.01 -0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.01 1fui h LEU 40 CO -0.04 0.10 0.00 -0.07 -0.34 0.00 0.00 178.44 178.09 1fui h LEU 41 N 0.19 0.01 -1.72 2.25 3.38 -1.13 -0.20 115.31 118.09 1fui h LEU 41 Ca 0.08 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1fui h LEU 41 Cb 0.03 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 1fui h LEU 41 CO -0.07 0.08 -0.16 0.71 0.09 0.00 0.00 178.44 179.09 1fui h THR 42 N -0.07 0.68 0.18 0.22 1.35 -1.32 0.20 112.91 114.14 1fui h THR 42 Ca 0.00 -0.70 -0.29 0.00 -0.55 0.00 0.00 66.41 64.88 1fui h THR 42 Cb 0.08 1.44 0.02 0.00 -1.73 0.00 0.00 68.15 67.95 1fui h THR 42 CO -0.00 0.16 -1.36 -0.08 -0.25 0.00 0.00 175.52 173.99 1fui h GLU 43 N 0.00 0.38 0.00 4.72 4.81 -1.12 -3.39 114.58 119.98 1fui h GLU 43 Ca -0.00 -0.64 0.00 0.00 -0.13 0.00 0.00 59.36 58.58 1fui h GLU 43 Cb 0.42 0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.04 1fui h GLU 43 CO 0.02 1.31 -0.88 1.63 -0.73 0.00 0.00 179.01 180.36 1fui n LYS 44 N -3.84 0.25 -4.22 1.92 4.76 -0.11 -4.97 118.16 111.94 1fui n LYS 44 Ca -0.20 0.02 -0.29 0.00 -2.87 0.00 0.00 58.31 54.97 1fui n LYS 44 Cb 0.98 -1.60 -0.09 0.00 -1.84 0.00 0.00 35.03 32.47 1fui n LYS 44 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1fui s LEU 45 N -3.86 3.11 0.01 -0.35 1.43 0.05 -5.07 118.68 113.99 1fui s LEU 45 Ca 0.05 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 52.75 1fui s LEU 45 Cb 0.15 -1.86 -0.01 0.00 0.03 0.00 0.00 46.19 44.49 1fui s LEU 45 CO 0.77 0.16 -0.00 -0.13 0.23 0.00 0.00 176.35 177.38 1fui s ARG 46 N -2.39 0.19 0.65 1.70 1.81 -1.26 -3.87 118.95 115.78 1fui s ARG 46 Ca 0.23 -0.32 -0.15 0.00 -1.72 0.00 0.00 55.73 53.77 1fui s ARG 46 Cb -0.11 0.07 -0.00 0.00 -0.45 0.00 0.00 34.95 34.46 1fui s ARG 46 CO 0.15 -0.03 1.12 -1.01 -0.68 0.00 0.00 175.30 174.85 1fui s HIS 47 N -0.80 2.58 0.61 -0.53 3.76 0.54 -4.89 115.29 116.56 1fui s HIS 47 Ca -0.09 1.55 0.32 0.00 -0.15 0.00 0.00 55.06 56.70 1fui s HIS 47 Cb -0.05 -3.21 1.86 0.00 1.11 0.00 0.00 32.58 32.29 1fui s HIS 47 CO -0.00 -1.75 2.18 0.00 -0.85 0.00 0.00 174.74 174.31 1fui h ALA 48 N 0.13 1.52 0.00 -1.40 0.00 -1.88 0.19 119.26 117.81 1fui h ALA 48 Ca -0.47 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1fui h ALA 48 Cb 1.25 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1fui h ALA 48 CO 0.54 -0.17 0.00 0.00 0.00 0.00 0.00 179.25 179.62 1fui n GLY 50 N 1.08 3.09 3.74 0.00 0.00 0.65 -4.91 105.19 108.85 1fui n GLY 50 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.76 2.26 0.54 4.61 0.00 -1.26 -4.67 121.76 120.49 1fui s ALA 51 Ca 0.00 0.68 -0.17 0.00 0.00 0.00 0.00 51.96 52.47 1fui s ALA 51 Cb 0.00 -3.39 -0.06 0.00 0.00 0.00 0.00 23.12 19.67 1fui s ALA 51 CO 0.00 -1.63 1.03 0.00 0.00 0.00 0.00 175.76 175.16 1fui s ALA 52 N -2.22 2.88 -0.03 0.00 0.00 -1.26 -0.34 121.76 120.79 1fui s ALA 52 Ca 0.70 0.35 -0.19 0.00 0.00 0.00 0.00 51.96 52.82 1fui s ALA 52 Cb -0.24 -3.19 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 1fui s ALA 52 CO 0.44 -0.50 0.53 0.08 0.00 0.00 0.00 175.76 176.31 1fui s VAL 53 N -2.43 4.99 -0.10 0.00 1.01 -1.25 -4.73 120.40 117.89 1fui s VAL 53 Ca 0.62 1.10 -0.03 0.00 0.00 0.00 0.00 61.98 63.67 1fui s VAL 53 Cb -0.14 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 1fui s VAL 53 CO 0.31 0.43 0.04 -1.61 0.00 0.00 0.00 175.10 174.27 1fui s GLU 54 N -0.17 3.18 0.00 2.72 2.02 -1.26 -4.44 118.70 120.75 1fui s GLU 54 Ca 0.28 -0.34 0.04 0.00 0.02 0.00 0.00 54.97 54.97 1fui s GLU 54 Cb -0.17 -2.92 -0.03 0.00 0.10 0.00 0.00 34.13 31.11 1fui s GLU 54 CO 0.15 0.68 -0.10 0.00 0.02 0.00 0.00 175.26 176.01 1fui s VAL 56 N -0.94 2.40 -0.00 0.00 1.01 0.31 -4.94 120.40 118.24 1fui s VAL 56 Ca 0.16 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.27 1fui s VAL 56 Cb -0.11 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.25 1fui s VAL 56 CO 0.06 0.53 0.05 -0.63 0.00 0.00 0.00 175.10 175.11 1fui s ILE 57 N 0.70 4.48 0.57 2.22 1.01 -1.26 -0.03 121.20 128.89 1fui s ILE 57 Ca -0.08 -0.49 -0.21 0.00 0.00 0.00 0.00 60.65 59.87 1fui s ILE 57 Cb -0.16 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.24 1fui s ILE 57 CO 0.01 0.36 1.26 -0.24 0.00 0.00 0.00 174.94 176.33 1fui n SER 58 N 1.28 2.16 0.11 3.58 2.88 -0.96 -4.90 113.62 117.77 1fui n SER 58 Ca -0.14 0.92 0.05 0.00 -1.33 0.00 0.00 58.87 58.37 1fui n SER 58 Cb 0.53 -1.53 0.48 0.00 -0.75 0.00 0.00 64.21 62.94 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 1.10 0.26 -5.07 -3.46 3.32 -1.95 -3.45 116.42 107.17 1fui h ASP 59 Ca -0.50 -0.02 -0.36 0.00 0.02 0.00 0.00 57.03 56.17 1fui h ASP 59 Cb 1.32 -0.06 -0.14 0.00 0.22 0.00 0.00 39.33 40.67 1fui h ASP 59 CO 0.55 0.25 -0.58 0.42 -1.72 0.00 0.00 179.24 178.17 1fui s THR 60 N -5.14 0.23 0.45 0.35 -4.23 -1.26 -5.14 115.64 100.91 1fui s THR 60 Ca -0.06 -2.00 -0.22 0.00 -1.18 0.00 0.00 61.69 58.23 1fui s THR 60 Cb 0.17 -2.53 -0.09 0.00 1.34 0.00 0.00 72.50 71.39 1fui s THR 60 CO 0.71 0.00 1.04 0.00 -0.54 0.00 0.00 174.62 175.83 1fui s ILE 62 N -1.87 5.05 0.00 0.00 1.01 0.77 -4.91 121.20 121.24 1fui s ILE 62 Ca 0.64 0.07 0.00 0.00 0.00 0.00 0.00 60.65 61.36 1fui s ILE 62 Cb -0.18 -3.36 0.00 0.00 0.01 0.00 0.00 42.46 38.93 1fui s ILE 62 CO 0.22 0.34 0.02 0.00 0.00 0.00 0.00 174.94 175.52 1fui n ALA 63 N 4.51 1.44 -3.00 9.38 0.00 -1.26 -0.26 120.51 131.33 1fui n ALA 63 Ca -0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 53.44 53.27 1fui n ALA 63 Cb 0.52 0.00 0.00 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 0.67 2.07 0.24 0.00 0.00 -1.26 -4.50 105.19 102.41 1fui n GLY 64 Ca 0.00 -1.04 -0.03 0.00 0.00 0.00 0.00 46.02 44.95 1fui n GLY 64 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1fui h MET 65 N 0.00 0.51 -0.03 1.61 0.00 -1.96 -1.22 114.93 113.83 1fui h MET 65 Ca -0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 59.70 59.51 1fui h MET 65 Cb 0.01 -0.04 -0.00 0.00 0.00 0.00 0.00 31.60 31.57 1fui h MET 65 CO 0.00 0.70 0.01 0.00 0.00 0.00 0.00 176.91 177.62 1fui h ALA 66 N 1.31 0.05 -0.48 6.32 0.00 -1.97 -0.36 119.26 124.12 1fui h ALA 66 Ca 0.07 -0.09 -0.11 0.00 0.00 0.00 0.00 54.91 54.78 1fui h ALA 66 Cb 0.63 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1fui h ALA 66 CO 0.05 -0.37 -0.14 0.93 0.00 0.00 0.00 179.25 179.72 1fui h GLU 67 N -0.11 0.92 -0.87 0.00 5.08 -1.92 -2.07 114.58 115.60 1fui h GLU 67 Ca 0.01 -0.34 -0.02 0.00 -1.00 0.00 0.00 59.36 58.02 1fui h GLU 67 Cb 0.17 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.32 1fui h GLU 67 CO -0.00 0.99 0.48 0.00 -1.00 0.00 0.00 179.01 179.48 1fui h ALA 68 N 1.02 1.20 -0.59 3.43 0.00 -1.08 -1.22 119.26 122.03 1fui h ALA 68 Ca 0.13 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1fui h ALA 68 Cb 0.67 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1fui h ALA 68 CO 0.05 0.65 -0.03 0.00 0.00 0.00 0.00 179.25 179.92 1fui h ALA 69 N 1.30 0.80 -0.18 0.00 0.00 -0.84 -1.92 119.26 118.42 1fui h ALA 69 Ca 0.31 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1fui h ALA 69 Cb 0.03 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1fui h ALA 69 CO -0.05 0.66 0.10 0.00 0.00 0.00 0.00 179.25 179.96 1fui h ALA 70 N 0.97 0.22 -0.71 0.00 0.00 -0.83 -1.84 119.26 117.08 1fui h ALA 70 Ca 0.16 -0.04 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1fui h ALA 70 Cb 0.59 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.26 1fui h ALA 70 CO 0.04 -0.26 0.41 0.00 0.00 0.00 0.00 179.25 179.44 1fui h GLU 72 N 0.76 1.09 -0.47 0.00 4.57 -1.03 0.13 114.58 119.62 1fui h GLU 72 Ca 0.31 -0.10 -0.01 0.00 -1.18 0.00 0.00 59.36 58.39 1fui h GLU 72 Cb 0.17 -0.23 -0.02 0.00 -0.16 0.00 0.00 28.75 28.51 1fui h GLU 72 CO -0.17 0.77 0.27 1.49 -1.18 0.00 0.00 179.01 180.18 1fui h GLU 73 N 1.10 0.65 -0.41 1.92 4.81 -0.69 -1.30 114.58 120.66 1fui h GLU 73 Ca 0.29 -0.07 -0.02 0.00 -0.13 0.00 0.00 59.36 59.42 1fui h GLU 73 Cb -0.04 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.19 1fui h GLU 73 CO -0.05 0.50 0.16 -0.22 -0.73 0.00 0.00 179.01 178.67 1fui h LYS 74 N 0.63 0.62 -0.18 1.92 3.64 -0.79 -3.19 116.57 119.22 1fui h LYS 74 Ca 0.17 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.42 1fui h LYS 74 Cb 0.03 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 1fui h LYS 74 CO -0.03 0.58 0.07 0.74 -2.27 0.00 0.00 179.45 178.54 1fui h PHE 75 N 0.52 0.27 -0.15 1.91 -1.00 -0.70 -3.05 116.94 114.74 1fui h PHE 75 Ca 0.14 -0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.94 1fui h PHE 75 Cb 0.20 -0.08 -0.01 0.00 3.61 0.00 0.00 35.95 39.67 1fui h PHE 75 CO 0.00 0.32 0.14 0.66 -1.61 0.00 0.00 178.31 177.82 1fui h SER 76 N 0.14 0.00 0.39 2.17 4.64 -1.24 0.10 113.55 119.74 1fui h SER 76 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1fui h SER 76 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1fui h SER 76 CO -0.01 0.00 -0.47 -1.54 -0.87 0.00 0.00 176.83 173.94 1fui n SER 77 N -4.05 0.70 -0.93 4.97 3.41 -1.18 -3.96 113.62 112.58 1fui n SER 77 Ca 0.01 -0.49 0.09 0.00 -0.26 0.00 0.00 58.87 58.22 1fui n SER 77 Cb 0.26 0.28 0.18 0.00 -0.26 0.00 0.00 64.21 64.67 1fui n SER 77 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fui n GLN 78 N -1.26 2.29 -3.56 4.33 1.13 -0.01 -5.00 117.38 115.31 1fui n GLN 78 Ca 0.07 -2.08 -0.20 0.00 -1.94 0.00 0.00 57.00 52.85 1fui n GLN 78 Cb 0.34 -1.41 0.07 0.00 0.11 0.00 0.00 30.24 29.35 1fui n GLN 78 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 1fui n ASN 79 N 1.12 -2.45 -4.73 1.08 4.05 -1.04 -4.57 115.26 108.72 1fui n ASN 79 Ca 0.16 -0.68 -0.41 0.00 0.45 0.00 0.00 54.58 54.10 1fui n ASN 79 Cb 0.51 -4.71 -0.04 0.00 1.23 0.00 0.00 39.78 36.76 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 -3.45 4.73 -0.75 3.44 -7.23 -1.20 -1.45 120.40 114.49 1fui s VAL 80 Ca 0.11 1.80 0.17 0.00 -1.81 0.00 0.00 61.98 62.25 1fui s VAL 80 Cb -0.05 -4.20 -0.20 0.00 0.56 0.00 0.00 36.38 32.49 1fui s VAL 80 CO 0.76 0.30 0.71 0.61 -0.31 0.00 0.00 175.10 177.17 1fui n GLY 81 N 2.52 -0.65 3.45 2.32 0.00 0.63 -4.83 105.19 108.62 1fui n GLY 81 Ca 0.00 -0.49 -0.17 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.95 -0.28 0.09 0.99 -0.00 -1.25 -3.86 118.68 111.43 1fui s LEU 82 Ca 0.05 0.52 0.08 0.00 -0.00 0.00 0.00 54.13 54.78 1fui s LEU 82 Cb 0.13 2.23 -0.03 0.00 -0.00 0.00 0.00 46.19 48.51 1fui s LEU 82 CO 0.72 -0.59 -0.20 0.42 -0.00 0.00 0.00 176.35 176.70 1fui s THR 83 N -1.37 1.62 -0.15 5.48 -4.23 -0.73 -0.83 115.64 115.43 1fui s THR 83 Ca -0.11 -1.44 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 1fui s THR 83 Cb -0.01 -1.46 0.03 0.00 1.34 0.00 0.00 72.50 72.39 1fui s THR 83 CO 0.07 -0.03 -0.11 -0.63 -0.54 0.00 0.00 174.62 173.38 1fui s ILE 84 N -1.10 1.39 -0.21 2.99 1.01 -0.24 -1.07 121.20 123.97 1fui s ILE 84 Ca 0.05 -0.59 -0.11 0.00 0.00 0.00 0.00 60.65 60.01 1fui s ILE 84 Cb -0.10 -1.37 -0.05 0.00 0.01 0.00 0.00 42.46 40.95 1fui s ILE 84 CO 0.03 0.37 0.17 -0.89 0.00 0.00 0.00 174.94 174.62 1fui s THR 85 N 1.55 5.38 0.11 2.92 2.01 -0.08 -0.95 115.64 126.58 1fui s THR 85 Ca 0.04 0.25 0.10 0.00 0.31 0.00 0.00 61.69 62.38 1fui s THR 85 Cb -0.13 -3.51 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 1fui s THR 85 CO -0.09 0.40 -0.25 0.68 -0.69 0.00 0.00 174.62 174.67 1fui s VAL 86 N 0.59 2.08 -0.24 3.82 -7.23 -0.12 -0.48 120.40 118.82 1fui s VAL 86 Ca 0.09 -1.65 -0.27 0.00 -1.81 0.00 0.00 61.98 58.34 1fui s VAL 86 Cb -0.12 -1.85 0.13 0.00 0.56 0.00 0.00 36.38 35.11 1fui s VAL 86 CO 0.01 0.08 1.07 0.28 -0.31 0.00 0.00 175.10 176.22 1fui s THR 87 N -1.06 0.00 -1.68 5.32 -1.32 -0.99 -1.38 115.64 114.54 1fui s THR 87 Ca 0.12 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 60.76 1fui s THR 87 Cb -0.10 -1.00 0.30 0.00 -1.51 0.00 0.00 72.50 70.19 1fui s THR 87 CO 0.05 0.00 1.21 -0.81 -2.21 0.00 0.00 174.62 172.86 1fui n PRO 88 N 1.52 2.11 -2.94 7.08 -0.04 -1.26 -1.08 135.00 140.39 1fui n PRO 88 Ca -0.11 -1.93 -0.08 0.00 -0.04 0.00 0.00 63.50 61.34 1fui n PRO 88 Cb 0.57 -1.36 -0.03 0.00 -0.04 0.00 0.00 33.50 32.64 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 -2.88 3.96 0.17 0.00 -0.11 -1.26 -4.18 118.94 114.65 1fui s TRP 90 Ca 0.17 1.90 -0.01 0.00 1.22 0.00 0.00 56.10 59.38 1fui s TRP 90 Cb 0.01 -2.99 -0.04 0.00 -1.50 0.00 0.00 33.47 28.94 1fui s TRP 90 CO 0.12 0.41 0.10 0.00 -4.62 0.00 0.00 176.95 172.96 1fui s TYR 92 N -4.10 3.05 0.00 0.00 2.02 -1.26 -4.92 117.35 112.13 1fui s TYR 92 Ca 0.33 -1.77 0.00 0.00 -0.37 0.00 0.00 57.07 55.26 1fui s TYR 92 Cb 0.07 -4.57 0.00 0.00 -0.40 0.00 0.00 41.96 37.06 1fui s TYR 92 CO 0.08 -1.65 0.00 0.41 -1.57 0.00 0.00 175.55 172.82 1fui n GLY 93 N 5.00 0.00 0.32 0.71 0.00 -1.26 -0.72 105.19 109.24 1fui n GLY 93 Ca 0.43 0.00 0.22 0.00 0.00 0.00 0.00 46.02 46.66 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 1.50 1.61 4.64 -1.93 -1.24 113.55 118.13 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 -0.09 -0.33 -0.87 0.00 0.00 176.83 175.54 1fui h GLU 95 N 0.00 0.00 0.00 4.77 5.08 -1.33 -3.37 114.58 119.73 1fui h GLU 95 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1fui h GLU 95 Cb 0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1fui h GLU 95 CO 0.00 0.00 -0.71 0.25 -1.00 0.00 0.00 179.01 177.55 1fui n THR 96 N -2.41 0.00 -1.69 1.13 -2.24 -0.49 -3.39 114.28 105.18 1fui n THR 96 Ca 0.05 -0.25 -0.33 0.00 -2.27 0.00 0.00 64.05 61.25 1fui n THR 96 Cb 0.45 0.70 0.05 0.00 -2.10 0.00 0.00 70.33 69.44 1fui n THR 96 CO 0.00 0.00 0.00 0.27 -0.57 0.00 0.00 175.07 174.77 1fui s ILE 97 N -1.88 3.35 -0.38 2.28 -4.36 -1.06 -4.98 121.20 114.16 1fui s ILE 97 Ca 0.00 0.58 -0.29 0.00 -0.26 0.00 0.00 60.65 60.69 1fui s ILE 97 Cb 0.03 -3.11 0.01 0.00 1.25 0.00 0.00 42.46 40.65 1fui s ILE 97 CO 0.20 -0.43 1.28 -0.62 0.24 0.00 0.00 174.94 175.61 1fui s ASP 98 N -2.79 6.57 0.00 4.36 -1.08 -1.26 -4.90 116.67 117.57 1fui s ASP 98 Ca 0.65 0.88 0.29 0.00 -0.52 0.00 0.00 52.55 53.86 1fui s ASP 98 Cb -0.19 -2.54 1.37 0.00 -1.46 0.00 0.00 42.92 40.10 1fui s ASP 98 CO 0.44 -1.23 1.94 0.23 0.52 0.00 0.00 175.17 177.08 1fui n MET 99 N 7.67 0.74 -1.68 4.34 2.81 -1.26 -4.90 117.12 124.84 1fui n MET 99 Ca 0.14 -0.20 -0.42 0.00 -1.81 0.00 0.00 57.70 55.42 1fui n MET 99 Cb 0.48 -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 0.34 1.51 0.00 0.00 175.97 177.82 1fui s ASP 100 N -2.39 6.41 0.52 7.83 2.15 -1.26 -4.89 116.67 125.03 1fui s ASP 100 Ca 0.32 2.62 0.32 0.00 0.43 0.00 0.00 52.55 56.25 1fui s ASP 100 Cb 0.20 -2.53 1.30 0.00 -0.30 0.00 0.00 42.92 41.59 1fui s ASP 100 CO 0.45 -1.09 1.95 1.55 -0.17 0.00 0.00 175.17 177.85 1fui h PRO 101 N 10.78 0.00 0.00 4.34 0.13 -1.98 -3.36 132.00 141.91 1fui h PRO 101 Ca -0.49 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.35 1fui h PRO 101 Cb 1.24 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.31 1fui h PRO 101 CO 0.94 0.00 -2.11 0.25 -0.23 0.00 0.00 178.00 176.85 1fui n THR 102 N -3.01 1.11 -2.48 1.56 -2.24 -1.26 -4.96 114.28 103.00 1fui n THR 102 Ca 0.01 -0.64 -0.38 0.00 -2.27 0.00 0.00 64.05 60.77 1fui n THR 102 Cb 0.31 -0.69 -0.04 0.00 -2.10 0.00 0.00 70.33 67.81 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 -2.39 4.30 0.29 -0.78 1.70 -1.26 -4.98 118.95 115.83 1fui s ARG 103 Ca -0.11 1.66 -0.30 0.00 -0.47 0.00 0.00 55.73 56.51 1fui s ARG 103 Cb 0.05 -2.78 -0.11 0.00 -0.57 0.00 0.00 34.95 31.55 1fui s ARG 103 CO 0.62 -0.05 1.47 -2.14 -1.08 0.00 0.00 175.30 174.12 1fui s PRO 104 N -2.11 4.22 -0.00 3.89 0.02 -1.25 -4.90 135.00 134.86 1fui s PRO 104 Ca 0.53 2.41 0.02 0.00 0.02 0.00 0.00 61.00 63.98 1fui s PRO 104 Cb -0.27 -3.06 -0.01 0.00 0.02 0.00 0.00 34.50 31.19 1fui s PRO 104 CO 0.34 -0.46 -0.08 0.15 -0.33 0.00 0.00 177.00 176.62 1fui s LYS 105 N -0.85 0.63 0.10 5.54 1.02 -1.26 -1.78 119.74 123.14 1fui s LYS 105 Ca 0.58 -0.31 0.04 0.00 0.02 0.00 0.00 55.97 56.30 1fui s LYS 105 Cb -0.44 -0.60 -0.04 0.00 -0.52 0.00 0.00 37.83 36.23 1fui s LYS 105 CO 0.49 0.16 -0.10 0.00 -0.92 0.00 0.00 175.35 174.98 1fui s ALA 106 N -0.25 1.15 -0.07 5.17 0.00 -0.23 -0.69 121.76 126.84 1fui s ALA 106 Ca 0.02 -1.23 0.01 0.00 0.00 0.00 0.00 51.96 50.76 1fui s ALA 106 Cb -0.03 0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.14 1fui s ALA 106 CO -0.00 -0.05 -0.07 0.42 0.00 0.00 0.00 175.76 176.06 1fui s ILE 107 N -2.60 0.82 -0.27 0.00 1.01 -0.38 -0.90 121.20 118.87 1fui s ILE 107 Ca 0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 60.65 60.46 1fui s ILE 107 Cb -0.02 -0.83 0.03 0.00 0.01 0.00 0.00 42.46 41.65 1fui s ILE 107 CO -0.00 0.31 -0.01 0.86 0.00 0.00 0.00 174.94 176.10 1fui s TRP 108 N 1.23 3.13 -0.25 3.97 -0.00 0.37 -1.07 118.94 126.31 1fui s TRP 108 Ca -0.05 -1.48 -0.08 0.00 -0.00 0.00 0.00 56.10 54.49 1fui s TRP 108 Cb -0.14 -2.12 -0.03 0.00 -0.00 0.00 0.00 33.47 31.17 1fui s TRP 108 CO -0.02 -0.71 0.10 0.20 -0.00 0.00 0.00 176.95 176.51 1fui s GLY 109 N 1.35 1.81 0.19 5.86 0.00 -1.10 -2.35 107.32 113.08 1fui s GLY 109 Ca -0.01 -1.10 -0.33 0.00 0.00 0.00 0.00 44.72 43.28 1fui s GLY 109 CO -0.02 0.54 1.49 0.33 0.00 0.00 0.00 173.10 175.44 1fui n PHE 110 N 4.89 2.18 -2.96 1.90 7.35 -0.24 -4.31 117.46 126.27 1fui n PHE 110 Ca -0.16 0.36 -0.44 0.00 -0.76 0.00 0.00 57.45 56.45 1fui n PHE 110 Cb 0.52 -2.49 0.00 0.00 0.35 0.00 0.00 39.48 37.85 1fui n PHE 110 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 1fui n ASN 111 N 2.82 5.25 -4.40 -2.13 2.85 -1.26 -2.77 115.26 115.61 1fui n ASN 111 Ca 0.15 -2.99 -0.20 0.00 -0.11 0.00 0.00 54.58 51.43 1fui n ASN 111 Cb 0.29 -1.55 -0.10 0.00 1.24 0.00 0.00 39.78 39.65 1fui n ASN 111 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1fui s GLY 112 N 2.64 1.94 -0.23 8.20 0.00 -1.01 -0.66 107.32 118.19 1fui s GLY 112 Ca 0.42 -1.98 -0.16 0.00 0.00 0.00 0.00 44.72 42.99 1fui s GLY 112 CO -0.00 -1.74 -0.02 -1.30 0.00 0.00 0.00 173.10 170.03 1fui n THR 113 N -0.60 1.55 0.20 0.90 -2.24 -1.26 -3.62 114.28 109.21 1fui n THR 113 Ca -0.02 -0.24 0.08 0.00 -2.27 0.00 0.00 64.05 61.60 1fui n THR 113 Cb 0.66 -1.92 0.35 0.00 -2.10 0.00 0.00 70.33 67.32 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 -0.87 0.00 -3.32 -0.78 3.07 -1.95 -3.33 114.58 107.40 1fui h GLU 114 Ca -0.51 0.00 -0.71 0.00 -0.50 0.00 0.00 59.36 57.64 1fui h GLU 114 Cb 1.51 0.00 -0.35 0.00 -0.84 0.00 0.00 28.75 29.08 1fui h GLU 114 CO -0.27 0.29 -0.05 0.54 -1.40 0.00 0.00 179.01 178.13 1fui n ARG 115 N -3.38 2.71 -0.81 2.33 5.12 -1.26 -4.99 116.66 116.38 1fui n ARG 115 Ca 0.00 -4.48 -0.12 0.00 -1.93 0.00 0.00 57.85 51.32 1fui n ARG 115 Cb 0.50 -2.42 -0.12 0.00 -1.16 0.00 0.00 32.46 29.26 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 2.30 1.73 0.08 5.56 -0.04 -1.18 -2.40 135.00 141.06 1fui n PRO 116 Ca 0.22 -0.92 0.03 0.00 -0.04 0.00 0.00 63.50 62.79 1fui n PRO 116 Cb 0.37 -1.99 0.40 0.00 -0.04 0.00 0.00 33.50 32.24 1fui n PRO 116 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1fui h GLY 117 N 5.53 0.36 2.00 0.55 0.00 -1.45 -2.04 103.07 108.02 1fui h GLY 117 Ca 0.22 -0.19 -0.03 0.00 0.00 0.00 0.00 47.33 47.33 1fui h GLY 117 CO 0.46 0.18 -0.14 0.00 0.00 0.00 0.00 176.54 177.04 1fui h ALA 118 N 1.66 1.29 -0.20 3.60 0.00 -1.71 -1.82 119.26 122.08 1fui h ALA 118 Ca 0.07 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.67 1fui h ALA 118 Cb 0.25 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1fui h ALA 118 CO 0.01 0.18 -0.60 0.28 0.00 0.00 0.00 179.25 179.12 1fui h VAL 119 N 0.00 1.31 -0.27 0.00 2.07 -1.71 -2.55 116.25 115.09 1fui h VAL 119 Ca -0.00 -1.84 -0.07 0.00 0.82 0.00 0.00 66.70 65.61 1fui h VAL 119 Cb 0.39 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.94 1fui h VAL 119 CO 0.02 0.58 -0.09 0.22 0.02 0.00 0.00 177.57 178.31 1fui h TYR 120 N 0.50 0.62 -0.47 1.57 3.20 -1.44 -2.75 116.97 118.20 1fui h TYR 120 Ca -0.00 -0.14 0.08 0.00 3.14 0.00 0.00 58.73 61.80 1fui h TYR 120 Cb 1.18 -0.15 -0.10 0.00 1.54 0.00 0.00 36.73 39.20 1fui h TYR 120 CO 0.06 0.77 -0.43 1.25 -1.64 0.00 0.00 178.16 178.17 1fui h LEU 121 N 0.29 -1.44 -1.13 2.82 6.46 -1.26 0.40 115.31 121.45 1fui h LEU 121 Ca 0.07 0.23 -0.02 0.00 -0.12 0.00 0.00 57.88 58.03 1fui h LEU 121 Cb 0.59 0.64 -0.03 0.00 -0.73 0.00 0.00 40.66 41.13 1fui h LEU 121 CO 0.03 -0.35 0.33 0.00 -0.62 0.00 0.00 178.44 177.83 1fui h ALA 122 N 0.51 1.33 -0.22 1.25 0.00 -1.47 -0.03 119.26 120.62 1fui h ALA 122 Ca 0.15 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1fui h ALA 122 Cb 0.57 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.09 1fui h ALA 122 CO -0.62 0.53 -0.19 0.00 0.00 0.00 0.00 179.25 178.98 1fui h ALA 123 N 1.42 0.32 -0.52 0.00 0.00 -0.89 -2.00 119.26 117.59 1fui h ALA 123 Ca 0.23 -0.35 -0.06 0.00 0.00 0.00 0.00 54.91 54.73 1fui h ALA 123 Cb 0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1fui h ALA 123 CO -0.03 0.24 0.08 0.00 0.00 0.00 0.00 179.25 179.54 1fui h ALA 124 N 0.67 0.70 -0.76 0.00 0.00 -0.02 -1.64 119.26 118.20 1fui h ALA 124 Ca 0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1fui h ALA 124 Cb 0.73 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1fui h ALA 124 CO 0.05 0.44 0.38 -0.07 0.00 0.00 0.00 179.25 180.04 1fui h LEU 125 N 0.75 0.98 -1.05 0.00 3.38 -1.02 0.95 115.31 119.31 1fui h LEU 125 Ca 0.16 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 1fui h LEU 125 Cb 0.41 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.88 1fui h LEU 125 CO 0.01 0.82 0.36 0.00 0.09 0.00 0.00 178.44 179.72 1fui h ALA 126 N 1.19 1.26 -0.45 1.53 0.00 -0.98 -0.41 119.26 121.41 1fui h ALA 126 Ca 0.26 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1fui h ALA 126 Cb 0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1fui h ALA 126 CO -0.04 0.58 -0.13 0.00 0.00 0.00 0.00 179.25 179.66 1fui h ALA 127 N 1.36 0.62 -0.17 0.00 0.00 -0.35 -0.88 119.26 119.85 1fui h ALA 127 Ca 0.25 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1fui h ALA 127 Cb 0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1fui h ALA 127 CO -0.03 0.53 0.08 0.45 0.00 0.00 0.00 179.25 180.27 1fui h HIS 128 N 0.71 0.14 -0.25 0.00 -0.00 -0.12 -1.10 115.15 114.53 1fui h HIS 128 Ca 0.11 0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.40 1fui h HIS 128 Cb 0.67 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.41 28.03 1fui h HIS 128 CO 0.05 0.08 -0.21 0.77 -0.00 0.00 0.00 177.93 178.62 1fui h SER 129 N 0.17 0.45 0.64 2.45 0.02 -0.99 -1.30 113.55 114.99 1fui h SER 129 Ca 0.07 -0.14 -0.11 0.00 -0.84 0.00 0.00 61.79 60.78 1fui h SER 129 Cb 0.02 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 1fui h SER 129 CO -0.06 0.67 -0.51 -0.61 -1.14 0.00 0.00 176.83 175.18 1fui h GLN 130 N 0.41 0.00 -0.62 3.45 4.15 -0.87 -3.01 115.11 118.62 1fui h GLN 130 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.49 1fui h GLN 130 Cb 0.59 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.28 1fui h GLN 130 CO 0.04 0.51 0.00 1.63 -1.93 0.00 0.00 178.83 179.08 1fui n LYS 131 N -3.77 2.55 -1.79 1.69 5.02 -0.44 -4.97 118.16 116.46 1fui n LYS 131 Ca -0.01 -2.40 -0.14 0.00 -2.02 0.00 0.00 58.31 53.75 1fui n LYS 131 Cb 0.55 -1.53 -0.03 0.00 -0.02 0.00 0.00 35.03 34.00 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 1.57 0.69 2.74 0.72 0.00 -0.72 -4.97 105.19 105.22 1fui n GLY 132 Ca 0.22 -0.36 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 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 -2.58 2.01 0.39 -0.61 -4.36 -0.57 -5.03 121.20 110.45 1fui s ILE 133 Ca 0.00 -3.58 -0.25 0.00 -0.26 0.00 0.00 60.65 56.56 1fui s ILE 133 Cb 0.00 -2.34 -0.11 0.00 1.25 0.00 0.00 42.46 41.25 1fui s ILE 133 CO 0.00 -1.04 1.05 -2.65 0.24 0.00 0.00 174.94 172.54 1fui n PRO 134 N 2.47 1.46 -4.06 0.37 -0.02 -1.26 -4.52 135.00 129.45 1fui n PRO 134 Ca 0.20 0.52 -0.09 0.00 -2.02 0.00 0.00 63.50 62.11 1fui n PRO 134 Cb 0.38 -2.05 -0.11 0.00 -0.02 0.00 0.00 33.50 31.70 1fui n PRO 134 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fui s ALA 135 N -1.22 0.46 0.31 3.55 0.00 -1.26 -4.67 121.76 118.94 1fui s ALA 135 Ca 0.61 -0.93 -0.13 0.00 0.00 0.00 0.00 51.96 51.51 1fui s ALA 135 Cb -0.58 0.16 -0.08 0.00 0.00 0.00 0.00 23.12 22.62 1fui s ALA 135 CO 0.58 -0.20 0.70 -0.06 0.00 0.00 0.00 175.76 176.78 1fui s PHE 136 N -2.50 3.39 -0.12 0.00 0.40 0.14 -1.17 117.98 118.12 1fui s PHE 136 Ca -0.04 1.13 -0.01 0.00 -0.60 0.00 0.00 56.93 57.41 1fui s PHE 136 Cb -0.02 -2.47 -0.02 0.00 0.51 0.00 0.00 43.02 41.02 1fui s PHE 136 CO -0.04 0.10 -0.10 0.45 0.70 0.00 0.00 175.22 176.34 1fui s SER 137 N -2.40 4.34 -0.34 1.36 0.15 -1.26 -1.26 113.70 114.29 1fui s SER 137 Ca 0.52 -0.21 0.03 0.00 0.70 0.00 0.00 55.95 57.00 1fui s SER 137 Cb -0.10 -1.50 0.10 0.00 -1.71 0.00 0.00 66.02 62.81 1fui s SER 137 CO 0.20 0.22 0.07 -0.63 1.20 0.00 0.00 173.24 174.30 1fui s ILE 138 N 0.04 1.97 -0.15 6.45 1.01 -0.24 -4.95 121.20 125.34 1fui s ILE 138 Ca -0.03 -2.20 0.00 0.00 0.00 0.00 0.00 60.65 58.43 1fui s ILE 138 Cb -0.14 -2.46 0.03 0.00 0.01 0.00 0.00 42.46 39.90 1fui s ILE 138 CO 0.04 -0.63 -0.13 -0.47 0.00 0.00 0.00 174.94 173.75 1fui s TYR 139 N 0.99 2.12 0.61 3.97 5.04 -1.26 -2.70 117.35 126.10 1fui s TYR 139 Ca 0.11 -1.22 -0.17 0.00 -2.44 0.00 0.00 57.07 53.36 1fui s TYR 139 Cb -0.19 -1.55 -0.03 0.00 0.35 0.00 0.00 41.96 40.54 1fui s TYR 139 CO -0.11 -0.66 1.11 0.20 -1.34 0.00 0.00 175.55 174.74 1fui s GLY 140 N 1.50 2.32 0.01 8.97 0.00 -1.26 -4.93 107.32 113.93 1fui s GLY 140 Ca 0.04 0.62 -0.22 0.00 0.00 0.00 0.00 44.72 45.16 1fui s GLY 140 CO -0.10 0.97 1.27 0.45 0.00 0.00 0.00 173.10 175.68 1fui h HIS 141 N 0.51 0.35 -2.94 1.90 3.86 -1.99 -3.46 115.15 113.37 1fui h HIS 141 Ca -0.48 -0.12 -0.67 0.00 -1.16 0.00 0.00 60.37 57.94 1fui h HIS 141 Cb 1.25 -0.07 -0.10 0.00 1.06 0.00 0.00 27.41 29.55 1fui h HIS 141 CO 0.54 0.76 -0.54 -0.51 0.86 0.00 0.00 177.93 179.04 1fui s ASP 142 N -6.13 5.88 0.28 2.45 1.01 -1.26 -5.09 116.67 113.81 1fui s ASP 142 Ca -0.15 0.33 -0.30 0.00 0.71 0.00 0.00 52.55 53.14 1fui s ASP 142 Cb 0.04 -1.81 -0.10 0.00 1.01 0.00 0.00 42.92 42.06 1fui s ASP 142 CO 0.74 0.40 1.46 -0.69 0.21 0.00 0.00 175.17 177.29 1fui s VAL 143 N -0.97 2.51 0.14 -1.27 1.01 -1.26 -4.88 120.40 115.67 1fui s VAL 143 Ca 0.14 0.44 0.07 0.00 0.00 0.00 0.00 61.98 62.63 1fui s VAL 143 Cb -0.12 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 1fui s VAL 143 CO 0.03 0.08 -0.02 -1.10 0.00 0.00 0.00 175.10 174.09 1fui s GLN 144 N -0.69 2.39 0.49 2.72 -0.21 0.16 -5.02 119.66 119.51 1fui s GLN 144 Ca 0.58 -1.02 -0.20 0.00 0.02 0.00 0.00 55.36 54.74 1fui s GLN 144 Cb -0.43 -2.40 -0.08 0.00 1.00 0.00 0.00 33.01 31.10 1fui s GLN 144 CO 0.47 0.49 1.03 -0.51 -2.12 0.00 0.00 175.29 174.65 1fui s ASP 145 N -2.64 6.36 0.61 5.90 1.01 -1.26 -4.44 116.67 122.21 1fui s ASP 145 Ca 0.26 1.91 0.31 0.00 0.71 0.00 0.00 52.55 55.74 1fui s ASP 145 Cb -0.10 -2.56 1.72 0.00 1.01 0.00 0.00 42.92 42.99 1fui s ASP 145 CO 0.18 -0.77 2.08 0.00 0.21 0.00 0.00 175.17 176.87 1fui h ALA 146 N 1.54 1.68 -0.01 5.23 0.00 -1.99 -0.76 119.26 124.96 1fui h ALA 146 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1fui h ALA 146 Cb 1.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1fui h ALA 146 CO 0.59 -0.31 -0.51 -0.40 0.00 0.00 0.00 179.25 178.63 1fui n ASP 147 N -3.58 1.19 -4.68 0.00 5.68 -1.26 -4.91 116.55 108.99 1fui n ASP 147 Ca 0.01 -0.95 -0.42 0.00 -0.50 0.00 0.00 54.79 52.92 1fui n ASP 147 Cb 0.34 0.42 -0.03 0.00 -1.14 0.00 0.00 41.12 40.71 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 -2.69 6.92 0.00 -1.12 -1.08 -0.29 -4.92 116.67 113.49 1fui s ASP 148 Ca 0.17 1.97 0.12 0.00 -0.52 0.00 0.00 52.55 54.29 1fui s ASP 148 Cb 0.18 -2.56 0.12 0.00 -1.46 0.00 0.00 42.92 39.20 1fui s ASP 148 CO 0.64 -0.68 0.92 0.35 0.52 0.00 0.00 175.17 176.91 1fui n THR 149 N 4.74 0.10 -1.77 1.71 -2.24 -1.26 -4.89 114.28 110.66 1fui n THR 149 Ca 0.13 -0.55 -0.31 0.00 -2.27 0.00 0.00 64.05 61.05 1fui n THR 149 Cb 0.45 1.18 0.02 0.00 -2.10 0.00 0.00 70.33 69.87 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 -0.99 5.94 -0.26 3.42 1.04 -1.26 -5.03 113.70 116.55 1fui s SER 150 Ca 0.15 1.49 -0.07 0.00 0.48 0.00 0.00 55.95 58.00 1fui s SER 150 Cb 0.10 -2.48 -0.01 0.00 0.10 0.00 0.00 66.02 63.73 1fui s SER 150 CO 0.15 -1.07 0.06 -0.63 0.98 0.00 0.00 173.24 172.74 1fui s ILE 151 N -3.13 4.11 0.81 -1.02 1.01 -1.26 -5.09 121.20 116.63 1fui s ILE 151 Ca 0.56 -0.37 -0.13 0.00 0.00 0.00 0.00 60.65 60.71 1fui s ILE 151 Cb -0.12 -2.98 0.09 0.00 0.01 0.00 0.00 42.46 39.45 1fui s ILE 151 CO 0.54 0.26 1.18 -2.84 0.00 0.00 0.00 174.94 174.08 1fui s PRO 152 N 1.57 1.66 0.20 2.79 0.02 -1.26 -4.76 135.00 135.21 1fui s PRO 152 Ca 0.05 1.66 -0.11 0.00 0.02 0.00 0.00 61.00 62.62 1fui s PRO 152 Cb -0.16 -1.79 0.19 0.00 0.02 0.00 0.00 34.50 32.76 1fui s PRO 152 CO 0.03 -2.18 1.81 0.00 -0.33 0.00 0.00 177.00 176.33 1fui h ALA 153 N -1.01 0.80 -0.35 -1.55 0.00 -1.99 -0.05 119.26 115.12 1fui h ALA 153 Ca -0.46 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.41 1fui h ALA 153 Cb 1.28 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 1fui h ALA 153 CO 0.46 0.03 -0.01 0.38 0.00 0.00 0.00 179.25 180.11 1fui h ASP 154 N 0.65 0.51 -0.25 0.00 2.03 -2.00 -0.85 116.42 116.50 1fui h ASP 154 Ca 0.26 -0.10 -0.16 0.00 -0.73 0.00 0.00 57.03 56.30 1fui h ASP 154 Cb 0.13 -0.13 0.00 0.00 -0.83 0.00 0.00 39.33 38.50 1fui h ASP 154 CO -0.16 0.59 -0.47 0.58 -1.03 0.00 0.00 179.24 178.75 1fui h VAL 155 N 0.52 1.30 -0.28 4.15 2.07 -1.73 -2.87 116.25 119.41 1fui h VAL 155 Ca 0.11 -1.67 0.00 0.00 0.82 0.00 0.00 66.70 65.96 1fui h VAL 155 Cb 0.35 1.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.82 1fui h VAL 155 CO 0.01 0.54 0.18 -0.08 0.02 0.00 0.00 177.57 178.24 1fui h GLU 156 N 0.51 0.36 -0.63 1.57 4.81 -0.69 -0.74 114.58 119.78 1fui h GLU 156 Ca 0.01 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.27 1fui h GLU 156 Cb 1.08 -0.08 -0.05 0.00 0.63 0.00 0.00 28.75 30.33 1fui h GLU 156 CO 0.11 0.24 0.35 1.49 -0.73 0.00 0.00 179.01 180.47 1fui h GLU 157 N 0.37 0.64 -0.32 1.92 4.81 -1.13 -0.59 114.58 120.28 1fui h GLU 157 Ca 0.10 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.16 1fui h GLU 157 Cb -0.03 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.19 1fui h GLU 157 CO -0.03 0.43 -0.34 0.87 -0.73 0.00 0.00 179.01 179.21 1fui h LYS 158 N 0.66 0.73 -0.32 1.92 1.57 -1.25 -1.36 116.57 118.52 1fui h LYS 158 Ca 0.28 -0.35 -0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1fui h LYS 158 Cb 0.15 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1fui h LYS 158 CO -0.17 0.96 0.11 -0.07 -0.57 0.00 0.00 179.45 179.71 1fui h LEU 159 N 0.61 0.45 -0.24 2.94 3.38 -0.62 -1.40 115.31 120.44 1fui h LEU 159 Ca 0.06 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.81 1fui h LEU 159 Cb 0.87 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1fui h LEU 159 CO 0.08 0.52 0.03 -0.07 0.09 0.00 0.00 178.44 179.09 1fui h LEU 160 N 0.36 0.39 -0.58 1.67 3.38 -1.07 -1.20 115.31 118.25 1fui h LEU 160 Ca 0.10 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.83 1fui h LEU 160 Cb 0.22 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.83 1fui h LEU 160 CO -0.01 0.56 0.35 -0.09 0.09 0.00 0.00 178.44 179.35 1fui h ARG 161 N 0.20 0.68 -0.19 1.13 2.43 -1.16 0.72 114.38 118.19 1fui h ARG 161 Ca 0.07 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1fui h ARG 161 Cb 0.34 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 1fui h ARG 161 CO 0.01 0.45 0.08 0.35 -1.51 0.00 0.00 179.97 179.34 1fui h PHE 162 N 0.70 0.28 -0.52 2.20 3.57 -1.19 -2.27 116.94 119.72 1fui h PHE 162 Ca 0.24 -0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.67 1fui h PHE 162 Cb 0.03 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.66 1fui h PHE 162 CO -0.06 0.32 0.14 0.00 -2.23 0.00 0.00 178.31 176.49 1fui h ALA 163 N 0.93 0.68 -0.16 2.41 0.00 -0.85 0.17 119.26 122.44 1fui h ALA 163 Ca 0.06 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1fui h ALA 163 Cb 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1fui h ALA 163 CO -0.01 0.36 0.10 -0.09 0.00 0.00 0.00 179.25 179.61 1fui h ARG 164 N 0.71 0.22 -0.20 0.00 2.43 -0.84 0.25 114.38 116.94 1fui h ARG 164 Ca 0.16 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.27 1fui h ARG 164 Cb 0.31 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.80 1fui h ARG 164 CO -0.00 0.19 -0.05 0.00 -1.51 0.00 0.00 179.97 178.59 1fui h ALA 165 N 1.02 0.28 -0.97 2.80 0.00 -1.34 -2.41 119.26 118.64 1fui h ALA 165 Ca 0.06 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.75 1fui h ALA 165 Cb 0.03 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.69 1fui h ALA 165 CO -0.01 0.07 0.64 0.78 0.00 0.00 0.00 179.25 180.72 1fui h GLY 166 N 0.12 1.41 1.00 0.00 0.00 -0.50 -1.80 103.07 103.31 1fui h GLY 166 Ca 0.05 -0.49 -0.05 0.00 0.00 0.00 0.00 47.33 46.85 1fui h GLY 166 CO 0.02 0.42 0.17 1.41 0.00 0.00 0.00 176.54 178.57 1fui h LEU 167 N 1.24 0.85 -0.43 3.11 3.38 -0.40 -1.82 115.31 121.23 1fui h LEU 167 Ca 0.39 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 58.20 1fui h LEU 167 Cb -0.01 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.47 1fui h LEU 167 CO -0.12 0.84 0.15 0.00 0.09 0.00 0.00 178.44 179.40 1fui h ALA 168 N 1.05 0.51 -0.06 1.53 0.00 -0.87 0.22 119.26 121.64 1fui h ALA 168 Ca 0.19 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.16 1fui h ALA 168 Cb 0.30 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1fui h ALA 168 CO -0.00 -0.24 -0.02 0.28 0.00 0.00 0.00 179.25 179.27 1fui h VAL 169 N 0.31 0.94 -0.18 0.00 2.07 -1.06 -2.63 116.25 115.70 1fui h VAL 169 Ca 0.20 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.68 1fui h VAL 169 Cb 0.19 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 1fui h VAL 169 CO -0.21 0.00 -0.09 0.00 0.02 0.00 0.00 177.57 177.29 1fui h ALA 170 N 1.05 1.52 -0.12 1.67 0.00 -0.73 -2.92 119.26 119.73 1fui h ALA 170 Ca 0.03 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.62 1fui h ALA 170 Cb 0.05 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1fui h ALA 170 CO -0.06 0.34 -0.50 0.77 0.00 0.00 0.00 179.25 179.80 1fui h SER 171 N 0.26 0.36 0.75 0.00 0.02 -0.23 -3.19 113.55 111.52 1fui h SER 171 Ca 0.06 -0.18 -0.18 0.00 -0.84 0.00 0.00 61.79 60.64 1fui h SER 171 Cb 0.33 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 1fui h SER 171 CO 0.02 0.81 -0.85 0.24 -1.14 0.00 0.00 176.83 175.90 1fui h MET 172 N 0.26 0.07 -6.26 3.45 2.86 -1.31 -3.44 114.93 110.56 1fui h MET 172 Ca 0.01 -0.08 -0.66 0.00 -2.06 0.00 0.00 59.70 56.91 1fui h MET 172 Cb 0.98 0.02 0.03 0.00 0.06 0.00 0.00 31.60 32.69 1fui h MET 172 CO 0.08 0.88 0.89 1.17 1.06 0.00 0.00 176.91 180.99 1fui n LYS 173 N -3.59 1.67 0.00 1.72 4.81 -1.15 -1.42 118.16 120.20 1fui n LYS 173 Ca -0.02 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 58.03 1fui n LYS 173 Cb 0.80 -2.36 0.00 0.00 0.02 0.00 0.00 35.03 33.49 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 3.91 2.91 3.87 3.14 0.00 0.62 -5.00 105.19 114.65 1fui n GLY 174 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.36 2.29 0.24 1.61 -0.14 -0.51 -4.69 119.74 118.18 1fui s LYS 175 Ca 0.00 0.33 0.07 0.00 -1.36 0.00 0.00 55.97 55.01 1fui s LYS 175 Cb 0.00 -1.97 -0.04 0.00 -1.68 0.00 0.00 37.83 34.14 1fui s LYS 175 CO 0.00 -1.41 0.15 -1.12 -0.76 0.00 0.00 175.35 172.21 1fui s SER 176 N -4.37 5.35 -0.19 2.83 0.01 -0.36 -1.23 113.70 115.75 1fui s SER 176 Ca 0.60 -0.30 -0.02 0.00 1.31 0.00 0.00 55.95 57.55 1fui s SER 176 Cb -0.12 -1.31 -0.00 0.00 0.21 0.00 0.00 66.02 64.79 1fui s SER 176 CO 0.51 -0.01 -0.10 -0.47 0.41 0.00 0.00 173.24 173.58 1fui s TYR 177 N -2.09 2.88 -0.42 2.43 5.04 -0.04 -1.15 117.35 123.99 1fui s TYR 177 Ca 0.32 -1.02 -0.20 0.00 -2.44 0.00 0.00 57.07 53.73 1fui s TYR 177 Cb -0.08 -1.99 0.02 0.00 0.35 0.00 0.00 41.96 40.26 1fui s TYR 177 CO 0.24 -0.52 0.61 -1.17 -1.34 0.00 0.00 175.55 173.37 1fui s LEU 178 N 1.13 4.50 -0.72 6.97 2.96 -0.27 -1.47 118.68 131.78 1fui s LEU 178 Ca 0.01 -0.30 -0.21 0.00 -0.22 0.00 0.00 54.13 53.41 1fui s LEU 178 Cb -0.14 -2.68 0.09 0.00 0.50 0.00 0.00 46.19 43.96 1fui s LEU 178 CO -0.03 -0.71 0.96 -0.55 -1.32 0.00 0.00 176.35 174.70 1fui s SER 179 N 1.93 6.30 -0.89 3.68 0.15 0.51 -1.41 113.70 123.98 1fui s SER 179 Ca 0.21 -1.38 -0.19 0.00 0.70 0.00 0.00 55.95 55.29 1fui s SER 179 Cb -0.15 -2.39 0.12 0.00 -1.71 0.00 0.00 66.02 61.89 1fui s SER 179 CO 0.17 -1.27 1.11 -0.22 1.20 0.00 0.00 173.24 174.23 1fui s LEU 180 N 3.39 4.91 0.00 3.45 0.20 -0.35 -1.37 118.68 128.91 1fui s LEU 180 Ca 0.23 -1.86 0.00 0.00 0.69 0.00 0.00 54.13 53.19 1fui s LEU 180 Cb -0.15 -2.41 0.00 0.00 -0.43 0.00 0.00 46.19 43.21 1fui s LEU 180 CO 0.04 -1.13 0.00 0.61 -0.29 0.00 0.00 176.35 175.58 1fui n GLY 181 N 5.52 -0.98 0.00 7.98 0.00 0.98 -1.12 105.19 117.57 1fui n GLY 181 Ca 0.20 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 44.07 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 0.00 2.26 3.72 -0.02 0.00 -1.26 -4.71 105.19 105.18 1fui n GLY 182 Ca 0.00 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 1fui n GLY 182 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fui s VAL 183 N 3.53 4.15 -0.34 1.61 1.01 -1.24 -4.75 120.40 124.37 1fui s VAL 183 Ca 0.00 1.65 -0.08 0.00 0.00 0.00 0.00 61.98 63.55 1fui s VAL 183 Cb 0.00 -4.06 0.03 0.00 0.00 0.00 0.00 36.38 32.36 1fui s VAL 183 CO 0.00 0.19 0.13 -0.55 0.00 0.00 0.00 175.10 174.87 1fui s SER 184 N 0.60 5.42 -1.50 3.32 0.15 -1.26 -4.73 113.70 115.70 1fui s SER 184 Ca 0.54 -1.04 -0.09 0.00 0.70 0.00 0.00 55.95 56.06 1fui s SER 184 Cb -0.28 -1.92 0.07 0.00 -1.71 0.00 0.00 66.02 62.18 1fui s SER 184 CO 0.31 -0.33 0.75 0.23 1.20 0.00 0.00 173.24 175.40 1fui n MET 185 N 4.87 -4.35 -1.13 5.44 2.81 -1.26 -1.88 117.12 121.62 1fui n MET 185 Ca -0.12 0.51 -0.05 0.00 -1.81 0.00 0.00 57.70 56.22 1fui n MET 185 Cb 0.45 -5.11 -0.02 0.00 -0.71 0.00 0.00 33.22 27.83 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 -1.68 0.54 3.65 3.03 0.00 -1.26 -4.94 105.19 104.53 1fui n GLY 186 Ca -0.10 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 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 -1.60 3.77 0.27 -0.61 1.01 -0.79 -4.92 121.20 118.33 1fui s ILE 187 Ca 0.00 0.91 -0.01 0.00 0.00 0.00 0.00 60.65 61.55 1fui s ILE 187 Cb 0.00 -3.66 0.26 0.00 0.01 0.00 0.00 42.46 39.07 1fui s ILE 187 CO 0.00 -0.16 1.69 0.00 0.00 0.00 0.00 174.94 176.47 1fui h ALA 188 N 9.68 1.18 0.00 9.38 0.00 -1.92 0.87 119.26 138.45 1fui h ALA 188 Ca -0.35 0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1fui h ALA 188 Cb 1.15 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1fui h ALA 188 CO 0.97 -0.33 0.00 0.78 0.00 0.00 0.00 179.25 180.68 1fui h GLY 189 N 0.34 0.00 0.29 0.00 0.00 -1.92 -2.03 103.07 99.76 1fui h GLY 189 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.81 1fui h GLY 189 CO -0.52 0.00 -0.12 -1.14 0.00 0.00 0.00 176.54 174.76 1fui n SER 190 N -2.98 0.91 -4.44 0.19 3.41 0.30 -2.14 113.62 108.87 1fui n SER 190 Ca -0.01 -0.98 -0.44 0.00 -0.26 0.00 0.00 58.87 57.18 1fui n SER 190 Cb 0.19 0.02 -0.01 0.00 -0.26 0.00 0.00 64.21 64.15 1fui n SER 190 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1fui s ILE 191 N -2.31 5.10 -0.01 -1.33 1.01 -0.76 -3.64 121.20 119.26 1fui s ILE 191 Ca 0.32 -2.45 -0.34 0.00 0.00 0.00 0.00 60.65 58.17 1fui s ILE 191 Cb 0.20 -4.82 -0.12 0.00 0.01 0.00 0.00 42.46 37.73 1fui s ILE 191 CO 0.44 -1.51 1.78 0.52 0.00 0.00 0.00 174.94 176.17 1fui n VAL 192 N 4.58 0.40 -3.10 2.92 0.31 -1.26 -4.94 118.33 117.23 1fui n VAL 192 Ca 0.31 -0.07 -0.45 0.00 -0.01 0.00 0.00 64.34 64.12 1fui n VAL 192 Cb 0.44 -1.75 -0.04 0.00 -0.91 0.00 0.00 33.84 31.58 1fui n VAL 192 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1fui s ASP 193 N 3.06 6.28 0.22 4.52 -1.08 -1.26 -4.93 116.67 123.49 1fui s ASP 193 Ca 0.88 -1.60 -0.08 0.00 -0.52 0.00 0.00 52.55 51.24 1fui s ASP 193 Cb -0.70 -2.31 0.27 0.00 -1.46 0.00 0.00 42.92 38.72 1fui s ASP 193 CO 0.48 -1.08 1.84 0.45 0.52 0.00 0.00 175.17 177.38 1fui h HIS 194 N 9.04 0.86 -0.50 -5.34 3.86 -2.01 -2.34 115.15 118.72 1fui h HIS 194 Ca -0.21 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.00 1fui h HIS 194 Cb 1.08 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 29.25 1fui h HIS 194 CO 0.90 0.44 0.21 -0.97 0.86 0.00 0.00 177.93 179.36 1fui h ASN 195 N 0.86 0.64 -0.11 2.45 -1.24 -1.98 -1.74 115.58 114.46 1fui h ASN 195 Ca 0.33 -0.07 -0.00 0.00 0.71 0.00 0.00 56.30 57.27 1fui h ASN 195 Cb 0.14 -0.16 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 1fui h ASN 195 CO -0.16 0.58 0.06 0.15 -1.29 0.00 0.00 177.43 176.77 1fui h PHE 196 N 0.71 0.15 -0.57 0.67 3.57 -1.85 0.30 116.94 119.92 1fui h PHE 196 Ca 0.17 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.66 1fui h PHE 196 Cb 0.13 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1fui h PHE 196 CO 0.01 0.18 0.33 0.74 -2.23 0.00 0.00 178.31 177.34 1fui h PHE 197 N 0.09 0.77 -0.10 0.41 0.04 -1.37 -1.55 116.94 115.23 1fui h PHE 197 Ca 0.04 -0.01 -0.04 0.00 2.80 0.00 0.00 57.97 60.76 1fui h PHE 197 Cb 0.07 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 37.97 1fui h PHE 197 CO -0.04 0.54 -0.09 0.93 -0.60 0.00 0.00 178.31 179.05 1fui h GLU 198 N 0.77 0.24 0.24 1.51 5.08 -1.18 0.89 114.58 122.14 1fui h GLU 198 Ca 0.20 -0.12 -0.32 0.00 -1.00 0.00 0.00 59.36 58.13 1fui h GLU 198 Cb 0.01 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.30 1fui h GLU 198 CO -0.04 0.64 -1.39 0.77 -1.00 0.00 0.00 179.01 177.99 1fui h SER 199 N -0.15 0.80 0.12 1.42 0.02 -0.93 -2.70 113.55 112.13 1fui h SER 199 Ca 0.02 -0.92 -0.36 0.00 -0.84 0.00 0.00 61.79 59.68 1fui h SER 199 Cb 0.59 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 1fui h SER 199 CO 0.02 1.67 -1.97 0.79 -1.14 0.00 0.00 176.83 176.21 1fui n TRP 200 N -3.78 1.25 0.47 3.45 8.01 -0.59 -1.39 117.44 124.87 1fui n TRP 200 Ca -0.17 0.27 0.09 0.00 -1.31 0.00 0.00 57.50 56.39 1fui n TRP 200 Cb 1.07 -1.16 -0.13 0.00 -2.01 0.00 0.00 31.31 29.08 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 -3.53 0.48 -1.68 -0.99 4.77 -1.08 -4.50 117.00 110.46 1fui n LEU 201 Ca -0.32 -0.27 -0.13 0.00 -0.03 0.00 0.00 56.01 55.26 1fui n LEU 201 Cb 1.03 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 42.13 1fui n LEU 201 CO 0.42 0.12 -0.08 0.61 -1.33 0.00 0.00 177.39 177.13 1fui n GLY 202 N 1.42 -0.09 3.83 -0.72 0.00 -0.12 -4.06 105.19 105.45 1fui n GLY 202 Ca 0.00 -0.29 -0.24 0.00 0.00 0.00 0.00 46.02 45.49 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 -4.95 2.33 0.23 1.61 1.00 0.12 -0.28 119.30 119.37 1fui s MET 203 Ca 0.10 -1.80 0.11 0.00 0.00 0.00 0.00 55.69 54.09 1fui s MET 203 Cb -0.04 -2.13 -0.05 0.00 0.00 0.00 0.00 34.83 32.61 1fui s MET 203 CO 0.12 -0.28 -0.16 0.15 0.00 0.00 0.00 175.02 174.86 1fui s LYS 204 N -4.07 1.81 -0.15 2.03 1.02 -0.37 -3.03 119.74 116.97 1fui s LYS 204 Ca 0.41 -1.52 -0.00 0.00 0.02 0.00 0.00 55.97 54.87 1fui s LYS 204 Cb -0.00 -1.94 -0.01 0.00 -0.52 0.00 0.00 37.83 35.36 1fui s LYS 204 CO 0.23 0.38 -0.13 0.08 -0.92 0.00 0.00 175.35 174.99 1fui s VAL 205 N -2.03 2.87 -0.26 3.17 1.01 -1.26 -0.86 120.40 123.05 1fui s VAL 205 Ca 0.26 -0.70 -0.06 0.00 0.00 0.00 0.00 61.98 61.48 1fui s VAL 205 Cb -0.07 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.08 1fui s VAL 205 CO 0.14 0.51 0.03 -1.58 0.00 0.00 0.00 175.10 174.20 1fui s GLN 206 N 0.73 3.32 -0.16 2.72 2.00 -0.54 -4.94 119.66 122.77 1fui s GLN 206 Ca -0.06 -0.69 -0.11 0.00 -2.00 0.00 0.00 55.36 52.51 1fui s GLN 206 Cb -0.15 -3.22 -0.05 0.00 0.80 0.00 0.00 33.01 30.39 1fui s GLN 206 CO 0.01 -0.29 0.19 0.00 -0.50 0.00 0.00 175.29 174.70 1fui s ALA 207 N 1.51 3.70 -0.04 1.58 0.00 -1.26 -0.37 121.76 126.89 1fui s ALA 207 Ca 0.04 -0.59 -0.01 0.00 0.00 0.00 0.00 51.96 51.41 1fui s ALA 207 Cb -0.16 -2.20 0.03 0.00 0.00 0.00 0.00 23.12 20.79 1fui s ALA 207 CO 0.00 0.24 0.02 0.08 0.00 0.00 0.00 175.76 176.11 1fui s VAL 208 N 0.06 0.12 0.48 0.00 1.01 -0.47 -4.97 120.40 116.62 1fui s VAL 208 Ca 0.12 0.19 -0.22 0.00 0.00 0.00 0.00 61.98 62.07 1fui s VAL 208 Cb -0.12 -0.27 -0.07 0.00 0.00 0.00 0.00 36.38 35.92 1fui s VAL 208 CO 0.01 0.17 1.14 -0.62 0.00 0.00 0.00 175.10 175.80 1fui s ASP 209 N 1.47 6.09 0.43 3.32 -1.08 -1.26 -0.02 116.67 125.62 1fui s ASP 209 Ca -0.04 2.23 0.30 0.00 -0.52 0.00 0.00 52.55 54.52 1fui s ASP 209 Cb -0.13 -2.59 1.48 0.00 -1.46 0.00 0.00 42.92 40.22 1fui s ASP 209 CO -0.03 -0.97 1.90 0.24 0.52 0.00 0.00 175.17 176.83 1fui h MET 210 N 1.81 0.00 0.00 4.34 2.86 -1.92 -1.83 114.93 120.19 1fui h MET 210 Ca -0.49 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.14 1fui h MET 210 Cb 1.25 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.91 1fui h MET 210 CO 0.59 0.00 -0.05 1.79 1.06 0.00 0.00 176.91 180.30 1fui h THR 211 N 0.00 0.51 -0.23 2.22 1.35 -2.00 -0.50 112.91 114.25 1fui h THR 211 Ca 0.00 -0.22 -0.07 0.00 -0.55 0.00 0.00 66.41 65.57 1fui h THR 211 Cb 0.15 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 1fui h THR 211 CO 0.00 0.05 -0.16 -0.08 -0.25 0.00 0.00 175.52 175.08 1fui h GLU 212 N 0.00 0.40 -0.37 4.72 4.57 -1.70 0.20 114.58 122.39 1fui h GLU 212 Ca -0.00 -0.12 -0.16 0.00 -1.18 0.00 0.00 59.36 57.90 1fui h GLU 212 Cb 0.14 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.68 1fui h GLU 212 CO 0.01 0.55 -0.41 1.25 -1.18 0.00 0.00 179.01 179.23 1fui h LEU 213 N 0.37 0.99 -0.68 1.64 6.46 -1.28 -2.06 115.31 120.74 1fui h LEU 213 Ca 0.07 -0.47 0.00 0.00 -0.12 0.00 0.00 57.88 57.36 1fui h LEU 213 Cb 0.50 -0.28 -0.03 0.00 -0.73 0.00 0.00 40.66 40.12 1fui h LEU 213 CO 0.03 1.27 0.44 -0.09 -0.62 0.00 0.00 178.44 179.47 1fui h ARG 214 N 0.75 0.91 -0.66 1.25 9.65 -1.18 -2.05 114.38 123.04 1fui h ARG 214 Ca 0.05 -0.06 -0.05 0.00 -1.10 0.00 0.00 59.98 58.82 1fui h ARG 214 Cb 1.01 -0.20 -0.03 0.00 -1.39 0.00 0.00 29.97 29.36 1fui h ARG 214 CO 0.10 0.62 0.24 -0.09 2.80 0.00 0.00 179.97 183.63 1fui h ARG 215 N 0.93 1.01 -0.72 0.20 2.43 -0.68 0.08 114.38 117.63 1fui h ARG 215 Ca 0.25 -0.20 -0.06 0.00 -0.81 0.00 0.00 59.98 59.16 1fui h ARG 215 Cb -0.08 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.28 1fui h ARG 215 CO -0.05 0.86 0.23 0.00 -1.51 0.00 0.00 179.97 179.50 1fui h ARG 216 N 0.95 1.10 0.14 0.20 2.47 -1.05 -0.91 114.38 117.30 1fui h ARG 216 Ca 0.22 -0.23 -0.01 0.00 -1.26 0.00 0.00 59.98 58.70 1fui h ARG 216 Cb 0.25 -0.16 0.00 0.00 -1.65 0.00 0.00 29.97 28.41 1fui h ARG 216 CO -0.01 0.94 -0.07 0.82 0.56 0.00 0.00 179.97 182.21 1fui h ILE 217 N 1.06 1.01 -0.57 2.04 2.04 -1.00 0.57 117.51 122.66 1fui h ILE 217 Ca 0.23 -0.95 -0.05 0.00 1.00 0.00 0.00 64.86 65.09 1fui h ILE 217 Cb 0.29 1.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.92 1fui h ILE 217 CO -0.01 0.21 0.15 0.44 0.00 0.00 0.00 178.15 178.94 1fui h ASP 218 N -0.67 0.81 -0.50 1.72 3.32 -0.97 -2.96 116.42 117.17 1fui h ASP 218 Ca -0.02 -0.14 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1fui h ASP 218 Cb 0.50 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1fui h ASP 218 CO 0.03 0.79 0.00 0.00 -1.72 0.00 0.00 179.24 178.34 1fui n GLN 219 N -4.27 3.69 -3.99 3.56 6.02 -0.35 -4.96 117.38 117.08 1fui n GLN 219 Ca 0.04 -2.44 -0.29 0.00 -0.01 0.00 0.00 57.00 54.31 1fui n GLN 219 Cb 0.22 -1.95 -0.01 0.00 1.02 0.00 0.00 30.24 29.53 1fui n GLN 219 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1fui n LYS 220 N 0.70 -3.80 -2.45 -1.09 4.01 -1.12 -4.88 118.16 109.54 1fui n LYS 220 Ca 0.22 0.45 -0.43 0.00 -0.51 0.00 0.00 58.31 58.04 1fui n LYS 220 Cb 0.88 -4.90 0.01 0.00 -0.51 0.00 0.00 35.03 30.51 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 -4.43 4.50 -3.80 -0.18 5.41 0.18 -4.87 119.36 116.16 1fui n ILE 221 Ca -0.15 -4.63 -0.04 0.00 1.00 0.00 0.00 62.75 58.93 1fui n ILE 221 Cb 0.61 -2.32 0.00 0.00 -0.71 0.00 0.00 39.64 37.22 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 -0.08 -0.04 -0.66 1.39 -0.85 -1.26 -4.83 117.35 111.02 1fui s TYR 222 Ca 0.38 -0.32 -0.25 0.00 -0.52 0.00 0.00 57.07 56.37 1fui s TYR 222 Cb 0.09 0.67 0.05 0.00 0.38 0.00 0.00 41.96 43.15 1fui s TYR 222 CO 0.02 -0.90 1.08 0.34 -1.52 0.00 0.00 175.55 174.57 1fui s ASP 223 N -3.11 6.21 0.40 -0.18 2.15 -1.26 -4.91 116.67 115.97 1fui s ASP 223 Ca 0.16 -0.63 0.07 0.00 0.43 0.00 0.00 52.55 52.58 1fui s ASP 223 Cb -0.02 -2.48 0.85 0.00 -0.30 0.00 0.00 42.92 40.97 1fui s ASP 223 CO 0.04 -1.54 2.03 -0.33 -0.17 0.00 0.00 175.17 175.19 1fui h GLU 224 N 9.68 0.58 0.18 4.34 5.08 -1.99 -2.40 114.58 130.04 1fui h GLU 224 Ca -0.28 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.04 1fui h GLU 224 Cb 1.06 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1fui h GLU 224 CO 1.20 0.38 -0.08 0.00 -1.00 0.00 0.00 179.01 179.51 1fui h ALA 225 N 1.70 -0.24 -0.83 3.43 0.00 -2.01 -2.92 119.26 118.40 1fui h ALA 225 Ca 0.20 -0.12 0.12 0.00 0.00 0.00 0.00 54.91 55.11 1fui h ALA 225 Cb 0.06 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.86 1fui h ALA 225 CO -0.05 -0.55 0.44 1.49 0.00 0.00 0.00 179.25 180.58 1fui h GLU 226 N -0.41 0.66 -0.74 0.00 4.81 -1.86 -0.91 114.58 116.13 1fui h GLU 226 Ca -0.02 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.20 1fui h GLU 226 Cb 0.32 -0.15 -0.05 0.00 0.63 0.00 0.00 28.75 29.50 1fui h GLU 226 CO 0.04 0.44 0.46 1.25 -0.73 0.00 0.00 179.01 180.47 1fui h LEU 227 N 0.68 0.75 -0.60 1.64 5.85 -1.34 0.21 115.31 122.50 1fui h LEU 227 Ca 0.43 0.00 0.06 0.00 0.84 0.00 0.00 57.88 59.21 1fui h LEU 227 Cb 0.53 -0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.34 1fui h LEU 227 CO -0.31 0.51 0.32 -0.33 -0.34 0.00 0.00 178.44 178.29 1fui h GLU 228 N 0.89 0.58 -0.65 1.25 5.08 -0.99 -0.78 114.58 119.96 1fui h GLU 228 Ca 0.30 -0.03 -0.08 0.00 -1.00 0.00 0.00 59.36 58.55 1fui h GLU 228 Cb 0.04 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 1fui h GLU 228 CO -0.12 0.38 0.10 1.98 -1.00 0.00 0.00 179.01 180.35 1fui h MET 229 N 0.60 1.07 -0.34 2.33 4.05 -0.70 -1.97 114.93 119.97 1fui h MET 229 Ca 0.27 -0.28 -0.02 0.00 -0.28 0.00 0.00 59.70 59.39 1fui h MET 229 Cb 0.18 -0.13 -0.01 0.00 -0.80 0.00 0.00 31.60 30.84 1fui h MET 229 CO -0.18 0.98 0.12 0.00 0.23 0.00 0.00 176.91 178.06 1fui h ALA 230 N 1.09 0.44 -0.62 0.39 0.00 0.23 -1.67 119.26 119.12 1fui h ALA 230 Ca 0.20 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1fui h ALA 230 Cb 0.44 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1fui h ALA 230 CO 0.01 0.05 0.36 -0.07 0.00 0.00 0.00 179.25 179.60 1fui h LEU 231 N 0.39 0.76 -0.28 0.00 3.38 -1.04 0.29 115.31 118.81 1fui h LEU 231 Ca 0.11 -0.08 0.03 0.00 0.09 0.00 0.00 57.88 58.03 1fui h LEU 231 Cb 0.21 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1fui h LEU 231 CO -0.01 0.62 0.10 0.00 0.09 0.00 0.00 178.44 179.24 1fui h ALA 232 N 1.17 0.31 -0.54 1.53 0.00 -1.18 0.17 119.26 120.73 1fui h ALA 232 Ca 0.22 0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.17 1fui h ALA 232 Cb 0.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 1fui h ALA 232 CO -0.04 -0.31 0.35 2.35 0.00 0.00 0.00 179.25 181.61 1fui h TRP 233 N 0.22 0.66 -0.12 0.00 7.01 -0.91 -0.86 115.95 121.95 1fui h TRP 233 Ca 0.12 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.13 1fui h TRP 233 Cb 0.09 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 26.92 1fui h TRP 233 CO -0.13 0.41 0.05 0.00 -2.79 0.00 0.00 178.44 175.98 1fui h ALA 234 N 1.21 0.16 -0.63 2.65 0.00 -0.37 -1.25 119.26 121.02 1fui h ALA 234 Ca 0.21 -0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1fui h ALA 234 Cb -0.05 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.63 1fui h ALA 234 CO -0.06 -0.27 0.32 -0.44 0.00 0.00 0.00 179.25 178.81 1fui h ASP 235 N 0.05 0.44 0.95 0.00 3.32 -0.33 0.16 116.42 121.01 1fui h ASP 235 Ca 0.04 0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.04 1fui h ASP 235 Cb 0.15 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 1fui h ASP 235 CO -0.00 0.28 -0.44 0.50 -1.72 0.00 0.00 179.24 177.86 1fui h LYS 236 N 0.59 0.00 0.00 3.56 1.63 -1.05 -3.39 116.57 117.90 1fui h LYS 236 Ca 0.29 0.00 -0.08 0.00 -0.85 0.00 0.00 60.65 60.01 1fui h LYS 236 Cb 0.24 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.86 1fui h LYS 236 CO -0.21 0.44 -1.36 0.09 -3.45 0.00 0.00 179.45 174.96 1fui n ASN 237 N -3.49 3.64 -4.69 4.20 3.02 -0.48 -5.04 115.26 112.42 1fui n ASN 237 Ca 0.00 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.13 1fui n ASN 237 Cb 0.57 0.74 -0.03 0.00 -0.61 0.00 0.00 39.78 40.45 1fui n ASN 237 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1fui s PHE 238 N -2.18 2.51 -0.23 3.10 0.40 0.49 -4.81 117.98 117.27 1fui s PHE 238 Ca -0.03 0.38 -0.09 0.00 -0.60 0.00 0.00 56.93 56.59 1fui s PHE 238 Cb 0.02 -3.94 -0.04 0.00 0.51 0.00 0.00 43.02 39.56 1fui s PHE 238 CO 0.23 -3.74 0.12 0.50 0.70 0.00 0.00 175.22 173.02 1fui s ARG 239 N 2.47 3.94 0.07 0.44 3.52 -1.26 -4.97 118.95 123.17 1fui s ARG 239 Ca 0.73 -0.34 -0.03 0.00 -0.13 0.00 0.00 55.73 55.96 1fui s ARG 239 Cb -0.40 -3.41 -0.05 0.00 -1.56 0.00 0.00 34.95 29.53 1fui s ARG 239 CO 0.32 0.05 0.27 0.71 -0.81 0.00 0.00 175.30 175.83 1fui s TYR 240 N 1.05 3.52 0.57 5.12 2.02 -1.26 0.13 117.35 128.49 1fui s TYR 240 Ca 0.06 0.41 0.08 0.00 -0.37 0.00 0.00 57.07 57.25 1fui s TYR 240 Cb -0.14 -1.88 0.10 0.00 -0.40 0.00 0.00 41.96 39.64 1fui s TYR 240 CO 0.04 0.55 0.79 0.41 -1.57 0.00 0.00 175.55 175.77 1fui n GLY 241 N 0.41 1.81 3.75 0.71 0.00 0.03 -4.75 105.19 107.16 1fui n GLY 241 Ca -0.06 -2.20 -0.41 0.00 0.00 0.00 0.00 46.02 43.35 1fui n GLY 241 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1fui s GLU 242 N -4.58 4.45 -0.30 1.61 2.12 -1.26 -4.83 118.70 115.92 1fui s GLU 242 Ca 0.59 1.99 -0.27 0.00 0.36 0.00 0.00 54.97 57.64 1fui s GLU 242 Cb -0.05 -3.18 0.01 0.00 0.26 0.00 0.00 34.13 31.17 1fui s GLU 242 CO 0.38 -0.11 0.98 0.34 -0.54 0.00 0.00 175.26 176.30 1fui s ASP 243 N -0.08 6.88 0.00 -1.70 -1.08 -1.26 -4.69 116.67 114.73 1fui s ASP 243 Ca 0.52 0.99 0.26 0.00 -0.52 0.00 0.00 52.55 53.80 1fui s ASP 243 Cb -0.35 -2.50 0.76 0.00 -1.46 0.00 0.00 42.92 39.37 1fui s ASP 243 CO 0.41 -0.75 1.58 -0.62 0.52 0.00 0.00 175.17 176.31 1fui n GLU 244 N 6.55 1.89 -1.97 4.34 -0.58 -1.26 -4.98 120.64 124.62 1fui n GLU 244 Ca 0.09 -1.30 -0.34 0.00 -0.42 0.00 0.00 57.16 55.19 1fui n GLU 244 Cb 0.47 -1.47 0.03 0.00 -0.57 0.00 0.00 31.44 29.91 1fui n GLU 244 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1fui s ASN 245 N -1.92 5.31 0.45 1.62 0.01 -1.26 -4.97 114.94 114.18 1fui s ASN 245 Ca 0.35 2.14 -0.25 0.00 -0.71 0.00 0.00 52.86 54.39 1fui s ASN 245 Cb 0.20 -2.57 -0.08 0.00 0.41 0.00 0.00 41.25 39.21 1fui s ASN 245 CO 0.32 -1.50 1.43 0.20 -1.51 0.00 0.00 177.10 176.04 1fui s ASN 246 N -2.09 5.84 0.27 -1.22 0.01 -1.26 -4.74 114.94 111.75 1fui s ASN 246 Ca 0.71 2.93 0.00 0.00 -0.71 0.00 0.00 52.86 55.79 1fui s ASN 246 Cb -0.24 -2.65 0.57 0.00 0.41 0.00 0.00 41.25 39.34 1fui s ASN 246 CO 0.35 -1.20 1.75 0.11 -1.51 0.00 0.00 177.10 176.60 1fui h LYS 247 N 2.29 0.58 0.00 -0.60 1.57 -1.96 -0.78 116.57 117.67 1fui h LYS 247 Ca -0.51 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.24 1fui h LYS 247 Cb 1.27 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1fui h LYS 247 CO 0.61 0.39 0.00 0.00 -0.57 0.00 0.00 179.45 179.88 1fui n GLN 248 N -4.89 0.14 -0.00 3.15 0.00 -1.26 -1.77 117.38 112.75 1fui n GLN 248 Ca 0.18 0.56 0.07 0.00 0.00 0.00 0.00 57.00 57.82 1fui n GLN 248 Cb 0.47 -1.89 -0.10 0.00 0.00 0.00 0.00 30.24 28.72 1fui n GLN 248 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1fui n TYR 249 N -2.18 0.00 -1.66 2.61 4.01 -0.34 -4.96 117.16 114.64 1fui n TYR 249 Ca -0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.31 1fui n TYR 249 Cb 0.09 -0.19 -0.03 0.00 -0.31 0.00 0.00 39.34 38.89 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 -2.78 3.75 0.14 -0.72 -0.21 -0.73 -4.96 119.66 114.15 1fui s GLN 250 Ca -0.01 2.37 -0.09 0.00 0.02 0.00 0.00 55.36 57.66 1fui s GLN 250 Cb 0.11 -4.24 -0.06 0.00 1.00 0.00 0.00 33.01 29.82 1fui s GLN 250 CO 0.63 -1.39 0.44 -0.98 -2.12 0.00 0.00 175.29 171.86 1fui s ARG 251 N 5.17 3.75 0.03 2.91 1.70 -1.26 -5.05 118.95 126.20 1fui s ARG 251 Ca 0.92 0.15 0.02 0.00 -0.47 0.00 0.00 55.73 56.35 1fui s ARG 251 Cb -0.39 -2.87 -0.02 0.00 -0.57 0.00 0.00 34.95 31.10 1fui s ARG 251 CO 0.39 0.47 -0.06 -0.80 -1.08 0.00 0.00 175.30 174.22 1fui s ASN 252 N -2.08 0.65 0.89 -2.89 0.02 -1.26 -4.75 114.94 105.52 1fui s ASN 252 Ca 0.39 -0.45 0.00 0.00 -1.02 0.00 0.00 52.86 51.78 1fui s ASN 252 Cb -0.13 0.03 0.00 0.00 0.02 0.00 0.00 41.25 41.17 1fui s ASN 252 CO 0.21 -0.18 0.00 0.00 0.02 0.00 0.00 177.10 177.15 1fui n ALA 253 N 1.78 0.00 0.09 0.60 0.00 -1.26 -3.53 120.51 118.20 1fui n ALA 253 Ca -0.21 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.08 1fui n ALA 253 Cb 0.55 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.93 1fui n ALA 253 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1fui h GLU 254 N 0.00 -0.63 -0.86 0.00 4.39 -2.00 -1.48 114.58 114.00 1fui h GLU 254 Ca 0.00 0.04 0.09 0.00 0.34 0.00 0.00 59.36 59.83 1fui h GLU 254 Cb 0.00 0.14 -0.07 0.00 -0.10 0.00 0.00 28.75 28.72 1fui h GLU 254 CO 0.00 -0.42 0.51 1.96 -1.16 0.00 0.00 179.01 179.90 1fui h GLN 255 N -0.65 0.84 -0.63 2.33 4.20 -1.95 -1.38 115.11 117.87 1fui h GLN 255 Ca 0.02 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.64 1fui h GLN 255 Cb 0.70 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 28.26 1fui h GLN 255 CO -0.29 0.56 0.20 0.77 -0.67 0.00 0.00 178.83 179.40 1fui h SER 256 N 0.87 0.88 -0.14 1.46 0.02 -1.68 -1.46 113.55 113.51 1fui h SER 256 Ca 0.41 -0.15 -0.11 0.00 -0.84 0.00 0.00 61.79 61.10 1fui h SER 256 Cb 0.34 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.63 1fui h SER 256 CO -0.23 0.83 -0.28 -0.09 -1.14 0.00 0.00 176.83 175.91 1fui h ARG 257 N 0.93 0.61 -0.56 3.45 9.65 -0.22 -1.88 114.38 126.36 1fui h ARG 257 Ca 0.21 -0.25 -0.09 0.00 -1.10 0.00 0.00 59.98 58.75 1fui h ARG 257 Cb 0.26 -0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 28.79 1fui h ARG 257 CO -0.01 0.82 -0.00 0.00 2.80 0.00 0.00 179.97 183.58 1fui h ALA 258 N 1.17 0.94 -0.34 2.80 0.00 -0.74 0.45 119.26 123.54 1fui h ALA 258 Ca 0.07 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.61 1fui h ALA 258 Cb 0.75 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1fui h ALA 258 CO 0.06 0.64 -0.08 0.28 0.00 0.00 0.00 179.25 180.15 1fui h VAL 259 N 0.89 1.28 -0.19 0.00 2.07 -1.08 -1.76 116.25 117.45 1fui h VAL 259 Ca 0.16 -1.12 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 1fui h VAL 259 Cb 0.53 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1fui h VAL 259 CO 0.03 0.37 0.07 0.25 0.02 0.00 0.00 177.57 178.31 1fui h LEU 260 N 0.43 0.26 -0.36 2.57 7.12 -1.13 -0.44 115.31 123.76 1fui h LEU 260 Ca 0.09 -0.17 0.03 0.00 0.13 0.00 0.00 57.88 57.96 1fui h LEU 260 Cb 0.57 -0.07 -0.04 0.00 -0.53 0.00 0.00 40.66 40.60 1fui h LEU 260 CO 0.03 0.36 0.15 -0.09 -0.13 0.00 0.00 178.44 178.77 1fui h ARG 261 N 0.15 0.31 -0.36 1.25 2.43 -0.89 -1.83 114.38 115.45 1fui h ARG 261 Ca 0.06 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.10 1fui h ARG 261 Cb 0.18 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 1fui h ARG 261 CO -0.00 0.21 -0.23 1.49 -1.51 0.00 0.00 179.97 179.92 1fui h GLU 262 N 0.32 0.72 -0.56 0.20 4.81 -1.16 -2.50 114.58 116.41 1fui h GLU 262 Ca 0.16 -0.29 0.01 0.00 -0.13 0.00 0.00 59.36 59.11 1fui h GLU 262 Cb 0.11 -0.03 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 1fui h GLU 262 CO -0.14 0.89 0.37 0.77 -0.73 0.00 0.00 179.01 180.17 1fui h SER 263 N 0.63 0.64 -0.37 1.04 0.02 -0.63 -0.90 113.55 113.98 1fui h SER 263 Ca 0.09 -0.02 -0.10 0.00 -0.84 0.00 0.00 61.79 60.92 1fui h SER 263 Cb 0.73 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.09 1fui h SER 263 CO 0.06 0.47 -0.12 -0.07 -1.14 0.00 0.00 176.83 176.02 1fui h LEU 264 N 0.76 0.82 -0.77 5.07 3.38 -1.28 -2.90 115.31 120.40 1fui h LEU 264 Ca 0.21 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 1fui h LEU 264 Cb -0.09 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1fui h LEU 264 CO -0.05 0.96 0.36 -0.07 0.09 0.00 0.00 178.44 179.73 1fui h LEU 265 N 0.74 1.02 -0.68 1.67 3.38 -1.01 -2.04 115.31 118.40 1fui h LEU 265 Ca 0.12 -0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.00 1fui h LEU 265 Cb 0.62 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.06 1fui h LEU 265 CO 0.04 0.88 0.39 0.24 0.09 0.00 0.00 178.44 180.08 1fui h MET 266 N 1.09 0.70 -0.27 1.13 2.86 -0.99 0.35 114.93 119.81 1fui h MET 266 Ca 0.26 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.87 1fui h MET 266 Cb 0.14 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.63 1fui h MET 266 CO -0.03 0.46 0.17 0.00 1.06 0.00 0.00 176.91 178.58 1fui h ALA 267 N 1.34 0.34 -0.06 6.32 0.00 -1.25 -1.12 119.26 124.83 1fui h ALA 267 Ca 0.30 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 1fui h ALA 267 Cb 0.16 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1fui h ALA 267 CO -0.17 -0.20 0.03 0.52 0.00 0.00 0.00 179.25 179.43 1fui h MET 268 N 0.35 0.09 -0.55 0.00 2.07 -0.84 -1.73 114.93 114.32 1fui h MET 268 Ca 0.10 -0.01 -0.09 0.00 -2.07 0.00 0.00 59.70 57.63 1fui h MET 268 Cb -0.03 -0.02 -0.02 0.00 -1.87 0.00 0.00 31.60 29.67 1fui h MET 268 CO -0.03 0.16 -0.03 0.00 1.07 0.00 0.00 176.91 178.08 1fui h ILE 270 N 0.88 1.21 -0.46 0.00 2.04 -1.15 0.30 117.51 120.33 1fui h ILE 270 Ca 0.16 -0.71 0.03 0.00 1.00 0.00 0.00 64.86 65.34 1fui h ILE 270 Cb 0.55 1.20 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 1fui h ILE 270 CO 0.03 0.23 0.25 -0.09 0.00 0.00 0.00 178.15 178.57 1fui h ARG 271 N 0.24 0.48 -0.53 2.37 2.43 -1.14 -1.03 114.38 117.19 1fui h ARG 271 Ca 0.08 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1fui h ARG 271 Cb 0.29 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.70 1fui h ARG 271 CO 0.00 0.32 0.25 -0.44 -1.51 0.00 0.00 179.97 178.59 1fui h ASP 272 N 0.49 0.67 -0.24 -3.80 3.32 -0.83 -1.53 116.42 114.51 1fui h ASP 272 Ca 0.20 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 57.06 1fui h ASP 272 Cb 0.08 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 1fui h ASP 272 CO -0.12 0.58 -0.28 0.24 -1.72 0.00 0.00 179.24 177.94 1fui h MET 273 N 0.75 0.73 0.02 3.56 2.86 -0.05 0.25 114.93 123.04 1fui h MET 273 Ca 0.19 -0.32 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 1fui h MET 273 Cb 0.09 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.73 1fui h MET 273 CO -0.02 0.93 -0.01 0.52 1.06 0.00 0.00 176.91 179.39 1fui h MET 274 N 0.63 -0.02 -0.11 1.72 2.86 -0.42 0.13 114.93 119.72 1fui h MET 274 Ca 0.08 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.72 1fui h MET 274 Cb 0.80 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.46 1fui h MET 274 CO 0.07 0.46 0.00 0.00 1.06 0.00 0.00 176.91 178.50 1fui n GLN 275 N -4.86 1.55 -0.19 1.72 10.64 -0.65 -0.92 117.38 124.66 1fui n GLN 275 Ca -0.08 -1.39 0.02 0.00 -1.83 0.00 0.00 57.00 53.72 1fui n GLN 275 Cb 0.25 -1.14 -0.01 0.00 -0.86 0.00 0.00 30.24 28.48 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 0.21 -2.02 3.33 2.61 0.00 0.86 -4.76 105.19 105.42 1fui n GLY 276 Ca 0.05 -1.45 0.02 0.00 0.00 0.00 0.00 46.02 44.65 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 -5.24 -1.20 0.49 1.61 3.84 0.30 -4.66 114.94 110.09 1fui s ASN 277 Ca 0.00 1.06 0.16 0.00 0.21 0.00 0.00 52.86 54.30 1fui s ASN 277 Cb 0.00 2.13 1.17 0.00 -0.55 0.00 0.00 41.25 44.00 1fui s ASN 277 CO 0.00 -0.23 2.07 0.77 -2.79 0.00 0.00 177.10 176.92 1fui h SER 278 N 7.97 0.00 -0.43 -4.21 4.64 -1.96 -2.51 113.55 117.06 1fui h SER 278 Ca -0.20 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.23 1fui h SER 278 Cb 1.14 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.21 1fui h SER 278 CO 0.17 0.10 0.30 0.11 -0.87 0.00 0.00 176.83 176.65 1fui h LYS 279 N 0.00 0.06 0.00 4.77 1.79 -1.97 0.16 116.57 121.38 1fui h LYS 279 Ca -0.00 -0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.39 1fui h LYS 279 Cb 0.19 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.81 1fui h LYS 279 CO 0.01 0.04 -0.37 -0.07 -1.08 0.00 0.00 179.45 177.98 1fui h LEU 280 N 0.06 0.00 -0.75 2.94 3.38 -1.75 -2.26 115.31 116.94 1fui h LEU 280 Ca 0.20 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 58.04 1fui h LEU 280 Cb 0.72 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.46 1fui h LEU 280 CO -0.01 0.37 -0.51 0.00 0.09 0.00 0.00 178.44 178.37 1fui h ALA 281 N 1.63 0.93 -0.78 1.53 0.00 -0.82 -0.21 119.26 121.54 1fui h ALA 281 Ca -0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 54.91 54.38 1fui h ALA 281 Cb 0.73 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 1fui h ALA 281 CO 0.05 0.67 0.33 -0.44 0.00 0.00 0.00 179.25 179.86 1fui h ASP 282 N 0.23 1.06 -0.09 0.00 3.32 -1.16 -2.66 116.42 117.12 1fui h ASP 282 Ca 0.01 -0.16 0.00 0.00 0.02 0.00 0.00 57.03 56.89 1fui h ASP 282 Cb 0.99 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.26 1fui h ASP 282 CO 0.08 0.93 0.00 2.30 -1.72 0.00 0.00 179.24 180.84 1fui n ILE 283 N -4.32 0.16 -0.72 0.35 -5.35 -1.07 -4.85 119.36 103.56 1fui n ILE 283 Ca 0.07 -0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.42 1fui n ILE 283 Cb 0.17 -0.04 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 0.54 0.64 2.74 3.28 0.00 -1.00 -4.97 105.19 106.41 1fui n GLY 284 Ca 0.03 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.72 3.85 -0.10 1.61 5.12 -0.11 -4.88 116.66 119.42 1fui n ARG 285 Ca 0.00 -4.68 -0.10 0.00 -1.93 0.00 0.00 57.85 51.13 1fui n ARG 285 Cb 0.00 -2.37 -0.03 0.00 -1.16 0.00 0.00 32.46 28.90 1fui n ARG 285 CO 0.00 0.00 0.00 -0.39 -1.93 0.00 0.00 177.63 175.31 1fui h VAL 286 N 3.00 1.20 -0.20 1.55 -1.51 -1.82 -2.76 116.25 115.72 1fui h VAL 286 Ca 0.25 -0.66 0.04 0.00 -1.23 0.00 0.00 66.70 65.11 1fui h VAL 286 Cb 0.54 1.06 -0.04 0.00 -2.13 0.00 0.00 31.29 30.72 1fui h VAL 286 CO 1.05 0.22 -0.06 -0.08 -1.23 0.00 0.00 177.57 177.47 1fui h GLU 287 N 0.34 -0.01 0.00 5.19 4.81 -1.95 -1.94 114.58 121.03 1fui h GLU 287 Ca 0.10 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.32 1fui h GLU 287 Cb 0.25 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.63 1fui h GLU 287 CO -0.00 -0.00 -0.04 0.93 -0.73 0.00 0.00 179.01 179.17 1fui h GLU 288 N -0.01 0.00 0.00 1.92 3.07 -1.95 -2.69 114.58 114.92 1fui h GLU 288 Ca 0.10 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.92 1fui h GLU 288 Cb 0.16 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.06 1fui h GLU 288 CO -0.21 0.04 -0.17 0.66 -1.40 0.00 0.00 179.01 177.92 1fui h SER 289 N 0.00 0.00 -0.40 1.42 4.64 -1.04 -3.23 113.55 114.94 1fui h SER 289 Ca -0.00 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.25 1fui h SER 289 Cb 0.11 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 1fui h SER 289 CO 0.00 0.17 0.02 -0.07 -0.87 0.00 0.00 176.83 176.09 1fui h LEU 290 N 0.00 0.74 0.00 5.97 3.38 -1.52 0.89 115.31 124.76 1fui h LEU 290 Ca -0.00 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1fui h LEU 290 Cb 0.69 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1fui h LEU 290 CO 0.02 0.79 0.00 0.61 0.09 0.00 0.00 178.44 179.95 1fui n GLY 291 N -0.70 -2.39 0.34 0.83 0.00 -1.22 -3.90 105.19 98.15 1fui n GLY 291 Ca 0.03 -1.57 0.04 0.00 0.00 0.00 0.00 46.02 44.51 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 -0.71 0.26 -3.65 1.61 4.01 0.46 -4.82 117.16 114.32 1fui n TYR 292 Ca 0.00 -0.56 -0.26 0.00 -0.16 0.00 0.00 57.90 56.92 1fui n TYR 292 Cb 0.00 -0.06 0.05 0.00 -0.31 0.00 0.00 39.34 39.02 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 -0.13 -5.77 -4.75 7.72 5.15 -1.03 -4.60 115.26 111.85 1fui n ASN 293 Ca 0.07 -0.60 -0.38 0.00 -0.60 0.00 0.00 54.58 53.08 1fui n ASN 293 Cb 0.39 -4.58 -0.06 0.00 -0.53 0.00 0.00 39.78 35.01 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 -3.29 3.51 -1.06 5.20 0.00 -0.10 -1.22 121.76 124.80 1fui s ALA 294 Ca 0.59 -0.12 0.18 0.00 0.00 0.00 0.00 51.96 52.61 1fui s ALA 294 Cb -0.27 -2.65 -0.15 0.00 0.00 0.00 0.00 23.12 20.05 1fui s ALA 294 CO 0.73 0.12 0.81 1.51 0.00 0.00 0.00 175.76 178.92 1fui n ILE 295 N 3.12 0.00 -3.53 0.00 3.06 -0.30 -4.58 119.36 117.13 1fui n ILE 295 Ca -0.08 -0.13 -0.17 0.00 -2.50 0.00 0.00 62.75 59.87 1fui n ILE 295 Cb 0.52 1.05 -0.06 0.00 0.54 0.00 0.00 39.64 41.69 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 -2.56 -1.67 0.20 1.51 0.00 -1.24 -4.49 121.76 113.50 1fui s ALA 296 Ca 0.09 1.16 -0.10 0.00 0.00 0.00 0.00 51.96 53.11 1fui s ALA 296 Cb 0.14 0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.34 1fui s ALA 296 CO 0.67 -0.40 0.34 0.00 0.00 0.00 0.00 175.76 176.37 1fui s ALA 297 N -1.46 0.03 0.01 0.00 0.00 0.21 -1.11 121.76 119.44 1fui s ALA 297 Ca -0.10 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 50.91 1fui s ALA 297 Cb -0.00 1.00 -0.01 0.00 0.00 0.00 0.00 23.12 24.10 1fui s ALA 297 CO 0.07 -0.71 -0.02 0.20 0.00 0.00 0.00 175.76 175.30 1fui s GLY 298 N -3.00 0.13 -0.22 0.00 0.00 -0.50 -0.01 107.32 103.72 1fui s GLY 298 Ca 0.21 -0.23 -0.00 0.00 0.00 0.00 0.00 44.72 44.71 1fui s GLY 298 CO 0.04 -0.24 -0.12 -0.12 0.00 0.00 0.00 173.10 172.66 1fui s PHE 299 N -0.46 2.97 0.10 1.90 5.36 -0.31 -1.20 117.98 126.34 1fui s PHE 299 Ca -0.04 -1.63 -0.31 0.00 -0.96 0.00 0.00 56.93 53.99 1fui s PHE 299 Cb -0.03 -1.99 -0.12 0.00 -0.34 0.00 0.00 43.02 40.54 1fui s PHE 299 CO -0.00 -0.76 1.61 0.37 -1.46 0.00 0.00 175.22 174.97 1fui h GLN 300 N 7.96 -0.66 0.00 10.12 4.15 -1.40 -0.99 115.11 134.29 1fui h GLN 300 Ca -0.37 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.10 1fui h GLN 300 Cb 1.12 0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.96 1fui h GLN 300 CO 0.59 -0.44 0.00 0.41 -1.93 0.00 0.00 178.83 177.46 1fui n GLY 301 N -1.45 1.34 3.77 2.39 0.00 -1.26 -3.89 105.19 106.09 1fui n GLY 301 Ca -0.09 0.20 -0.37 0.00 0.00 0.00 0.00 46.02 45.77 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 3.87 -0.10 1.61 -0.21 -1.26 -1.73 119.66 121.84 1fui s GLN 302 Ca 0.00 1.75 0.16 0.00 0.02 0.00 0.00 55.36 57.30 1fui s GLN 302 Cb 0.00 -2.48 -0.23 0.00 1.00 0.00 0.00 33.01 31.30 1fui s GLN 302 CO 0.00 -0.45 0.42 0.54 -2.12 0.00 0.00 175.29 173.67 1fui n ARG 303 N -0.32 0.66 0.08 2.91 5.12 -1.26 -4.17 116.66 119.68 1fui n ARG 303 Ca 0.06 0.12 0.05 0.00 -1.93 0.00 0.00 57.85 56.15 1fui n ARG 303 Cb 0.48 -1.66 0.48 0.00 -1.16 0.00 0.00 32.46 30.60 1fui n ARG 303 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 1fui h HIS 304 N 0.00 0.35 0.00 -1.55 3.86 -1.97 -1.45 115.15 114.39 1fui h HIS 304 Ca -0.36 0.00 -0.17 0.00 -1.16 0.00 0.00 60.37 58.68 1fui h HIS 304 Cb 1.99 -0.12 -0.02 0.00 1.06 0.00 0.00 27.41 30.32 1fui h HIS 304 CO 0.00 0.24 -0.92 2.35 0.86 0.00 0.00 177.93 180.46 1fui h TRP 305 N 0.37 0.00 0.00 2.45 2.91 -1.67 -3.38 115.95 116.63 1fui h TRP 305 Ca 0.10 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.12 1fui h TRP 305 Cb -0.01 0.00 -0.00 0.00 -0.51 0.00 0.00 29.16 28.64 1fui h TRP 305 CO 0.00 1.32 -0.00 1.79 -1.03 0.00 0.00 178.44 180.52 1fui h THR 306 N -1.00 0.05 0.00 2.65 1.35 -1.51 0.28 112.91 114.74 1fui h THR 306 Ca -0.25 -0.12 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 1fui h THR 306 Cb 1.20 1.11 0.00 0.00 -1.73 0.00 0.00 68.15 68.73 1fui h THR 306 CO -0.15 0.00 0.00 0.47 -0.25 0.00 0.00 175.52 175.59 1fui n ASP 307 N -3.14 0.00 0.00 5.36 8.00 -0.55 -1.91 116.55 124.30 1fui n ASP 307 Ca -0.02 -0.78 0.00 0.00 0.71 0.00 0.00 54.79 54.69 1fui n ASP 307 Cb 0.12 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 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 -1.02 1.57 -4.48 -1.24 10.64 -0.66 -4.60 117.38 117.59 1fui n GLN 308 Ca 0.19 0.00 -0.24 0.00 -1.83 0.00 0.00 57.00 55.13 1fui n GLN 308 Cb 0.10 -0.26 -0.10 0.00 -0.86 0.00 0.00 30.24 29.11 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 -0.50 2.22 0.35 2.61 2.02 0.91 -4.48 117.35 120.47 1fui s TYR 309 Ca 0.00 -0.47 -0.27 0.00 -0.37 0.00 0.00 57.07 55.96 1fui s TYR 309 Cb 0.00 -1.12 -0.12 0.00 -0.40 0.00 0.00 41.96 40.32 1fui s TYR 309 CO 0.00 0.57 1.17 -2.30 -1.57 0.00 0.00 175.55 173.42 1fui n PRO 310 N -0.65 1.77 -1.34 -1.71 -0.02 -1.21 -3.80 135.00 128.04 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 -2.16 0.17 0.00 -0.02 0.00 0.00 33.50 32.11 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 -0.47 2.78 0.00 2.55 2.20 0.19 -4.79 114.94 117.40 1fui s ASN 311 Ca 0.58 0.98 0.14 0.00 -0.94 0.00 0.00 52.86 53.63 1fui s ASN 311 Cb -0.59 -1.54 0.69 0.00 -2.00 0.00 0.00 41.25 37.81 1fui s ASN 311 CO 0.60 -3.01 1.47 0.61 -2.94 0.00 0.00 177.10 173.84 1fui n GLY 312 N -1.65 -0.46 0.39 0.45 0.00 -1.26 -4.51 105.19 98.15 1fui n GLY 312 Ca 0.07 -0.21 -0.10 0.00 0.00 0.00 0.00 46.02 45.78 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 0.84 -1.38 -0.40 1.61 3.32 -1.88 0.00 116.42 118.53 1fui h ASP 313 Ca 0.00 0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.24 1fui h ASP 313 Cb 0.19 0.60 -0.02 0.00 0.22 0.00 0.00 39.33 40.32 1fui h ASP 313 CO 0.00 -0.37 0.18 0.74 -1.72 0.00 0.00 179.24 178.07 1fui h THR 314 N -0.34 1.18 0.25 0.35 2.02 -1.76 -0.65 112.91 113.97 1fui h THR 314 Ca 0.13 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.75 1fui h THR 314 Cb 0.58 0.80 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1fui h THR 314 CO -0.55 0.20 -0.14 0.00 0.37 0.00 0.00 175.52 175.41 1fui h ALA 315 N 1.02 -0.36 -0.53 6.16 0.00 -1.61 -1.11 119.26 122.83 1fui h ALA 315 Ca 0.14 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1fui h ALA 315 Cb 0.15 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1fui h ALA 315 CO -0.01 -0.71 0.30 0.93 0.00 0.00 0.00 179.25 179.76 1fui h GLU 316 N -0.37 0.57 -0.39 0.00 5.08 -0.95 0.10 114.58 118.62 1fui h GLU 316 Ca -0.03 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1fui h GLU 316 Cb 0.29 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 1fui h GLU 316 CO 0.04 0.38 0.19 0.00 -1.00 0.00 0.00 179.01 178.62 1fui h ALA 317 N 1.25 0.51 0.12 3.43 0.00 -0.97 -1.97 119.26 121.63 1fui h ALA 317 Ca 0.22 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1fui h ALA 317 Cb 0.07 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.70 1fui h ALA 317 CO -0.12 0.06 -0.06 0.82 0.00 0.00 0.00 179.25 179.95 1fui h ILE 318 N 0.50 1.06 -0.87 0.00 1.08 -0.92 -2.81 117.51 115.54 1fui h ILE 318 Ca 0.14 -0.82 0.06 0.00 -0.39 0.00 0.00 64.86 63.85 1fui h ILE 318 Cb 0.11 1.56 -0.06 0.00 -3.07 0.00 0.00 36.82 35.36 1fui h ILE 318 CO -0.02 0.19 0.57 -0.07 -0.69 0.00 0.00 178.15 178.13 1fui h LEU 319 N -0.56 0.87 -0.00 1.44 3.38 -0.81 -1.41 115.31 118.22 1fui h LEU 319 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1fui h LEU 319 Cb 0.44 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1fui h LEU 319 CO 0.03 0.56 -0.01 0.59 0.09 0.00 0.00 178.44 179.70 1fui n ASN 320 N -4.48 0.01 -4.91 -0.43 3.02 -0.74 -0.48 115.26 107.24 1fui n ASN 320 Ca 0.13 0.17 -0.27 0.00 -0.03 0.00 0.00 54.58 54.58 1fui n ASN 320 Cb 0.20 -0.39 0.05 0.00 -0.61 0.00 0.00 39.78 39.03 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 -2.79 5.32 -0.14 6.41 0.01 -0.53 -4.33 113.70 117.65 1fui s SER 321 Ca 0.21 0.74 0.08 0.00 1.31 0.00 0.00 55.95 58.29 1fui s SER 321 Cb 0.20 -1.59 0.48 0.00 0.21 0.00 0.00 66.02 65.31 1fui s SER 321 CO 0.50 -1.29 1.24 -1.20 0.41 0.00 0.00 173.24 172.90 1fui n SER 322 N -2.79 3.75 -3.59 2.44 7.64 -1.26 -4.09 113.62 115.71 1fui n SER 322 Ca 0.06 -2.56 -0.06 0.00 1.01 0.00 0.00 58.87 57.32 1fui n SER 322 Cb 0.58 -0.61 -0.02 0.00 -1.01 0.00 0.00 64.21 63.15 1fui n SER 322 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1fui s PHE 323 N -2.02 -0.26 0.00 1.43 -0.12 -1.26 -0.51 117.98 115.24 1fui s PHE 323 Ca 0.32 0.07 0.00 0.00 -0.05 0.00 0.00 56.93 57.27 1fui s PHE 323 Cb 0.24 0.57 0.00 0.00 -0.63 0.00 0.00 43.02 43.21 1fui s PHE 323 CO 0.09 -0.62 0.00 -0.40 -0.05 0.00 0.00 175.22 174.24 1fui n ASP 324 N -0.32 0.00 0.27 1.98 5.68 -0.99 -4.89 116.55 118.29 1fui n ASP 324 Ca -0.08 -0.60 0.16 0.00 -0.50 0.00 0.00 54.79 53.77 1fui n ASP 324 Cb 0.61 0.00 0.75 0.00 -1.14 0.00 0.00 41.12 41.34 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 0.60 0.00 -0.47 2.11 0.09 -1.94 -0.27 115.95 116.07 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 -3.06 2.75 0.00 0.11 3.02 -1.26 -5.01 115.26 111.81 1fui n ASN 326 Ca 0.01 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.59 1fui n ASN 326 Cb 0.49 -0.31 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 1.33 -1.78 3.80 7.41 0.00 -0.11 -4.97 105.19 110.87 1fui n GLY 327 Ca 0.18 -2.05 -0.35 0.00 0.00 0.00 0.00 46.02 43.80 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 -0.04 4.19 0.35 1.61 -7.23 -1.26 -2.34 120.40 115.68 1fui s VAL 328 Ca 0.00 1.52 -0.15 0.00 -1.81 0.00 0.00 61.98 61.55 1fui s VAL 328 Cb 0.00 -3.71 0.03 0.00 0.56 0.00 0.00 36.38 33.27 1fui s VAL 328 CO 0.00 -0.14 0.70 0.00 -0.31 0.00 0.00 175.10 175.35 1fui s ARG 329 N -2.79 2.04 0.20 4.82 1.70 0.34 -4.93 118.95 120.33 1fui s ARG 329 Ca 0.59 -1.38 -0.30 0.00 -0.47 0.00 0.00 55.73 54.17 1fui s ARG 329 Cb -0.14 0.58 -0.09 0.00 -0.57 0.00 0.00 34.95 34.74 1fui s ARG 329 CO 0.18 -0.93 1.31 -2.00 -1.08 0.00 0.00 175.30 172.79 1fui s GLU 330 N -2.91 4.39 0.58 3.89 2.12 -1.26 -4.36 118.70 121.15 1fui s GLU 330 Ca 0.17 2.05 -0.18 0.00 0.36 0.00 0.00 54.97 57.38 1fui s GLU 330 Cb -0.04 -3.19 -0.04 0.00 0.26 0.00 0.00 34.13 31.11 1fui s GLU 330 CO 0.12 -0.25 1.11 -1.25 -0.54 0.00 0.00 175.26 174.44 1fui s PRO 331 N -0.11 3.21 0.57 4.30 0.04 -1.26 -4.90 135.00 136.85 1fui s PRO 331 Ca 0.57 1.46 0.00 0.00 0.04 0.00 0.00 61.00 63.07 1fui s PRO 331 Cb -0.36 -2.00 0.04 0.00 0.04 0.00 0.00 34.50 32.22 1fui s PRO 331 CO 0.38 -0.94 0.81 -0.06 0.04 0.00 0.00 177.00 177.24 1fui s PHE 332 N -2.06 2.83 -0.38 0.56 0.08 0.37 -5.00 117.98 114.37 1fui s PHE 332 Ca 0.69 0.04 0.03 0.00 0.12 0.00 0.00 56.93 57.81 1fui s PHE 332 Cb -0.21 -2.82 0.11 0.00 -0.57 0.00 0.00 43.02 39.53 1fui s PHE 332 CO 0.32 -0.97 0.11 0.08 -0.10 0.00 0.00 175.22 174.67 1fui s VAL 333 N -2.83 2.49 -0.25 -0.44 1.01 -1.26 -4.24 120.40 114.87 1fui s VAL 333 Ca 0.58 -2.47 0.03 0.00 0.00 0.00 0.00 61.98 60.11 1fui s VAL 333 Cb -0.10 -2.80 0.06 0.00 0.00 0.00 0.00 36.38 33.54 1fui s VAL 333 CO 0.39 -0.65 -0.12 -0.69 0.00 0.00 0.00 175.10 174.04 1fui s VAL 334 N 0.73 2.11 -0.03 2.92 1.01 -1.26 -0.62 120.40 125.26 1fui s VAL 334 Ca 0.12 -1.52 -0.28 0.00 0.00 0.00 0.00 61.98 60.29 1fui s VAL 334 Cb -0.21 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.95 1fui s VAL 334 CO -0.06 0.03 0.92 0.00 0.00 0.00 0.00 175.10 175.99 1fui s ALA 335 N 1.14 3.23 0.47 5.51 0.00 0.99 -4.93 121.76 128.17 1fui s ALA 335 Ca -0.07 0.43 -0.20 0.00 0.00 0.00 0.00 51.96 52.11 1fui s ALA 335 Cb -0.19 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.57 1fui s ALA 335 CO -0.06 -0.24 1.01 -0.08 0.00 0.00 0.00 175.76 176.39 1fui s THR 336 N 1.07 3.99 -1.93 0.00 -1.32 -1.26 -1.16 115.64 115.03 1fui s THR 336 Ca 0.48 1.24 0.00 0.00 -1.21 0.00 0.00 61.69 62.20 1fui s THR 336 Cb -0.20 -3.50 0.00 0.00 -1.51 0.00 0.00 72.50 67.29 1fui s THR 336 CO 0.25 -0.27 0.00 -0.62 -2.21 0.00 0.00 174.62 171.77 1fui n GLU 337 N -0.86 -1.38 -3.62 7.08 1.02 -0.65 -2.31 120.64 119.93 1fui n GLU 337 Ca 0.09 1.11 -0.27 0.00 -0.02 0.00 0.00 57.16 58.06 1fui n GLU 337 Cb 0.53 -5.48 -0.01 0.00 -0.02 0.00 0.00 31.44 26.46 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 -1.23 -3.75 -4.56 1.62 5.15 -0.47 -4.30 115.26 107.73 1fui n ASN 338 Ca -0.20 -0.57 -0.42 0.00 -0.60 0.00 0.00 54.58 52.79 1fui n ASN 338 Cb 0.64 -3.08 -0.02 0.00 -0.53 0.00 0.00 39.78 36.79 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 -2.91 6.63 0.35 1.20 -1.08 -0.98 -3.89 116.67 115.99 1fui s ASP 339 Ca 0.51 -1.83 0.08 0.00 -0.52 0.00 0.00 52.55 50.79 1fui s ASP 339 Cb -0.27 -2.56 0.78 0.00 -1.46 0.00 0.00 42.92 39.41 1fui s ASP 339 CO 0.63 -1.36 1.87 0.77 0.52 0.00 0.00 175.17 177.60 1fui h SER 340 N 8.99 0.68 0.18 -0.34 4.64 -1.76 -0.41 113.55 125.53 1fui h SER 340 Ca 0.28 0.04 -0.07 0.00 -0.47 0.00 0.00 61.79 61.56 1fui h SER 340 Cb 0.96 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.94 1fui h SER 340 CO 1.42 0.36 -0.28 -0.07 -0.87 0.00 0.00 176.83 177.39 1fui h LEU 341 N 0.73 0.16 -0.13 5.97 3.38 -1.88 0.24 115.31 123.78 1fui h LEU 341 Ca 0.44 -0.05 -0.22 0.00 0.09 0.00 0.00 57.88 58.15 1fui h LEU 341 Cb 0.66 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 1fui h LEU 341 CO -0.20 0.44 -0.98 -1.13 0.09 0.00 0.00 178.44 176.66 1fui h ASN 342 N 0.15 0.22 -0.34 -0.43 -1.24 -1.47 -2.84 115.58 109.64 1fui h ASN 342 Ca 0.02 -0.21 0.01 0.00 0.71 0.00 0.00 56.30 56.83 1fui h ASN 342 Cb 0.57 -0.07 -0.02 0.00 0.73 0.00 0.00 38.32 39.54 1fui h ASN 342 CO 0.04 1.07 0.22 1.23 -1.29 0.00 0.00 177.43 178.70 1fui h GLY 343 N 2.08 0.48 0.92 1.57 0.00 0.48 0.21 103.07 108.80 1fui h GLY 343 Ca -0.05 -0.17 0.02 0.00 0.00 0.00 0.00 47.33 47.13 1fui h GLY 343 CO 0.15 0.16 0.47 -2.08 0.00 0.00 0.00 176.54 175.24 1fui h VAL 344 N 0.44 1.13 -0.72 4.60 2.07 -0.60 0.29 116.25 123.47 1fui h VAL 344 Ca 0.13 -0.32 -0.05 0.00 0.82 0.00 0.00 66.70 67.28 1fui h VAL 344 Cb -0.03 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 29.83 1fui h VAL 344 CO -0.04 0.17 0.26 0.00 0.02 0.00 0.00 177.57 177.98 1fui h ALA 345 N 1.29 0.94 -0.67 1.67 0.00 -1.19 -0.66 119.26 120.65 1fui h ALA 345 Ca 0.28 -0.21 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1fui h ALA 345 Cb -0.03 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1fui h ALA 345 CO -0.09 0.59 0.10 0.52 0.00 0.00 0.00 179.25 180.38 1fui h MET 346 N 1.05 1.11 0.11 0.00 2.86 -0.04 -1.30 114.93 118.73 1fui h MET 346 Ca 0.24 -0.30 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1fui h MET 346 Cb 0.26 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1fui h MET 346 CO -0.01 1.02 -0.05 1.25 1.06 0.00 0.00 176.91 180.17 1fui h LEU 347 N 1.04 -0.13 0.03 1.22 6.46 0.05 0.38 115.31 124.36 1fui h LEU 347 Ca 0.20 -0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.95 1fui h LEU 347 Cb 0.45 0.03 -0.03 0.00 -0.73 0.00 0.00 40.66 40.39 1fui h LEU 347 CO 0.01 -0.06 -0.15 0.24 -0.62 0.00 0.00 178.44 177.87 1fui h MET 348 N -0.19 -0.25 -0.63 1.25 2.86 -1.02 0.06 114.93 117.01 1fui h MET 348 Ca -0.02 0.02 0.06 0.00 -2.06 0.00 0.00 59.70 57.70 1fui h MET 348 Cb 0.15 0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.81 1fui h MET 348 CO 0.03 -0.17 0.34 0.78 1.06 0.00 0.00 176.91 178.94 1fui h GLY 349 N -0.26 0.91 0.98 8.32 0.00 -1.09 -0.74 103.07 111.20 1fui h GLY 349 Ca 0.04 -0.23 -0.09 0.00 0.00 0.00 0.00 47.33 47.05 1fui h GLY 349 CO -0.12 0.14 -0.09 0.84 0.00 0.00 0.00 176.54 177.30 1fui h HIS 350 N 0.63 0.87 -0.02 5.60 6.17 -0.66 -1.42 115.15 126.32 1fui h HIS 350 Ca 0.28 -0.18 -0.06 0.00 0.71 0.00 0.00 60.37 61.12 1fui h HIS 350 Cb 0.19 -0.21 -0.01 0.00 2.52 0.00 0.00 27.41 29.89 1fui h HIS 350 CO -0.09 0.90 -0.26 1.96 0.71 0.00 0.00 177.93 181.15 1fui h GLN 351 N 0.60 0.03 0.04 5.26 1.08 -0.61 0.74 115.11 122.25 1fui h GLN 351 Ca 0.10 -0.01 -0.23 0.00 -1.45 0.00 0.00 58.65 57.06 1fui h GLN 351 Cb 0.61 -0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.01 1fui h GLN 351 CO 0.04 0.29 -1.12 -0.07 -0.95 0.00 0.00 178.83 177.02 1fui h LEU 352 N 0.03 0.12 0.00 1.46 3.38 -0.94 -3.41 115.31 115.95 1fui h LEU 352 Ca 0.00 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.84 1fui h LEU 352 Cb 0.47 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.18 1fui h LEU 352 CO 0.03 1.10 -1.11 0.35 0.09 0.00 0.00 178.44 178.91 1fui n THR 353 N -3.38 0.03 -1.05 0.22 -2.24 -0.55 -5.00 114.28 102.30 1fui n THR 353 Ca -0.04 -0.06 -0.02 0.00 -2.27 0.00 0.00 64.05 61.67 1fui n THR 353 Cb 0.97 0.20 -0.01 0.00 -2.10 0.00 0.00 70.33 69.39 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 2.47 0.52 3.89 3.38 0.00 0.26 -4.68 105.19 111.02 1fui n GLY 354 Ca -0.01 -0.36 -0.22 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.94 2.42 0.35 2.61 -4.23 -1.26 -3.72 115.64 109.87 1fui s THR 355 Ca 0.00 -1.36 -0.26 0.00 -1.18 0.00 0.00 61.69 58.88 1fui s THR 355 Cb 0.00 -2.79 -0.09 0.00 1.34 0.00 0.00 72.50 70.96 1fui s THR 355 CO 0.00 0.00 1.09 0.00 -0.54 0.00 0.00 174.62 175.17 1fui s ALA 356 N -2.55 3.22 -0.07 3.99 0.00 -1.26 -4.53 121.76 120.56 1fui s ALA 356 Ca 0.46 0.83 -0.00 0.00 0.00 0.00 0.00 51.96 53.25 1fui s ALA 356 Cb -0.03 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.75 1fui s ALA 356 CO 0.27 -0.26 -0.04 -0.65 0.00 0.00 0.00 175.76 175.08 1fui s GLN 357 N -2.06 2.83 -0.29 0.00 -1.52 -1.26 -4.77 119.66 112.58 1fui s GLN 357 Ca 0.53 -0.50 -0.13 0.00 -1.95 0.00 0.00 55.36 53.31 1fui s GLN 357 Cb -0.28 -2.67 -0.04 0.00 -0.22 0.00 0.00 33.01 29.81 1fui s GLN 357 CO 0.35 0.68 0.26 0.08 -0.25 0.00 0.00 175.29 176.40 1fui s VAL 358 N -0.85 5.26 -0.00 1.09 1.01 -0.94 -4.40 120.40 121.58 1fui s VAL 358 Ca 0.13 0.20 -0.22 0.00 0.00 0.00 0.00 61.98 62.09 1fui s VAL 358 Cb -0.11 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 1fui s VAL 358 CO 0.02 0.16 0.67 0.12 0.00 0.00 0.00 175.10 176.07 1fui s PHE 359 N 1.86 3.68 -0.00 5.22 2.19 -1.26 -1.14 117.98 128.52 1fui s PHE 359 Ca 0.09 1.29 -0.10 0.00 0.33 0.00 0.00 56.93 58.55 1fui s PHE 359 Cb -0.16 -2.71 0.01 0.00 -1.31 0.00 0.00 43.02 38.84 1fui s PHE 359 CO 0.11 0.27 0.19 0.00 1.83 0.00 0.00 175.22 177.62 1fui s ALA 360 N 0.05 -0.47 -0.11 11.12 0.00 -0.76 -4.28 121.76 127.31 1fui s ALA 360 Ca 0.35 0.00 -0.15 0.00 0.00 0.00 0.00 51.96 52.16 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 0.19 -0.23 0.35 -0.51 0.00 0.00 0.00 175.76 175.56 1fui s ASP 361 N -1.38 6.57 -1.12 0.00 1.11 -1.05 -1.38 116.67 119.42 1fui s ASP 361 Ca -0.14 0.68 -0.17 0.00 0.18 0.00 0.00 52.55 53.09 1fui s ASP 361 Cb -0.07 -2.21 0.12 0.00 1.07 0.00 0.00 42.92 41.83 1fui s ASP 361 CO 0.02 0.15 1.41 -0.69 1.18 0.00 0.00 175.17 177.24 1fui s VAL 362 N 0.06 4.61 -0.10 -1.27 1.01 -0.10 -1.90 120.40 122.70 1fui s VAL 362 Ca 0.20 -1.92 -0.26 0.00 0.00 0.00 0.00 61.98 60.00 1fui s VAL 362 Cb -0.14 -4.95 -0.22 0.00 0.00 0.00 0.00 36.38 31.07 1fui s VAL 362 CO 0.07 -1.71 0.88 -0.09 0.00 0.00 0.00 175.10 174.25 1fui h ARG 363 N 8.10 -0.02 -3.70 2.72 2.43 -1.53 -3.48 114.38 118.89 1fui h ARG 363 Ca 0.28 0.00 -0.18 0.00 -0.81 0.00 0.00 59.98 59.27 1fui h ARG 363 Cb 0.94 0.01 -0.24 0.00 -0.42 0.00 0.00 29.97 30.25 1fui h ARG 363 CO 1.27 0.73 -0.63 0.99 -1.51 0.00 0.00 179.97 180.82 1fui s THR 364 N -2.86 0.06 -0.25 0.20 2.01 -1.19 -4.98 115.64 108.62 1fui s THR 364 Ca -0.17 -0.46 -0.08 0.00 0.31 0.00 0.00 61.69 61.30 1fui s THR 364 Cb -0.01 -0.22 -0.03 0.00 0.01 0.00 0.00 72.50 72.24 1fui s THR 364 CO 0.63 -0.25 0.08 -0.47 -0.69 0.00 0.00 174.62 173.91 1fui s TYR 365 N -0.79 3.10 -0.40 4.92 5.04 -1.26 -0.48 117.35 127.49 1fui s TYR 365 Ca -0.09 -0.35 -0.11 0.00 -2.44 0.00 0.00 57.07 54.08 1fui s TYR 365 Cb -0.05 -2.24 0.05 0.00 0.35 0.00 0.00 41.96 40.07 1fui s TYR 365 CO 0.00 -0.31 0.23 -1.58 -1.34 0.00 0.00 175.55 172.55 1fui s TRP 366 N 1.54 3.27 0.56 4.97 0.52 0.27 -4.99 118.94 125.09 1fui s TRP 366 Ca 0.06 -1.15 -0.16 0.00 0.02 0.00 0.00 56.10 54.87 1fui s TRP 366 Cb -0.15 -2.65 -0.06 0.00 -1.15 0.00 0.00 33.47 29.46 1fui s TRP 366 CO 0.04 -0.73 1.02 -1.54 0.02 0.00 0.00 176.95 175.76 1fui s SER 367 N 1.80 6.22 0.42 2.95 1.04 -1.26 -1.37 113.70 123.50 1fui s SER 367 Ca 0.02 1.66 0.12 0.00 0.48 0.00 0.00 55.95 58.24 1fui s SER 367 Cb -0.21 -2.52 0.98 0.00 0.10 0.00 0.00 66.02 64.37 1fui s SER 367 CO 0.05 -0.87 1.99 1.55 0.98 0.00 0.00 173.24 176.95 1fui h PRO 368 N 0.61 0.45 -0.40 4.02 0.13 -1.88 -0.40 132.00 134.53 1fui h PRO 368 Ca -0.47 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.60 1fui h PRO 368 Cb 1.20 -0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 1fui h PRO 368 CO 0.60 0.30 0.11 0.93 -0.23 0.00 0.00 178.00 179.70 1fui h GLU 369 N 0.46 0.62 -0.66 0.86 3.07 -1.98 -0.66 114.58 116.29 1fui h GLU 369 Ca 0.26 -0.14 -0.04 0.00 -0.50 0.00 0.00 59.36 58.93 1fui h GLU 369 Cb 0.42 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.21 1fui h GLU 369 CO -0.07 0.64 0.25 0.00 -1.40 0.00 0.00 179.01 178.42 1fui h ALA 370 N 0.96 0.87 0.16 3.43 0.00 -1.68 0.47 119.26 123.46 1fui h ALA 370 Ca 0.13 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1fui h ALA 370 Cb 0.28 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1fui h ALA 370 CO -0.00 0.50 -0.08 0.82 0.00 0.00 0.00 179.25 180.50 1fui h ILE 371 N 0.95 0.90 -0.48 0.00 1.08 -0.92 -2.06 117.51 116.98 1fui h ILE 371 Ca 0.22 -0.23 0.05 0.00 -0.39 0.00 0.00 64.86 64.51 1fui h ILE 371 Cb 0.24 1.04 -0.05 0.00 -3.07 0.00 0.00 36.82 34.98 1fui h ILE 371 CO -0.01 0.05 0.21 -0.08 -0.69 0.00 0.00 178.15 177.63 1fui h GLU 372 N -0.32 0.41 -0.14 2.37 4.81 -0.90 -0.37 114.58 120.44 1fui h GLU 372 Ca -0.02 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.20 1fui h GLU 372 Cb 0.25 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.52 1fui h GLU 372 CO 0.04 0.27 0.01 -0.09 -0.73 0.00 0.00 179.01 178.50 1fui h ARG 373 N 0.42 0.05 0.00 1.92 2.43 -0.75 0.30 114.38 118.76 1fui h ARG 373 Ca 0.22 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.35 1fui h ARG 373 Cb 0.17 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1fui h ARG 373 CO -0.18 0.04 -0.30 -0.39 -1.51 0.00 0.00 179.97 177.63 1fui h VAL 374 N 0.05 0.21 0.00 0.20 -1.51 -1.12 -3.39 116.25 110.70 1fui h VAL 374 Ca 0.06 -1.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.22 1fui h VAL 374 Cb 0.07 2.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.26 1fui h VAL 374 CO -0.10 0.12 -0.53 0.35 -1.23 0.00 0.00 177.57 176.18 1fui n THR 375 N -3.07 0.00 0.00 7.19 -2.24 -0.17 -5.04 114.28 110.96 1fui n THR 375 Ca 0.03 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1fui n THR 375 Cb 0.59 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 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 1.60 3.01 3.66 3.38 0.00 0.10 -5.01 105.19 111.93 1fui n GLY 376 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -1.41 3.30 -0.15 1.61 3.76 -1.26 -4.91 115.29 116.22 1fui s HIS 377 Ca 0.00 1.43 -0.29 0.00 -0.15 0.00 0.00 55.06 56.05 1fui s HIS 377 Cb 0.00 -3.29 -0.00 0.00 1.11 0.00 0.00 32.58 30.40 1fui s HIS 377 CO 0.00 -0.59 1.02 0.21 -0.85 0.00 0.00 174.74 174.53 1fui s LYS 378 N 3.22 4.36 0.11 1.40 2.20 -1.26 -4.15 119.74 125.61 1fui s LYS 378 Ca 0.45 1.38 -0.10 0.00 -0.36 0.00 0.00 55.97 57.34 1fui s LYS 378 Cb -0.16 -3.58 -0.06 0.00 -1.51 0.00 0.00 37.83 32.52 1fui s LYS 378 CO 0.07 -0.44 0.44 -0.51 -0.36 0.00 0.00 175.35 174.55 1fui s LEU 379 N 2.47 4.33 0.00 5.43 1.02 -1.26 -5.10 118.68 125.56 1fui s LEU 379 Ca 0.47 0.84 0.00 0.00 0.02 0.00 0.00 54.13 55.45 1fui s LEU 379 Cb -0.17 -3.12 0.00 0.00 0.02 0.00 0.00 46.19 42.92 1fui s LEU 379 CO 0.13 0.13 0.00 -0.90 0.02 0.00 0.00 176.35 175.73 1fui n ASP 380 N 0.74 0.54 0.00 2.29 5.68 -1.26 -4.43 116.55 120.10 1fui n ASP 380 Ca -0.06 -0.78 0.00 0.00 -0.50 0.00 0.00 54.79 53.44 1fui n ASP 380 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1fui n ASP 380 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1fui n GLY 381 N 1.35 0.26 0.29 6.12 0.00 -1.26 -2.99 105.19 108.96 1fui n GLY 381 Ca 0.00 -0.90 0.02 0.00 0.00 0.00 0.00 46.02 45.14 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 0.43 -0.10 0.99 -0.00 -1.99 -2.19 115.31 112.44 1fui h LEU 382 Ca 0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 57.88 57.84 1fui h LEU 382 Cb 0.00 -0.11 0.00 0.00 -0.00 0.00 0.00 40.66 40.55 1fui h LEU 382 CO 0.00 0.41 0.00 0.00 -0.00 0.00 0.00 178.44 178.85 1fui n ALA 383 N -2.48 2.66 -0.18 1.53 0.00 -1.21 -4.28 120.51 116.55 1fui n ALA 383 Ca 0.02 -0.21 0.23 0.00 0.00 0.00 0.00 53.44 53.48 1fui n ALA 383 Cb 0.15 -1.43 0.63 0.00 0.00 0.00 0.00 19.45 18.80 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 0.24 0.16 -0.44 0.00 4.81 -1.29 -2.52 114.58 115.54 1fui h GLU 384 Ca 0.00 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1fui h GLU 384 Cb 0.05 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1fui h GLU 384 CO 0.00 0.11 0.00 0.72 -0.73 0.00 0.00 179.01 179.11 1fui n HIS 385 N -4.38 0.57 0.00 0.92 8.25 -1.26 -4.82 115.22 114.50 1fui n HIS 385 Ca 0.17 -0.34 0.00 0.00 -0.26 0.00 0.00 57.72 57.29 1fui n HIS 385 Cb 0.80 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.90 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 1.28 3.05 3.21 -1.41 0.00 -0.95 -4.32 105.19 106.04 1fui n GLY 386 Ca 0.18 -1.95 -0.13 0.00 0.00 0.00 0.00 46.02 44.13 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 0.06 -0.16 -0.61 2.07 -0.47 -4.72 121.20 115.18 1fui s ILE 387 Ca 0.00 -0.54 -0.00 0.00 -1.41 0.00 0.00 60.65 58.70 1fui s ILE 387 Cb 0.00 -0.57 -0.00 0.00 0.13 0.00 0.00 42.46 42.01 1fui s ILE 387 CO 0.00 -0.29 -0.14 -0.63 -1.91 0.00 0.00 174.94 171.96 1fui s ILE 388 N -1.37 2.76 -0.39 2.00 1.01 -0.09 -0.56 121.20 124.55 1fui s ILE 388 Ca -0.14 -0.74 -0.24 0.00 0.00 0.00 0.00 60.65 59.54 1fui s ILE 388 Cb -0.06 -2.17 0.01 0.00 0.01 0.00 0.00 42.46 40.26 1fui s ILE 388 CO 0.03 0.51 0.81 -2.28 0.00 0.00 0.00 174.94 174.02 1fui s HIS 389 N 0.81 3.07 -0.33 3.97 5.65 0.37 -1.19 115.29 127.64 1fui s HIS 389 Ca -0.05 0.49 -0.08 0.00 0.25 0.00 0.00 55.06 55.68 1fui s HIS 389 Cb -0.15 -3.53 0.02 0.00 -1.18 0.00 0.00 32.58 27.74 1fui s HIS 389 CO 0.00 -0.82 0.12 -0.51 -0.65 0.00 0.00 174.74 172.88 1fui s LEU 390 N 3.24 4.23 -0.07 8.88 1.43 -0.39 -1.44 118.68 134.56 1fui s LEU 390 Ca 0.32 -0.89 -0.03 0.00 -1.03 0.00 0.00 54.13 52.50 1fui s LEU 390 Cb -0.13 -1.92 0.04 0.00 0.03 0.00 0.00 46.19 44.21 1fui s LEU 390 CO 0.19 -0.28 0.07 -0.63 0.23 0.00 0.00 176.35 175.93 1fui s ILE 391 N 1.49 -0.11 0.43 -0.59 1.01 -0.80 -1.42 121.20 121.21 1fui s ILE 391 Ca 0.01 0.31 -0.20 0.00 0.00 0.00 0.00 60.65 60.78 1fui s ILE 391 Cb -0.18 -0.24 -0.10 0.00 0.01 0.00 0.00 42.46 41.94 1fui s ILE 391 CO 0.04 0.09 0.93 0.21 0.00 0.00 0.00 174.94 176.21 1fui s ASN 392 N 2.17 6.87 0.00 3.58 2.47 -1.25 -2.53 114.94 126.26 1fui s ASN 392 Ca 0.04 1.62 -0.02 0.00 0.42 0.00 0.00 52.86 54.93 1fui s ASN 392 Cb -0.13 -2.52 -0.08 0.00 -1.45 0.00 0.00 41.25 37.08 1fui s ASN 392 CO -0.04 -0.38 1.41 -1.54 -3.72 0.00 0.00 177.10 172.83 1fui n SER 393 N -0.76 1.76 0.00 -4.21 3.41 -1.26 -4.21 113.62 108.34 1fui n SER 393 Ca 0.07 -1.77 0.00 0.00 -0.26 0.00 0.00 58.87 56.90 1fui n SER 393 Cb 0.54 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 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 2.68 1.68 3.11 5.00 0.00 -1.26 -4.98 105.19 111.42 1fui n GLY 394 Ca 0.12 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.05 1fui n GLY 394 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1fui s SER 395 N -1.29 0.75 -0.28 1.61 1.04 -1.26 -1.53 113.70 112.74 1fui s SER 395 Ca 0.00 -0.95 -0.27 0.00 0.48 0.00 0.00 55.95 55.21 1fui s SER 395 Cb 0.00 0.15 0.18 0.00 0.10 0.00 0.00 66.02 66.45 1fui s SER 395 CO 0.00 -0.51 1.35 0.00 0.98 0.00 0.00 173.24 175.06 1fui s ALA 396 N -3.54 -2.15 0.14 5.32 0.00 -1.26 -4.56 121.76 115.71 1fui s ALA 396 Ca 0.07 1.76 -0.34 0.00 0.00 0.00 0.00 51.96 53.45 1fui s ALA 396 Cb 0.05 -1.59 -0.14 0.00 0.00 0.00 0.00 23.12 21.44 1fui s ALA 396 CO -0.07 -0.17 1.55 0.00 0.00 0.00 0.00 175.76 177.07 1fui n ALA 397 N 1.20 0.95 0.30 0.00 0.00 -1.26 -4.59 120.51 117.10 1fui n ALA 397 Ca -0.07 0.45 0.15 0.00 0.00 0.00 0.00 53.44 53.97 1fui n ALA 397 Cb 0.58 -2.31 0.91 0.00 0.00 0.00 0.00 19.45 18.62 1fui n ALA 397 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1fui h LEU 398 N 5.83 0.00 -2.10 0.00 3.38 -1.87 0.14 115.31 120.68 1fui h LEU 398 Ca -0.45 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.59 1fui h LEU 398 Cb 1.27 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 1fui h LEU 398 CO 0.87 0.01 0.22 0.44 0.09 0.00 0.00 178.44 180.07 1fui h ASP 399 N 0.00 0.00 0.00 -0.43 5.19 -1.91 -1.75 116.42 117.52 1fui h ASP 399 Ca -0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1fui h ASP 399 Cb 0.02 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.53 1fui h ASP 399 CO 0.00 0.00 0.08 0.61 -3.12 0.00 0.00 179.24 176.81 1fui n GLY 400 N -1.51 -0.71 0.27 2.75 0.00 0.47 -1.44 105.19 105.02 1fui n GLY 400 Ca 0.03 0.14 0.16 0.00 0.00 0.00 0.00 46.02 46.35 1fui n GLY 400 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1fui h SER 401 N 0.00 0.00 -4.41 1.61 4.64 -1.52 -3.40 113.55 110.48 1fui h SER 401 Ca 0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.01 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 0.06 -0.50 0.00 -0.87 0.00 0.00 176.83 175.52 1fui n LYS 403 N -3.77 0.13 -1.83 0.00 4.76 -1.26 -3.93 118.16 112.25 1fui n LYS 403 Ca -0.01 0.06 -0.32 0.00 -2.87 0.00 0.00 58.31 55.17 1fui n LYS 403 Cb 0.56 -1.61 0.03 0.00 -1.84 0.00 0.00 35.03 32.17 1fui n LYS 403 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 1fui s GLN 404 N -3.07 3.15 0.06 1.97 -0.21 -1.25 -4.91 119.66 115.42 1fui s GLN 404 Ca 0.10 1.09 0.05 0.00 0.02 0.00 0.00 55.36 56.62 1fui s GLN 404 Cb 0.16 -2.01 -0.03 0.00 1.00 0.00 0.00 33.01 32.13 1fui s GLN 404 CO 0.65 -0.94 -0.14 1.03 -2.12 0.00 0.00 175.29 173.77 1fui s ARG 405 N -4.51 0.84 0.37 2.91 1.81 -1.26 -1.32 118.95 117.79 1fui s ARG 405 Ca 0.61 -0.91 -0.00 0.00 -1.72 0.00 0.00 55.73 53.71 1fui s ARG 405 Cb -0.15 -0.84 0.07 0.00 -0.45 0.00 0.00 34.95 33.58 1fui s ARG 405 CO 0.45 0.19 0.51 -0.40 -0.68 0.00 0.00 175.30 175.37 1fui n ASP 406 N 1.41 0.69 -0.15 0.23 5.68 -0.64 -4.91 116.55 118.86 1fui n ASP 406 Ca -0.21 -1.58 -0.03 0.00 -0.50 0.00 0.00 54.79 52.47 1fui n ASP 406 Cb 0.54 -0.33 0.04 0.00 -1.14 0.00 0.00 41.12 40.23 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 -0.31 -0.36 0.00 -1.12 0.02 -2.02 -0.48 113.55 109.28 1fui h SER 407 Ca -0.17 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.92 1fui h SER 407 Cb 0.62 0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.43 1fui h SER 407 CO 0.18 -0.13 0.00 -0.62 -1.14 0.00 0.00 176.83 175.12 1fui n GLU 408 N -5.31 0.70 -0.87 3.45 1.02 -1.26 -4.87 120.64 113.51 1fui n GLU 408 Ca 0.05 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1fui n GLU 408 Cb 0.26 -1.30 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 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 0.33 0.74 3.82 0.62 0.00 -0.19 -5.05 105.19 105.46 1fui n GLY 409 Ca 0.10 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.48 6.98 0.30 1.61 0.01 -1.26 -4.71 114.94 115.39 1fui s ASN 410 Ca 0.00 1.63 -0.29 0.00 -0.71 0.00 0.00 52.86 53.49 1fui s ASN 410 Cb 0.00 -2.51 -0.10 0.00 0.41 0.00 0.00 41.25 39.04 1fui s ASN 410 CO 0.00 -0.28 1.37 -2.16 -1.51 0.00 0.00 177.10 174.52 1fui s PRO 411 N -2.93 4.30 0.20 -0.60 0.04 -1.26 -1.62 135.00 133.13 1fui s PRO 411 Ca 0.58 2.27 -0.08 0.00 0.04 0.00 0.00 61.00 63.81 1fui s PRO 411 Cb -0.11 -3.08 0.03 0.00 0.04 0.00 0.00 34.50 31.38 1fui s PRO 411 CO 0.16 -0.30 0.41 -2.37 0.04 0.00 0.00 177.00 174.94 1fui n THR 412 N 1.36 0.00 -4.34 1.26 5.66 -0.43 -4.88 114.28 112.91 1fui n THR 412 Ca 0.03 -0.49 -0.22 0.00 -3.05 0.00 0.00 64.05 60.31 1fui n THR 412 Cb 0.41 0.50 -0.16 0.00 -1.55 0.00 0.00 70.33 69.53 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 -2.04 1.19 0.31 1.09 -1.94 -1.26 -3.80 119.30 112.85 1fui s MET 413 Ca 0.08 -0.23 0.10 0.00 -1.71 0.00 0.00 55.69 53.92 1fui s MET 413 Cb -0.02 -1.07 -0.06 0.00 2.01 0.00 0.00 34.83 35.69 1fui s MET 413 CO 0.06 -0.03 -0.12 0.15 -0.01 0.00 0.00 175.02 175.07 1fui s LYS 414 N 0.79 1.72 0.37 2.03 1.02 -1.26 -4.97 119.74 119.44 1fui s LYS 414 Ca -0.13 -1.86 -0.27 0.00 0.02 0.00 0.00 55.97 53.73 1fui s LYS 414 Cb -0.15 -1.60 -0.10 0.00 -0.52 0.00 0.00 37.83 35.47 1fui s LYS 414 CO 0.02 0.17 1.32 -2.14 -0.92 0.00 0.00 175.35 173.80 1fui s PRO 415 N -3.61 4.14 0.51 -1.68 0.02 -1.26 -4.61 135.00 128.51 1fui s PRO 415 Ca 0.31 2.21 0.32 0.00 0.02 0.00 0.00 61.00 63.86 1fui s PRO 415 Cb 0.01 -2.90 1.44 0.00 0.02 0.00 0.00 34.50 33.07 1fui s PRO 415 CO 0.15 -0.37 1.81 1.12 -0.33 0.00 0.00 177.00 179.37 1fui h HIS 416 N 2.99 0.15 0.00 6.54 2.07 -1.86 0.14 115.15 125.17 1fui h HIS 416 Ca -0.49 0.01 0.00 0.00 -2.85 0.00 0.00 60.37 57.03 1fui h HIS 416 Cb 1.24 -0.04 0.00 0.00 2.57 0.00 0.00 27.41 31.17 1fui h HIS 416 CO 0.54 0.01 0.00 -2.67 -3.07 0.00 0.00 177.93 172.74 1fui n TRP 417 N -4.30 0.00 0.06 6.12 2.14 -1.26 -2.02 117.44 118.19 1fui n TRP 417 Ca 0.25 0.00 0.05 0.00 2.07 0.00 0.00 57.50 59.86 1fui n TRP 417 Cb 1.13 -0.44 0.09 0.00 -0.81 0.00 0.00 31.31 31.29 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 1.89 -3.54 -2.67 1.02 0.48 -4.97 120.64 111.43 1fui n GLU 418 Ca 0.05 -1.61 -0.37 0.00 -0.02 0.00 0.00 57.16 55.21 1fui n GLU 418 Cb 0.17 -1.21 -0.08 0.00 -0.02 0.00 0.00 31.44 30.30 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 -0.91 5.29 0.34 -3.67 1.01 -0.85 -4.94 121.20 117.46 1fui s ILE 419 Ca 0.16 0.45 -0.03 0.00 0.00 0.00 0.00 60.65 61.24 1fui s ILE 419 Cb 0.09 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.91 1fui s ILE 419 CO 0.13 0.32 0.58 -0.94 0.00 0.00 0.00 174.94 175.03 1fui s SER 420 N 0.90 6.36 0.39 3.58 1.04 -1.26 -4.98 113.70 119.73 1fui s SER 420 Ca 0.14 0.63 0.10 0.00 0.48 0.00 0.00 55.95 57.30 1fui s SER 420 Cb -0.14 -2.11 0.89 0.00 0.10 0.00 0.00 66.02 64.76 1fui s SER 420 CO 0.05 -0.28 1.94 -0.61 0.98 0.00 0.00 173.24 175.32 1fui h GLN 421 N 1.11 0.57 -0.92 4.02 5.75 -1.99 -0.48 115.11 123.17 1fui h GLN 421 Ca -0.48 -0.03 -0.01 0.00 -0.15 0.00 0.00 58.65 57.97 1fui h GLN 421 Cb 1.20 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 29.58 1fui h GLN 421 CO 0.64 0.38 0.54 1.96 -2.65 0.00 0.00 178.83 179.70 1fui h GLN 422 N 0.59 1.26 -0.25 1.69 4.20 -2.00 -1.75 115.11 118.84 1fui h GLN 422 Ca 0.33 -0.12 -0.18 0.00 0.06 0.00 0.00 58.65 58.74 1fui h GLN 422 Cb 0.51 -0.26 -0.00 0.00 0.30 0.00 0.00 27.48 28.03 1fui h GLN 422 CO -0.12 0.89 -0.55 0.93 -0.67 0.00 0.00 178.83 179.31 1fui h GLU 423 N 1.27 0.77 -0.19 1.46 5.08 -1.51 -2.20 114.58 119.27 1fui h GLU 423 Ca 0.33 -0.49 0.02 0.00 -1.00 0.00 0.00 59.36 58.21 1fui h GLU 423 Cb -0.04 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1fui h GLU 423 CO -0.06 1.12 0.06 0.00 -1.00 0.00 0.00 179.01 179.13 1fui h ALA 424 N 0.78 0.20 -0.51 3.43 0.00 -0.94 -1.45 119.26 120.77 1fui h ALA 424 Ca 0.01 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1fui h ALA 424 Cb 1.14 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 1fui h ALA 424 CO 0.12 -0.37 0.15 -0.44 0.00 0.00 0.00 179.25 178.71 1fui h ASP 425 N 0.15 0.70 -0.74 0.00 3.32 -1.31 -2.29 116.42 116.24 1fui h ASP 425 Ca 0.08 -0.11 -0.04 0.00 0.02 0.00 0.00 57.03 56.98 1fui h ASP 425 Cb 0.05 -0.18 -0.03 0.00 0.22 0.00 0.00 39.33 39.39 1fui h ASP 425 CO -0.09 0.67 0.31 0.00 -1.72 0.00 0.00 179.24 178.41 1fui h ALA 426 N 1.43 1.12 -0.49 3.45 0.00 -0.87 0.47 119.26 124.37 1fui h ALA 426 Ca 0.17 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 1fui h ALA 426 Cb 0.23 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1fui h ALA 426 CO -0.01 0.63 -0.05 0.00 0.00 0.00 0.00 179.25 179.82 1fui h LEU 428 N 0.75 0.76 -1.42 0.00 6.46 -1.08 -2.57 115.31 118.22 1fui h LEU 428 Ca 0.13 -0.20 -0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1fui h LEU 428 Cb 0.58 -0.20 -0.00 0.00 -0.73 0.00 0.00 40.66 40.30 1fui h LEU 428 CO 0.03 0.86 -0.15 0.00 -0.62 0.00 0.00 178.44 178.56 1fui h ALA 429 N 1.22 1.07 -0.01 1.25 0.00 -0.71 -2.49 119.26 119.60 1fui h ALA 429 Ca 0.13 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fui h ALA 429 Cb 0.51 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1fui h ALA 429 CO 0.03 0.19 -0.02 0.00 0.00 0.00 0.00 179.25 179.45 1fui n ALA 430 N -2.20 2.64 -2.67 0.00 0.00 -0.91 -4.87 120.51 112.49 1fui n ALA 430 Ca -0.00 -0.37 -0.34 0.00 0.00 0.00 0.00 53.44 52.72 1fui n ALA 430 Cb 0.35 -1.27 -0.11 0.00 0.00 0.00 0.00 19.45 18.43 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 -2.05 3.97 -0.07 0.00 2.01 -0.94 -4.53 115.64 114.05 1fui s THR 431 Ca 0.40 -0.37 0.06 0.00 0.31 0.00 0.00 61.69 62.08 1fui s THR 431 Cb 0.21 -2.66 -0.01 0.00 0.01 0.00 0.00 72.50 70.06 1fui s THR 431 CO 0.36 0.59 -0.25 -1.61 -0.69 0.00 0.00 174.62 173.02 1fui s GLU 432 N -0.70 2.64 -0.32 4.92 2.02 -0.46 -4.27 118.70 122.53 1fui s GLU 432 Ca 0.11 -0.89 -0.16 0.00 0.02 0.00 0.00 54.97 54.04 1fui s GLU 432 Cb -0.11 -2.17 -0.02 0.00 0.10 0.00 0.00 34.13 31.92 1fui s GLU 432 CO 0.02 0.33 0.44 -1.58 0.02 0.00 0.00 175.26 174.49 1fui s TRP 433 N -0.05 3.21 -0.08 1.61 0.52 0.12 -1.17 118.94 123.11 1fui s TRP 433 Ca -0.07 0.24 0.01 0.00 0.02 0.00 0.00 56.10 56.30 1fui s TRP 433 Cb -0.15 -2.74 -0.03 0.00 -1.15 0.00 0.00 33.47 29.40 1fui s TRP 433 CO 0.05 -0.40 -0.09 0.00 0.02 0.00 0.00 176.95 176.53 1fui n PRO 435 N 2.52 2.39 -2.12 0.00 -0.02 -1.26 -0.27 135.00 136.24 1fui n PRO 435 Ca -0.18 0.84 -0.36 0.00 -2.02 0.00 0.00 63.50 61.78 1fui n PRO 435 Cb 0.53 -2.58 0.01 0.00 -0.02 0.00 0.00 33.50 31.44 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 -1.15 2.77 -0.36 3.55 0.00 0.02 -4.78 121.76 121.82 1fui s ALA 436 Ca 0.57 0.99 -0.29 0.00 0.00 0.00 0.00 51.96 53.23 1fui s ALA 436 Cb -0.48 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.22 1fui s ALA 436 CO 0.61 -0.93 1.38 0.42 0.00 0.00 0.00 175.76 177.24 1fui s ILE 437 N -1.57 3.99 0.25 0.00 1.01 -1.26 -4.77 121.20 118.84 1fui s ILE 437 Ca 0.71 1.06 -0.10 0.00 0.00 0.00 0.00 60.65 62.31 1fui s ILE 437 Cb -0.30 -4.16 0.36 0.00 0.01 0.00 0.00 42.46 38.37 1fui s ILE 437 CO 0.34 -0.63 1.59 -0.74 0.00 0.00 0.00 174.94 175.50 1fui h HIS 438 N 10.15 -0.44 -0.03 3.97 -0.00 -1.93 -0.12 115.15 126.74 1fui h HIS 438 Ca -0.27 0.08 0.01 0.00 -0.00 0.00 0.00 60.37 60.18 1fui h HIS 438 Cb 1.10 0.33 -0.00 0.00 -0.00 0.00 0.00 27.41 28.84 1fui h HIS 438 CO 0.93 -0.36 0.03 0.93 -0.00 0.00 0.00 177.93 179.46 1fui h GLU 439 N 0.00 0.00 0.06 5.26 3.07 -1.96 -1.17 114.58 119.84 1fui h GLU 439 Ca 0.40 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 58.94 1fui h GLU 439 Cb 0.62 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.49 1fui h GLU 439 CO -0.86 0.00 -1.81 0.66 -1.40 0.00 0.00 179.01 175.60 1fui n TYR 440 N -4.32 0.98 -3.89 4.33 4.01 -0.76 -4.68 117.16 112.84 1fui n TYR 440 Ca -0.02 0.29 -0.28 0.00 -0.16 0.00 0.00 57.90 57.73 1fui n TYR 440 Cb 0.12 -1.12 -0.12 0.00 -0.31 0.00 0.00 39.34 37.91 1fui n TYR 440 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1fui s PHE 441 N -2.48 3.44 0.61 -0.72 0.08 -0.13 -4.80 117.98 113.99 1fui s PHE 441 Ca -0.27 -3.29 0.33 0.00 0.12 0.00 0.00 56.93 53.83 1fui s PHE 441 Cb 0.07 -2.66 1.95 0.00 -0.57 0.00 0.00 43.02 41.80 1fui s PHE 441 CO 0.67 -0.58 2.25 0.00 -0.10 0.00 0.00 175.22 177.46 1fui h ARG 442 N 5.55 0.00 -0.00 0.44 3.08 -0.72 -1.23 114.38 121.50 1fui h ARG 442 Ca 0.12 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.17 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 0.70 0.00 -0.17 0.41 -1.07 0.00 0.00 179.97 179.84 1fui n GLY 443 N -1.27 -1.10 1.99 0.04 0.00 -0.80 -4.82 105.19 99.23 1fui n GLY 443 Ca -0.02 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 1.37 -2.34 0.00 -0.02 0.00 -0.46 -3.34 105.19 100.40 1fui n GLY 444 Ca 0.11 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.30 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 -0.11 1.20 2.79 -0.02 0.00 -1.26 -0.64 105.19 107.15 1fui n GLY 445 Ca 0.00 -1.42 -0.25 0.00 0.00 0.00 0.00 46.02 44.35 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 -1.84 0.99 0.26 1.61 2.02 -1.26 -0.79 117.35 118.34 1fui s TYR 446 Ca 0.00 -0.53 -0.18 0.00 -0.37 0.00 0.00 57.07 56.00 1fui s TYR 446 Cb 0.00 -0.98 -0.08 0.00 -0.40 0.00 0.00 41.96 40.50 1fui s TYR 446 CO 0.00 -0.46 0.72 -1.12 -1.57 0.00 0.00 175.55 173.12 1fui s SER 447 N 1.87 6.93 -0.56 2.29 0.01 0.63 -2.87 113.70 122.00 1fui s SER 447 Ca 0.03 1.35 -0.18 0.00 1.31 0.00 0.00 55.95 58.46 1fui s SER 447 Cb -0.14 -2.40 0.10 0.00 0.21 0.00 0.00 66.02 63.80 1fui s SER 447 CO -0.07 -0.06 0.61 -0.94 0.41 0.00 0.00 173.24 173.19 1fui s SER 448 N -1.91 6.19 -0.19 2.44 1.04 -0.58 -1.41 113.70 119.27 1fui s SER 448 Ca 0.47 -1.45 -0.10 0.00 0.48 0.00 0.00 55.95 55.35 1fui s SER 448 Cb -0.14 -2.26 -0.05 0.00 0.10 0.00 0.00 66.02 63.67 1fui s SER 448 CO 0.19 -0.97 0.15 -0.60 0.98 0.00 0.00 173.24 172.99 1fui s ARG 449 N 2.29 4.17 0.20 4.02 3.52 -0.31 -3.45 118.95 129.40 1fui s ARG 449 Ca 0.09 -0.18 -0.19 0.00 -0.13 0.00 0.00 55.73 55.32 1fui s ARG 449 Cb -0.25 -3.41 0.04 0.00 -1.56 0.00 0.00 34.95 29.76 1fui s ARG 449 CO 0.06 0.31 0.58 -0.59 -0.81 0.00 0.00 175.30 174.85 1fui s PHE 450 N 0.31 -0.22 -0.15 5.12 -0.12 -1.26 -1.35 117.98 120.30 1fui s PHE 450 Ca 0.09 -0.11 0.01 0.00 -0.05 0.00 0.00 56.93 56.87 1fui s PHE 450 Cb -0.11 0.49 0.02 0.00 -0.63 0.00 0.00 43.02 42.79 1fui s PHE 450 CO -0.01 -0.97 -0.17 -1.17 -0.05 0.00 0.00 175.22 172.85 1fui s LEU 451 N -2.86 1.88 0.19 -1.99 0.20 -1.26 -1.79 118.68 113.05 1fui s LEU 451 Ca 0.08 -0.54 -0.30 0.00 0.69 0.00 0.00 54.13 54.05 1fui s LEU 451 Cb -0.02 -1.29 -0.09 0.00 -0.43 0.00 0.00 46.19 44.36 1fui s LEU 451 CO -0.03 -0.01 1.37 -0.89 -0.29 0.00 0.00 176.35 176.49 1fui s THR 452 N 1.28 3.07 0.50 3.68 2.01 -0.84 -4.82 115.64 120.52 1fui s THR 452 Ca 0.02 0.86 -0.23 0.00 0.31 0.00 0.00 61.69 62.65 1fui s THR 452 Cb -0.13 -3.55 -0.06 0.00 0.01 0.00 0.00 72.50 68.77 1fui s THR 452 CO -0.09 0.12 1.35 -1.61 -0.69 0.00 0.00 174.62 173.69 1fui s GLU 453 N 0.12 3.42 0.81 4.92 2.02 -1.15 -4.83 118.70 124.01 1fui s GLU 453 Ca 0.59 2.22 -0.12 0.00 0.02 0.00 0.00 54.97 57.68 1fui s GLU 453 Cb -0.38 -2.41 0.08 0.00 0.10 0.00 0.00 34.13 31.51 1fui s GLU 453 CO 0.37 -0.96 1.13 0.20 0.02 0.00 0.00 175.26 176.02 1fui s GLY 454 N -0.88 1.60 -0.30 -1.39 0.00 -1.26 -4.29 107.32 100.81 1fui s GLY 454 Ca 0.67 -0.42 0.00 0.00 0.00 0.00 0.00 44.72 44.97 1fui s GLY 454 CO 0.48 0.05 0.00 0.61 0.00 0.00 0.00 173.10 174.24 1fui n GLY 455 N -2.59 0.56 3.73 0.20 0.00 0.23 -4.85 105.19 102.48 1fui n GLY 455 Ca 0.07 -0.28 -0.36 0.00 0.00 0.00 0.00 46.02 45.46 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 -1.89 5.36 0.21 1.61 1.01 -1.25 -4.86 120.40 120.59 1fui s VAL 456 Ca 0.00 0.35 -0.30 0.00 0.00 0.00 0.00 61.98 62.04 1fui s VAL 456 Cb 0.00 -3.55 -0.08 0.00 0.00 0.00 0.00 36.38 32.75 1fui s VAL 456 CO 0.00 0.41 1.21 -2.16 0.00 0.00 0.00 175.10 174.56 1fui s PRO 457 N 0.43 4.49 0.06 2.72 0.04 -1.26 -1.12 135.00 140.35 1fui s PRO 457 Ca 0.12 1.92 -0.00 0.00 0.04 0.00 0.00 61.00 63.07 1fui s PRO 457 Cb -0.12 -3.22 -0.04 0.00 0.04 0.00 0.00 34.50 31.17 1fui s PRO 457 CO 0.01 -0.08 -0.04 -0.06 0.04 0.00 0.00 177.00 176.87 1fui s PHE 458 N -0.24 0.59 -0.14 0.56 0.08 -0.43 0.17 117.98 118.57 1fui s PHE 458 Ca 0.52 -1.00 -0.00 0.00 0.12 0.00 0.00 56.93 56.57 1fui s PHE 458 Cb -0.34 -0.41 0.03 0.00 -0.57 0.00 0.00 43.02 41.73 1fui s PHE 458 CO 0.38 -0.32 -0.10 0.99 -0.10 0.00 0.00 175.22 176.08 1fui s THR 459 N -3.70 1.27 -0.21 0.64 2.01 0.21 -1.08 115.64 114.78 1fui s THR 459 Ca 0.07 -0.50 -0.13 0.00 0.31 0.00 0.00 61.69 61.44 1fui s THR 459 Cb 0.06 -1.27 -0.05 0.00 0.01 0.00 0.00 72.50 71.25 1fui s THR 459 CO -0.08 0.36 0.25 -0.32 -0.69 0.00 0.00 174.62 174.14 1fui s MET 460 N 1.60 4.14 0.33 4.92 1.75 -0.08 -0.90 119.30 131.06 1fui s MET 460 Ca 0.04 -0.07 0.04 0.00 -1.25 0.00 0.00 55.69 54.45 1fui s MET 460 Cb -0.13 -3.51 -0.06 0.00 2.84 0.00 0.00 34.83 33.97 1fui s MET 460 CO -0.09 0.08 0.07 0.95 -0.65 0.00 0.00 175.02 175.37 1fui s THR 461 N 0.99 1.11 -0.28 10.11 -4.23 -0.06 -0.87 115.64 122.41 1fui s THR 461 Ca 0.12 -2.00 -0.25 0.00 -1.18 0.00 0.00 61.69 58.38 1fui s THR 461 Cb -0.14 -2.74 0.12 0.00 1.34 0.00 0.00 72.50 71.08 1fui s THR 461 CO 0.05 0.00 1.03 -0.60 -0.54 0.00 0.00 174.62 174.56 1fui s ARG 462 N -3.88 0.50 -0.07 3.99 6.06 -0.95 -1.25 118.95 123.34 1fui s ARG 462 Ca 0.35 0.59 0.02 0.00 -2.50 0.00 0.00 55.73 54.20 1fui s ARG 462 Cb 0.08 0.24 -0.02 0.00 0.06 0.00 0.00 34.95 35.31 1fui s ARG 462 CO 0.15 -0.06 -0.13 0.08 -2.50 0.00 0.00 175.30 172.84 1fui s VAL 463 N 0.21 3.12 0.07 7.11 1.01 -1.26 -0.96 120.40 129.69 1fui s VAL 463 Ca 0.03 -0.68 0.03 0.00 0.00 0.00 0.00 61.98 61.36 1fui s VAL 463 Cb -0.05 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1fui s VAL 463 CO -0.06 0.57 -0.10 0.20 0.00 0.00 0.00 175.10 175.71 1fui s ASN 464 N -0.44 1.23 -0.21 3.32 0.01 -0.76 -4.70 114.94 113.39 1fui s ASN 464 Ca 0.06 -0.67 -0.05 0.00 -0.71 0.00 0.00 52.86 51.48 1fui s ASN 464 Cb -0.12 0.01 -0.03 0.00 0.41 0.00 0.00 41.25 41.53 1fui s ASN 464 CO 0.02 -0.21 0.01 -0.63 -1.51 0.00 0.00 177.10 174.78 1fui s ILE 465 N -1.80 4.03 -0.25 0.60 1.01 -1.26 -0.91 121.20 122.63 1fui s ILE 465 Ca -0.02 -0.28 -0.03 0.00 0.00 0.00 0.00 60.65 60.31 1fui s ILE 465 Cb -0.07 -2.83 0.01 0.00 0.01 0.00 0.00 42.46 39.57 1fui s ILE 465 CO 0.00 0.42 -0.03 -0.63 0.00 0.00 0.00 174.94 174.70 1fui s ILE 466 N 1.08 3.26 0.25 2.92 -1.09 0.08 -4.97 121.20 122.72 1fui s ILE 466 Ca 0.03 -0.75 -0.31 0.00 -2.23 0.00 0.00 60.65 57.38 1fui s ILE 466 Cb -0.14 -2.59 -0.12 0.00 -1.58 0.00 0.00 42.46 38.03 1fui s ILE 466 CO 0.02 0.27 1.64 1.17 -1.23 0.00 0.00 174.94 176.81 1fui n LYS 467 N 4.76 2.67 -0.40 2.79 4.81 -1.26 0.16 118.16 131.69 1fui n LYS 467 Ca -0.17 0.96 0.00 0.00 -0.87 0.00 0.00 58.31 58.23 1fui n LYS 467 Cb 0.49 -2.76 0.00 0.00 0.02 0.00 0.00 35.03 32.78 1fui n LYS 467 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1fui n GLY 468 N 3.01 1.20 0.85 3.14 0.00 -1.26 -4.73 105.19 107.40 1fui n GLY 468 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 0.69 0.00 0.99 0.00 -0.32 -5.16 117.00 113.20 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 -0.02 0.00 0.61 0.00 0.00 0.00 177.39 177.98 1fui n GLY 470 N 2.44 -0.59 3.82 -3.96 0.00 0.12 -4.97 105.19 102.05 1fui n GLY 470 Ca 0.00 -2.13 -0.32 0.00 0.00 0.00 0.00 46.02 43.57 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 3.55 0.02 1.61 0.04 -1.26 -0.74 135.00 138.22 1fui s PRO 471 Ca 0.00 1.12 -0.04 0.00 0.04 0.00 0.00 61.00 62.11 1fui s PRO 471 Cb 0.00 -2.07 -0.01 0.00 0.04 0.00 0.00 34.50 32.46 1fui s PRO 471 CO 0.00 -0.61 0.07 0.14 0.04 0.00 0.00 177.00 176.64 1fui s VAL 472 N -2.51 0.11 -0.01 -0.36 -7.23 -0.08 -4.13 120.40 106.19 1fui s VAL 472 Ca 0.62 -0.89 0.04 0.00 -1.81 0.00 0.00 61.98 59.94 1fui s VAL 472 Cb -0.14 -0.53 -0.03 0.00 0.56 0.00 0.00 36.38 36.24 1fui s VAL 472 CO 0.35 -0.49 -0.13 -0.22 -0.31 0.00 0.00 175.10 174.30 1fui s LEU 473 N -1.64 2.86 -0.03 1.32 2.96 0.04 -1.82 118.68 122.36 1fui s LEU 473 Ca -0.12 -0.23 0.07 0.00 -0.22 0.00 0.00 54.13 53.63 1fui s LEU 473 Cb -0.06 -1.63 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 1fui s LEU 473 CO -0.01 0.31 -0.24 -1.10 -1.32 0.00 0.00 176.35 173.98 1fui s GLN 474 N -1.11 2.14 0.01 1.98 -0.21 -0.14 -1.29 119.66 121.05 1fui s GLN 474 Ca 0.14 -0.87 0.01 0.00 0.02 0.00 0.00 55.36 54.67 1fui s GLN 474 Cb -0.11 -1.97 -0.01 0.00 1.00 0.00 0.00 33.01 31.93 1fui s GLN 474 CO 0.04 0.46 -0.05 0.42 -2.12 0.00 0.00 175.29 174.04 1fui s ILE 475 N -0.41 0.37 -0.28 1.08 1.01 0.14 -2.24 121.20 120.87 1fui s ILE 475 Ca 0.05 -0.39 0.00 0.00 0.00 0.00 0.00 60.65 60.31 1fui s ILE 475 Cb -0.11 -0.35 0.15 0.00 0.01 0.00 0.00 42.46 42.16 1fui s ILE 475 CO 0.01 -0.02 0.38 0.00 0.00 0.00 0.00 174.94 175.31 1fui s ALA 476 N -0.41 -1.07 0.35 9.38 0.00 -0.05 -3.69 121.76 126.28 1fui s ALA 476 Ca -0.01 0.34 -0.22 0.00 0.00 0.00 0.00 51.96 52.07 1fui s ALA 476 Cb -0.04 -1.92 -0.10 0.00 0.00 0.00 0.00 23.12 21.06 1fui s ALA 476 CO -0.00 -1.61 0.89 -1.21 0.00 0.00 0.00 175.76 173.83 1fui s GLU 477 N 2.52 4.31 0.00 0.00 2.02 -1.26 -0.91 118.70 125.38 1fui s GLU 477 Ca 0.10 1.09 0.00 0.00 0.02 0.00 0.00 54.97 56.18 1fui s GLU 477 Cb -0.13 -2.51 0.00 0.00 0.10 0.00 0.00 34.13 31.59 1fui s GLU 477 CO -0.26 0.15 0.00 0.41 0.02 0.00 0.00 175.26 175.58 1fui n GLY 478 N -0.03 1.67 3.13 -1.39 0.00 -0.24 -1.50 105.19 106.83 1fui n GLY 478 Ca 0.04 -0.45 -0.10 0.00 0.00 0.00 0.00 46.02 45.51 1fui n GLY 478 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1fui s TRP 479 N -1.53 0.15 0.26 1.61 0.51 -0.11 -1.32 118.94 118.51 1fui s TRP 479 Ca 0.00 -0.41 -0.21 0.00 -2.12 0.00 0.00 56.10 53.36 1fui s TRP 479 Cb 0.00 -0.11 -0.09 0.00 -0.81 0.00 0.00 33.47 32.47 1fui s TRP 479 CO 0.00 -0.37 0.79 -1.54 -0.51 0.00 0.00 176.95 175.32 1fui s SER 480 N -2.03 7.11 0.30 2.95 1.04 -0.28 -0.56 113.70 122.23 1fui s SER 480 Ca -0.06 1.53 0.10 0.00 0.48 0.00 0.00 55.95 57.99 1fui s SER 480 Cb -0.02 -2.46 -0.05 0.00 0.10 0.00 0.00 66.02 63.59 1fui s SER 480 CO -0.04 -0.02 -0.03 0.68 0.98 0.00 0.00 173.24 174.82 1fui s VAL 481 N -1.59 2.96 -0.21 5.02 -7.23 0.23 0.78 120.40 120.36 1fui s VAL 481 Ca 0.46 -2.02 -0.03 0.00 -1.81 0.00 0.00 61.98 58.57 1fui s VAL 481 Cb -0.17 -2.72 -0.00 0.00 0.56 0.00 0.00 36.38 34.05 1fui s VAL 481 CO 0.21 -0.31 -0.07 -0.70 -0.31 0.00 0.00 175.10 173.92 1fui s GLU 482 N -3.66 3.33 0.07 4.82 2.12 -1.26 -4.24 118.70 119.87 1fui s GLU 482 Ca 0.33 -0.65 -0.05 0.00 0.36 0.00 0.00 54.97 54.95 1fui s GLU 482 Cb -0.04 -2.93 -0.05 0.00 0.26 0.00 0.00 34.13 31.37 1fui s GLU 482 CO 0.19 -0.18 0.30 -0.51 -0.54 0.00 0.00 175.26 174.52 1fui s LEU 483 N 1.40 4.33 0.33 2.70 1.43 -1.26 -5.01 118.68 122.60 1fui s LEU 483 Ca 0.05 0.52 -0.29 0.00 -1.03 0.00 0.00 54.13 53.38 1fui s LEU 483 Cb -0.14 -2.97 -0.12 0.00 0.03 0.00 0.00 46.19 42.99 1fui s LEU 483 CO -0.04 0.16 1.44 -0.81 0.23 0.00 0.00 176.35 177.33 1fui n PRO 484 N 0.57 2.43 -0.26 1.29 -0.04 -1.26 -4.71 135.00 133.03 1fui n PRO 484 Ca -0.07 0.86 0.20 0.00 -0.04 0.00 0.00 63.50 64.45 1fui n PRO 484 Cb 0.52 -2.54 0.37 0.00 -0.04 0.00 0.00 33.50 31.81 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 1.03 -0.05 -0.18 0.54 -0.00 -1.26 -1.04 118.16 117.20 1fui n LYS 485 Ca 0.05 1.12 -0.10 0.00 -0.00 0.00 0.00 58.31 59.38 1fui n LYS 485 Cb 0.37 -1.91 0.01 0.00 -0.00 0.00 0.00 35.03 33.50 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 0.92 -0.08 -5.58 2.03 -2.01 -3.10 116.42 108.59 1fui h ASP 486 Ca 0.59 -0.31 -0.09 0.00 -0.73 0.00 0.00 57.03 56.49 1fui h ASP 486 Cb 1.45 -0.25 0.00 0.00 -0.83 0.00 0.00 39.33 39.70 1fui h ASP 486 CO -0.66 1.01 -0.31 0.58 -1.03 0.00 0.00 179.24 178.83 1fui h VAL 487 N 0.81 1.41 -0.65 4.15 2.07 -1.44 -3.22 116.25 119.38 1fui h VAL 487 Ca 0.15 -1.68 0.11 0.00 0.82 0.00 0.00 66.70 66.10 1fui h VAL 487 Cb 0.54 2.26 -0.08 0.00 -1.52 0.00 0.00 31.29 32.49 1fui h VAL 487 CO 0.03 0.49 0.24 -0.74 0.02 0.00 0.00 177.57 177.61 1fui h HIS 488 N -0.12 0.42 -0.84 1.57 -0.00 -1.54 -2.06 115.15 112.59 1fui h HIS 488 Ca -0.02 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.37 1fui h HIS 488 Cb 0.94 -0.09 -0.04 0.00 -0.00 0.00 0.00 27.41 28.23 1fui h HIS 488 CO 0.12 0.08 0.45 -0.44 -0.00 0.00 0.00 177.93 178.15 1fui h ASP 489 N 0.41 1.05 0.16 3.26 3.32 -1.61 0.17 116.42 123.18 1fui h ASP 489 Ca 0.34 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.28 1fui h ASP 489 Cb 0.45 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1fui h ASP 489 CO -0.34 0.85 -0.08 0.40 -1.72 0.00 0.00 179.24 178.35 1fui h ILE 490 N 1.16 0.86 -0.44 0.35 1.08 -1.40 -1.32 117.51 117.81 1fui h ILE 490 Ca 0.29 -0.07 -0.10 0.00 -0.39 0.00 0.00 64.86 64.59 1fui h ILE 490 Cb 0.03 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 34.68 1fui h ILE 490 CO -0.05 0.02 -0.13 -0.07 -0.69 0.00 0.00 178.15 177.23 1fui h LEU 491 N -0.24 0.88 -0.52 1.44 3.38 -1.29 -2.72 115.31 116.24 1fui h LEU 491 Ca -0.02 -0.37 -0.06 0.00 0.09 0.00 0.00 57.88 57.52 1fui h LEU 491 Cb 0.19 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 1fui h LEU 491 CO 0.04 1.05 0.09 -1.13 0.09 0.00 0.00 178.44 178.58 1fui h ASN 492 N 0.71 0.83 0.13 -0.43 -1.24 -0.58 -2.30 115.58 112.69 1fui h ASN 492 Ca 0.11 -0.26 -0.10 0.00 0.71 0.00 0.00 56.30 56.76 1fui h ASN 492 Cb 0.68 -0.22 -0.01 0.00 0.73 0.00 0.00 38.32 39.50 1fui h ASN 492 CO 0.05 0.87 -0.36 0.07 -1.29 0.00 0.00 177.43 176.77 1fui h LYS 493 N 0.75 0.32 0.00 6.67 2.10 -1.26 -2.54 116.57 122.61 1fui h LYS 493 Ca 0.16 -0.14 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 1fui h LYS 493 Cb 0.39 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.72 1fui h LYS 493 CO 0.01 0.65 0.00 -0.09 -2.00 0.00 0.00 179.45 178.01 1fui h ARG 494 N 0.28 0.00 0.00 0.07 2.43 -1.23 -3.42 114.38 112.51 1fui h ARG 494 Ca 0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1fui h ARG 494 Cb 0.77 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1fui h ARG 494 CO 0.06 0.00 0.00 2.41 -1.51 0.00 0.00 179.97 180.93 1fui n THR 495 N -2.81 0.00 -2.90 0.20 -1.04 -0.89 -5.05 114.28 101.80 1fui n THR 495 Ca 0.02 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.93 1fui n THR 495 Cb 0.33 -0.44 -0.01 0.00 -1.82 0.00 0.00 70.33 68.40 1fui n THR 495 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1fui n ASN 496 N -0.35 -2.66 0.32 8.00 4.13 -1.08 -5.04 115.26 118.59 1fui n ASN 496 Ca 0.00 -2.86 0.13 0.00 1.68 0.00 0.00 54.58 53.53 1fui n ASN 496 Cb 0.00 1.22 0.71 0.00 -1.54 0.00 0.00 39.78 40.17 1fui n ASN 496 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 1fui h SER 497 N 4.93 0.00 -0.11 6.41 4.64 -1.73 -1.93 113.55 125.76 1fui h SER 497 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 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 0.15 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.46 1fui n THR 498 N -2.77 0.12 -4.09 2.95 -2.24 -1.26 -4.95 114.28 102.04 1fui n THR 498 Ca -0.02 -0.38 -0.28 0.00 -2.27 0.00 0.00 64.05 61.10 1fui n THR 498 Cb 0.42 0.70 -0.06 0.00 -2.10 0.00 0.00 70.33 69.29 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 3.11 0.20 4.78 0.51 -0.73 -4.34 118.94 120.60 1fui s TRP 499 Ca 0.35 0.00 -0.31 0.00 -2.12 0.00 0.00 56.10 54.02 1fui s TRP 499 Cb 0.20 -1.54 -0.10 0.00 -0.81 0.00 0.00 33.47 31.22 1fui s TRP 499 CO 0.31 0.51 1.47 -1.25 -0.51 0.00 0.00 176.95 177.48 1fui s PRO 500 N -2.73 4.26 0.04 4.98 0.04 -1.22 -4.63 135.00 135.74 1fui s PRO 500 Ca 0.29 2.28 0.06 0.00 0.04 0.00 0.00 61.00 63.68 1fui s PRO 500 Cb -0.11 -3.14 -0.03 0.00 0.04 0.00 0.00 34.50 31.25 1fui s PRO 500 CO 0.22 -0.47 -0.15 0.99 0.04 0.00 0.00 177.00 177.62 1fui s THR 501 N 0.50 3.00 -0.13 1.26 2.01 -0.74 -3.84 115.64 117.71 1fui s THR 501 Ca 0.63 -1.12 -0.04 0.00 0.31 0.00 0.00 61.69 61.47 1fui s THR 501 Cb -0.42 -2.29 0.06 0.00 0.01 0.00 0.00 72.50 69.87 1fui s THR 501 CO 0.38 0.32 0.15 -0.89 -0.69 0.00 0.00 174.62 173.89 1fui s THR 502 N -0.97 -0.23 -0.17 -0.82 2.01 -0.51 -2.00 115.64 112.95 1fui s THR 502 Ca 0.16 0.15 -0.21 0.00 0.31 0.00 0.00 61.69 62.10 1fui s THR 502 Cb -0.11 -0.43 -0.03 0.00 0.01 0.00 0.00 72.50 71.95 1fui s THR 502 CO 0.06 -0.02 0.62 0.26 -0.69 0.00 0.00 174.62 174.86 1fui s TRP 503 N 2.26 3.41 -0.06 4.92 0.52 -1.26 -1.26 118.94 127.47 1fui s TRP 503 Ca 0.04 0.96 0.05 0.00 0.02 0.00 0.00 56.10 57.17 1fui s TRP 503 Cb -0.14 -2.78 -0.01 0.00 -1.15 0.00 0.00 33.47 29.40 1fui s TRP 503 CO -0.08 -0.11 -0.22 0.12 0.02 0.00 0.00 176.95 176.68 1fui s PHE 504 N 1.65 2.25 -0.23 -1.98 5.36 -0.33 -0.60 117.98 124.10 1fui s PHE 504 Ca 0.30 -0.73 0.02 0.00 -0.96 0.00 0.00 56.93 55.56 1fui s PHE 504 Cb -0.16 -1.49 0.05 0.00 -0.34 0.00 0.00 43.02 41.07 1fui s PHE 504 CO 0.11 -0.25 -0.12 0.00 -1.46 0.00 0.00 175.22 173.50 1fui s ALA 505 N 0.02 2.34 0.36 11.12 0.00 0.28 -0.92 121.76 134.95 1fui s ALA 505 Ca -0.07 -1.48 -0.25 0.00 0.00 0.00 0.00 51.96 50.16 1fui s ALA 505 Cb -0.14 -1.41 -0.10 0.00 0.00 0.00 0.00 23.12 21.46 1fui s ALA 505 CO 0.04 -0.92 0.95 -1.25 0.00 0.00 0.00 175.76 174.58 1fui s PRO 506 N 1.23 4.46 -0.06 0.00 0.04 -1.26 -0.94 135.00 138.48 1fui s PRO 506 Ca -0.04 1.28 -0.30 0.00 0.04 0.00 0.00 61.00 61.98 1fui s PRO 506 Cb -0.17 -2.62 -0.04 0.00 0.04 0.00 0.00 34.50 31.71 1fui s PRO 506 CO -0.08 0.17 1.37 0.50 0.04 0.00 0.00 177.00 179.01 1fui s ARG 507 N -2.39 4.27 0.31 4.56 3.52 -0.56 -4.94 118.95 123.72 1fui s ARG 507 Ca 0.54 1.87 -0.17 0.00 -0.13 0.00 0.00 55.73 57.84 1fui s ARG 507 Cb -0.16 -3.68 -0.09 0.00 -1.56 0.00 0.00 34.95 29.46 1fui s ARG 507 CO 0.21 -0.62 0.77 -0.51 -0.81 0.00 0.00 175.30 174.33 1fui s LEU 508 N 2.87 4.13 -0.00 -0.88 1.43 -1.26 -4.93 118.68 120.03 1fui s LEU 508 Ca 0.62 1.39 0.05 0.00 -1.03 0.00 0.00 54.13 55.15 1fui s LEU 508 Cb -0.28 -4.02 -0.07 0.00 0.03 0.00 0.00 46.19 41.86 1fui s LEU 508 CO 0.23 -0.16 0.15 0.35 0.23 0.00 0.00 176.35 177.15 1fui n THR 509 N -0.10 0.00 0.00 5.49 -2.24 -0.44 -5.02 114.28 111.97 1fui n THR 509 Ca 0.02 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.58 1fui n THR 509 Cb 0.53 0.64 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 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 1.76 1.75 3.38 3.38 0.00 -0.38 -4.98 105.19 110.10 1fui n GLY 510 Ca -0.00 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.48 1.37 4.46 1.61 1.02 -1.26 -4.58 119.74 121.88 1fui s LYS 511 Ca 0.00 -1.33 0.00 0.00 0.02 0.00 0.00 55.97 54.66 1fui s LYS 511 Cb 0.00 -1.84 0.00 0.00 -0.52 0.00 0.00 37.83 35.47 1fui s LYS 511 CO 0.00 0.43 0.00 0.41 -0.92 0.00 0.00 175.35 175.27 1fui n GLY 512 N 0.91 2.49 0.07 -3.33 0.00 -1.26 -1.83 105.19 102.24 1fui n GLY 512 Ca -0.18 -0.36 0.07 0.00 0.00 0.00 0.00 46.02 45.55 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 13.25 0.08 -1.12 1.61 -0.02 -1.26 -2.39 135.00 145.15 1fui n PRO 513 Ca 0.00 0.50 -0.19 0.00 -2.02 0.00 0.00 63.50 61.79 1fui n PRO 513 Cb 0.00 -1.71 0.18 0.00 -0.02 0.00 0.00 33.50 31.95 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 -1.87 2.47 -0.01 6.00 3.01 -0.76 -1.76 117.46 124.54 1fui n PHE 514 Ca 0.00 -1.85 -0.18 0.00 1.01 0.00 0.00 57.45 56.44 1fui n PHE 514 Cb 0.07 -0.83 -0.08 0.00 -0.01 0.00 0.00 39.48 38.63 1fui n PHE 514 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 1fui h THR 515 N 1.02 1.31 -3.55 4.37 2.02 -1.52 -0.65 112.91 115.90 1fui h THR 515 Ca 0.51 -1.98 -0.04 0.00 0.77 0.00 0.00 66.41 65.66 1fui h THR 515 Cb 2.38 2.14 -0.08 0.00 -1.74 0.00 0.00 68.15 70.85 1fui h THR 515 CO 0.91 0.62 -0.06 1.51 0.37 0.00 0.00 175.52 178.87 1fui s ASP 516 N -7.00 -0.09 0.33 4.18 1.47 -1.26 -4.49 116.67 109.81 1fui s ASP 516 Ca -0.11 -0.90 0.02 0.00 1.18 0.00 0.00 52.55 52.74 1fui s ASP 516 Cb 0.07 0.62 0.58 0.00 -0.34 0.00 0.00 42.92 43.85 1fui s ASP 516 CO 0.88 -1.19 1.94 0.58 0.68 0.00 0.00 175.17 178.06 1fui h VAL 517 N 2.20 1.18 -0.78 2.11 2.07 -1.90 -2.51 116.25 118.63 1fui h VAL 517 Ca -0.25 -0.52 0.03 0.00 0.82 0.00 0.00 66.70 66.78 1fui h VAL 517 Cb 1.25 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 31.48 1fui h VAL 517 CO 0.34 0.21 0.49 0.22 0.02 0.00 0.00 177.57 178.85 1fui h TYR 518 N 0.75 0.93 -0.22 1.57 3.20 -1.92 -2.01 116.97 119.26 1fui h TYR 518 Ca 0.19 0.02 -0.07 0.00 3.14 0.00 0.00 58.73 62.01 1fui h TYR 518 Cb 0.09 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 38.04 1fui h TYR 518 CO 0.01 0.53 -0.16 0.77 -1.64 0.00 0.00 178.16 177.67 1fui h SER 519 N 0.96 0.36 -0.20 -2.11 0.02 -1.66 0.19 113.55 111.12 1fui h SER 519 Ca 0.31 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.15 1fui h SER 519 Cb 0.01 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1fui h SER 519 CO -0.11 0.55 0.05 0.58 -1.14 0.00 0.00 176.83 176.76 1fui h VAL 520 N 0.35 1.20 0.21 2.27 2.07 -0.63 -1.70 116.25 120.01 1fui h VAL 520 Ca 0.06 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 66.94 1fui h VAL 520 Cb 0.49 1.24 0.00 0.00 -1.52 0.00 0.00 31.29 31.50 1fui h VAL 520 CO 0.03 0.20 -0.10 -0.03 0.02 0.00 0.00 177.57 177.69 1fui h MET 521 N 0.14 -0.27 -0.04 1.57 -1.53 -0.95 -2.78 114.93 111.07 1fui h MET 521 Ca 0.06 0.02 0.01 0.00 -3.44 0.00 0.00 59.70 56.35 1fui h MET 521 Cb 0.25 0.06 -0.00 0.00 -0.55 0.00 0.00 31.60 31.36 1fui h MET 521 CO -0.00 -0.05 0.08 0.00 0.14 0.00 0.00 176.91 177.08 1fui h ALA 522 N 0.31 1.34 -0.34 0.39 0.00 -0.58 -1.54 119.26 118.84 1fui h ALA 522 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1fui h ALA 522 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1fui h ALA 522 CO 0.05 -0.10 0.00 0.09 0.00 0.00 0.00 179.25 179.28 1fui n ASN 523 N -3.40 3.22 -4.73 0.00 3.02 -0.65 -4.94 115.26 107.79 1fui n ASN 523 Ca -0.02 -1.93 -0.41 0.00 -0.03 0.00 0.00 54.58 52.19 1fui n ASN 523 Cb 0.16 -0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 39.08 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 -1.35 3.40 -1.73 3.10 -0.11 -0.58 -4.94 118.94 116.73 1fui s TRP 524 Ca 0.34 1.32 0.06 0.00 1.22 0.00 0.00 56.10 59.04 1fui s TRP 524 Cb 0.20 -3.47 0.19 0.00 -1.50 0.00 0.00 33.47 28.89 1fui s TRP 524 CO 0.27 -1.40 1.08 0.41 -4.62 0.00 0.00 176.95 172.70 1fui n GLY 525 N 2.62 0.41 3.83 5.86 0.00 -1.26 -4.91 105.19 111.74 1fui n GLY 525 Ca 0.06 -0.23 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.67 -1.09 -2.67 4.61 0.00 -1.26 -5.00 121.76 114.68 1fui s ALA 526 Ca 0.14 -0.54 0.26 0.00 0.00 0.00 0.00 51.96 51.82 1fui s ALA 526 Cb 0.08 0.71 0.69 0.00 0.00 0.00 0.00 23.12 24.61 1fui s ALA 526 CO 0.08 -1.02 1.54 0.27 0.00 0.00 0.00 175.76 176.64 1fui n ASN 527 N -1.22 2.14 -4.42 0.00 6.94 -1.26 -4.91 115.26 112.53 1fui n ASN 527 Ca -0.06 -1.72 -0.22 0.00 -0.02 0.00 0.00 54.58 52.56 1fui n ASN 527 Cb 0.60 -0.02 -0.10 0.00 -2.36 0.00 0.00 39.78 37.90 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 -1.97 2.05 0.22 -2.53 3.76 -1.26 -0.93 115.29 114.63 1fui s HIS 528 Ca 0.34 -0.43 -0.16 0.00 -0.15 0.00 0.00 55.06 54.66 1fui s HIS 528 Cb 0.20 -0.92 0.02 0.00 1.11 0.00 0.00 32.58 32.99 1fui s HIS 528 CO 0.32 0.56 0.52 0.20 -0.85 0.00 0.00 174.74 175.49 1fui s GLY 529 N -3.36 0.08 -0.02 -2.22 0.00 -0.48 -4.86 107.32 96.46 1fui s GLY 529 Ca 0.26 -0.42 0.07 0.00 0.00 0.00 0.00 44.72 44.63 1fui s GLY 529 CO 0.11 -0.35 -0.23 0.14 0.00 0.00 0.00 173.10 172.77 1fui s VAL 530 N -3.92 1.83 -0.19 1.40 1.01 -0.38 -1.82 120.40 118.34 1fui s VAL 530 Ca 0.13 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 61.08 1fui s VAL 530 Cb -0.01 -1.52 -0.02 0.00 0.00 0.00 0.00 36.38 34.82 1fui s VAL 530 CO 0.01 0.52 -0.02 -0.76 0.00 0.00 0.00 175.10 174.85 1fui s LEU 531 N -0.46 3.19 -0.04 3.92 1.02 -0.29 -0.88 118.68 125.13 1fui s LEU 531 Ca 0.07 -0.21 0.06 0.00 0.02 0.00 0.00 54.13 54.07 1fui s LEU 531 Cb -0.10 -1.79 -0.02 0.00 0.02 0.00 0.00 46.19 44.30 1fui s LEU 531 CO -0.00 0.09 -0.23 -0.89 0.02 0.00 0.00 176.35 175.34 1fui s THR 532 N 0.84 2.27 0.38 5.49 2.01 -0.08 -2.21 115.64 124.34 1fui s THR 532 Ca -0.00 -1.01 -0.28 0.00 0.31 0.00 0.00 61.69 60.71 1fui s THR 532 Cb -0.14 -1.82 -0.10 0.00 0.01 0.00 0.00 72.50 70.44 1fui s THR 532 CO 0.02 0.58 1.45 -0.51 -0.69 0.00 0.00 174.62 175.46 1fui s ILE 533 N -0.47 2.16 0.00 1.82 1.10 -1.26 -0.62 121.20 123.93 1fui s ILE 533 Ca 0.05 0.15 0.00 0.00 -0.51 0.00 0.00 60.65 60.35 1fui s ILE 533 Cb -0.11 -3.10 0.00 0.00 0.15 0.00 0.00 42.46 39.40 1fui s ILE 533 CO 0.01 0.03 0.00 0.61 -2.11 0.00 0.00 174.94 173.48 1fui n GLY 534 N 0.53 -2.40 3.23 1.50 0.00 0.13 -4.62 105.19 103.55 1fui n GLY 534 Ca 0.02 -1.59 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 1fui n GLY 534 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1fui s HIS 535 N -0.68 3.83 -0.25 1.61 3.76 -1.26 -2.16 115.29 120.15 1fui s HIS 535 Ca 0.00 -2.56 0.13 0.00 -0.15 0.00 0.00 55.06 52.48 1fui s HIS 535 Cb 0.00 -3.55 0.67 0.00 1.11 0.00 0.00 32.58 30.81 1fui s HIS 535 CO 0.00 -0.89 1.62 1.33 -0.85 0.00 0.00 174.74 175.96 1fui n VAL 536 N 3.17 2.63 -0.24 -0.90 0.24 -1.26 -4.66 118.33 117.31 1fui n VAL 536 Ca 0.17 -1.77 0.01 0.00 -2.04 0.00 0.00 64.34 60.70 1fui n VAL 536 Cb 0.41 -0.30 0.13 0.00 -1.47 0.00 0.00 33.84 32.61 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 2.54 1.06 0.75 7.63 0.00 -1.97 -0.81 103.07 112.26 1fui h GLY 537 Ca 0.10 -0.22 0.09 0.00 0.00 0.00 0.00 47.33 47.30 1fui h GLY 537 CO 0.46 0.06 0.58 0.00 0.00 0.00 0.00 176.54 177.64 1fui h ALA 538 N 1.43 1.60 -0.37 3.60 0.00 -1.88 0.11 119.26 123.74 1fui h ALA 538 Ca 0.35 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.12 1fui h ALA 538 Cb 0.36 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 1fui h ALA 538 CO -0.26 0.23 -0.26 -0.44 0.00 0.00 0.00 179.25 178.51 1fui h ASP 539 N 0.92 0.88 -0.82 0.00 3.32 -1.53 -2.07 116.42 117.12 1fui h ASP 539 Ca 0.41 -0.44 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 1fui h ASP 539 Cb 0.36 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 1fui h ASP 539 CO -0.17 1.13 0.42 -0.26 -1.72 0.00 0.00 179.24 178.63 1fui h PHE 540 N 0.64 1.17 -0.54 4.55 0.04 -0.47 -0.33 116.94 121.99 1fui h PHE 540 Ca 0.07 -0.05 -0.07 0.00 2.80 0.00 0.00 57.97 60.73 1fui h PHE 540 Cb 0.84 -0.37 -0.02 0.00 2.20 0.00 0.00 35.95 38.60 1fui h PHE 540 CO 0.06 0.83 0.08 0.82 -0.60 0.00 0.00 178.31 179.50 1fui h ILE 541 N 1.17 1.26 -0.19 -0.55 2.04 -0.88 -0.09 117.51 120.26 1fui h ILE 541 Ca 0.29 -0.98 -0.03 0.00 1.00 0.00 0.00 64.86 65.13 1fui h ILE 541 Cb 0.09 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 1fui h ILE 541 CO -0.04 0.35 -0.02 0.74 0.00 0.00 0.00 178.15 179.19 1fui h THR 542 N 0.79 1.27 -0.81 -0.27 2.02 -1.03 -2.38 112.91 112.50 1fui h THR 542 Ca 0.16 -0.92 0.04 0.00 0.77 0.00 0.00 66.41 66.46 1fui h THR 542 Cb 0.42 1.49 -0.05 0.00 -1.74 0.00 0.00 68.15 68.27 1fui h THR 542 CO 0.01 0.28 0.51 0.25 0.37 0.00 0.00 175.52 176.94 1fui h LEU 543 N 0.09 0.84 -1.03 2.58 5.85 -0.95 -2.25 115.31 120.45 1fui h LEU 543 Ca 0.05 -0.00 -0.06 0.00 0.84 0.00 0.00 57.88 58.72 1fui h LEU 543 Cb 0.42 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.25 1fui h LEU 543 CO 0.01 0.57 0.09 0.00 -0.34 0.00 0.00 178.44 178.78 1fui h ALA 544 N 1.35 1.21 -0.09 1.25 0.00 -0.90 -2.09 119.26 119.98 1fui h ALA 544 Ca 0.33 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.91 1fui h ALA 544 Cb 0.04 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1fui h ALA 544 CO -0.12 0.54 -0.43 0.66 0.00 0.00 0.00 179.25 179.89 1fui h SER 545 N 0.75 0.23 0.45 0.00 4.64 -0.88 0.23 113.55 118.96 1fui h SER 545 Ca 0.16 -0.10 -0.09 0.00 -0.47 0.00 0.00 61.79 61.29 1fui h SER 545 Cb 0.33 -0.06 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1fui h SER 545 CO 0.00 0.64 -0.44 0.24 -0.87 0.00 0.00 176.83 176.41 1fui h MET 546 N 0.18 0.00 -0.02 4.77 2.07 -0.92 -2.81 114.93 118.20 1fui h MET 546 Ca 0.01 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.64 1fui h MET 546 Cb 0.84 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.57 1fui h MET 546 CO 0.07 0.44 -0.19 1.28 1.07 0.00 0.00 176.91 179.57 1fui n LEU 547 N -4.00 2.28 -3.44 1.22 4.77 -0.89 -4.89 117.00 112.05 1fui n LEU 547 Ca -0.02 -0.78 -0.22 0.00 -0.03 0.00 0.00 56.01 54.97 1fui n LEU 547 Cb 0.46 -0.01 0.08 0.00 -2.33 0.00 0.00 43.42 41.62 1fui n LEU 547 CO 0.40 0.40 0.21 0.54 -1.33 0.00 0.00 177.39 177.60 1fui n ARG 548 N 0.53 -7.42 -3.70 3.23 3.00 0.60 -4.49 116.66 108.42 1fui n ARG 548 Ca 0.13 0.80 -0.38 0.00 -0.01 0.00 0.00 57.85 58.39 1fui n ARG 548 Cb 0.50 -5.75 -0.12 0.00 0.00 0.00 0.00 32.46 27.09 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 -3.31 4.31 0.39 0.55 1.01 -0.11 -4.82 121.20 119.22 1fui s ILE 549 Ca 0.46 -0.60 -0.27 0.00 0.00 0.00 0.00 60.65 60.24 1fui s ILE 549 Cb -0.20 -3.24 -0.10 0.00 0.01 0.00 0.00 42.46 38.93 1fui s ILE 549 CO 0.70 0.03 1.42 -2.84 0.00 0.00 0.00 174.94 174.25 1fui s PRO 550 N 1.55 4.01 -0.49 2.79 0.02 -1.26 -4.53 135.00 137.10 1fui s PRO 550 Ca 0.03 2.43 -0.18 0.00 0.02 0.00 0.00 61.00 63.30 1fui s PRO 550 Cb -0.17 -2.87 0.06 0.00 0.02 0.00 0.00 34.50 31.53 1fui s PRO 550 CO 0.05 -0.55 0.53 0.08 -0.33 0.00 0.00 177.00 176.77 1fui s VAL 551 N -1.16 5.02 -1.02 3.83 1.01 -1.26 -0.78 120.40 126.04 1fui s VAL 551 Ca 0.55 -0.69 0.27 0.00 0.00 0.00 0.00 61.98 62.11 1fui s VAL 551 Cb -0.44 -4.21 0.15 0.00 0.00 0.00 0.00 36.38 31.88 1fui s VAL 551 CO 0.58 -0.69 1.72 0.00 0.00 0.00 0.00 175.10 176.70 1fui s MET 553 N -2.99 0.64 -0.02 0.00 -2.45 -1.23 -5.05 119.30 108.20 1fui s MET 553 Ca 0.13 1.05 -0.29 0.00 -1.25 0.00 0.00 55.69 55.33 1fui s MET 553 Cb 0.18 0.16 0.10 0.00 1.25 0.00 0.00 34.83 36.52 1fui s MET 553 CO 0.60 -0.13 0.96 -3.38 1.05 0.00 0.00 175.02 174.12 1fui s HIS 554 N 1.39 -0.28 -0.16 4.11 -3.43 -1.24 -0.68 115.29 114.99 1fui s HIS 554 Ca -0.08 0.14 0.15 0.00 -0.80 0.00 0.00 55.06 54.47 1fui s HIS 554 Cb -0.05 0.55 0.43 0.00 -1.43 0.00 0.00 32.58 32.08 1fui s HIS 554 CO -0.16 -0.51 1.20 0.27 -2.00 0.00 0.00 174.74 173.53 1fui n ASN 555 N -0.25 1.89 -4.82 7.38 6.94 -1.26 -5.00 115.26 120.14 1fui n ASN 555 Ca -0.07 -3.23 -0.36 0.00 -0.02 0.00 0.00 54.58 50.90 1fui n ASN 555 Cb 0.61 -0.44 -0.06 0.00 -2.36 0.00 0.00 39.78 37.53 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 -2.53 4.59 0.28 3.53 1.01 -1.26 -4.90 120.40 121.11 1fui s VAL 556 Ca 0.38 1.24 -0.30 0.00 0.00 0.00 0.00 61.98 63.29 1fui s VAL 556 Cb 0.38 -3.83 -0.11 0.00 0.00 0.00 0.00 36.38 32.82 1fui s VAL 556 CO -0.08 0.16 1.61 -1.61 0.00 0.00 0.00 175.10 175.18 1fui s GLU 557 N -2.09 4.12 0.41 2.72 2.02 -1.26 -4.89 118.70 119.72 1fui s GLU 557 Ca 0.44 2.58 0.17 0.00 0.02 0.00 0.00 54.97 58.18 1fui s GLU 557 Cb -0.16 -3.03 1.07 0.00 0.10 0.00 0.00 34.13 32.11 1fui s GLU 557 CO 0.21 -0.65 1.82 1.49 0.02 0.00 0.00 175.26 178.15 1fui h GLU 558 N 5.20 0.41 0.00 1.61 4.81 -1.99 0.19 114.58 124.82 1fui h GLU 558 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1fui h GLU 558 Cb 1.22 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1fui h GLU 558 CO 0.82 0.27 0.00 1.79 -0.73 0.00 0.00 179.01 181.16 1fui h THR 559 N 0.42 0.00 -0.01 0.32 1.35 -2.05 -2.84 112.91 110.10 1fui h THR 559 Ca 0.52 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 1fui h THR 559 Cb 1.28 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 69.05 1fui h THR 559 CO -0.22 0.00 -0.10 0.29 -0.25 0.00 0.00 175.52 175.24 1fui n LYS 560 N -2.85 1.44 -2.73 4.72 5.02 0.67 -4.87 118.16 119.56 1fui n LYS 560 Ca 0.01 -0.89 -0.42 0.00 -2.02 0.00 0.00 58.31 54.98 1fui n LYS 560 Cb 0.28 -1.48 -0.03 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 -2.17 4.76 -0.22 -0.18 -7.23 -1.08 -4.82 120.40 109.45 1fui s VAL 561 Ca 0.32 1.91 0.01 0.00 -1.81 0.00 0.00 61.98 62.41 1fui s VAL 561 Cb 0.20 -4.26 0.05 0.00 0.56 0.00 0.00 36.38 32.94 1fui s VAL 561 CO 0.40 -0.09 -0.08 -0.47 -0.31 0.00 0.00 175.10 174.55 1fui s TYR 562 N 2.71 2.50 0.29 2.82 5.04 -1.26 -5.10 117.35 124.35 1fui s TYR 562 Ca 0.43 -1.74 0.03 0.00 -2.44 0.00 0.00 57.07 53.34 1fui s TYR 562 Cb -0.16 -1.64 -0.04 0.00 0.35 0.00 0.00 41.96 40.47 1fui s TYR 562 CO 0.10 -0.77 0.14 1.03 -1.34 0.00 0.00 175.55 174.70 1fui s ARG 563 N 1.36 1.55 0.55 4.97 0.52 -1.26 -4.21 118.95 122.43 1fui s ARG 563 Ca -0.04 -1.88 -0.21 0.00 -0.52 0.00 0.00 55.73 53.08 1fui s ARG 563 Cb -0.18 -0.19 -0.05 0.00 0.52 0.00 0.00 34.95 35.05 1fui s ARG 563 CO -0.07 -0.40 1.26 -2.30 0.02 0.00 0.00 175.30 173.82 1fui n PRO 564 N -0.56 1.51 0.19 3.54 -0.02 -1.26 -4.66 135.00 133.74 1fui n PRO 564 Ca 0.00 0.56 0.16 0.00 -2.02 0.00 0.00 63.50 62.20 1fui n PRO 564 Cb 0.65 -2.46 0.77 0.00 -0.02 0.00 0.00 33.50 32.45 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 1.26 0.00 0.09 2.55 4.64 -1.49 -1.76 113.55 118.84 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 1.32 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.41 1fui h SER 565 CO 0.56 0.00 -0.01 0.00 -0.87 0.00 0.00 176.83 176.51 1fui h ALA 566 N 1.84 1.11 -0.95 5.18 0.00 -1.89 -2.00 119.26 122.55 1fui h ALA 566 Ca 0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1fui h ALA 566 Cb 0.43 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 1fui h ALA 566 CO -0.00 0.01 0.59 -1.49 0.00 0.00 0.00 179.25 178.36 1fui h TRP 567 N 0.00 1.23 -0.30 0.00 -0.00 -1.67 -2.33 115.95 112.89 1fui h TRP 567 Ca -0.00 0.01 0.03 0.00 -0.00 0.00 0.00 58.89 58.92 1fui h TRP 567 Cb 0.06 -0.41 -0.02 0.00 -0.00 0.00 0.00 29.16 28.79 1fui h TRP 567 CO 0.00 0.80 0.20 0.00 -0.00 0.00 0.00 178.44 179.44 1fui h ALA 568 N 1.33 1.90 0.00 1.49 0.00 -1.56 0.15 119.26 122.56 1fui h ALA 568 Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1fui h ALA 568 Cb -0.09 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.62 1fui h ALA 568 CO -0.07 0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.24 1fui h ALA 569 N 1.83 1.00 -0.23 0.00 0.00 -1.54 -1.06 119.26 119.26 1fui h ALA 569 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1fui h ALA 569 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1fui h ALA 569 CO -0.03 0.00 0.00 0.72 0.00 0.00 0.00 179.25 179.94 1fui n HIS 570 N -2.64 0.29 0.00 0.00 -0.00 0.51 -5.02 115.22 108.37 1fui n HIS 570 Ca 0.00 -0.15 0.00 0.00 -0.00 0.00 0.00 57.72 57.58 1fui n HIS 570 Cb 0.20 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.19 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 1.21 4.01 0.08 -1.41 0.00 -0.40 -4.06 105.19 104.61 1fui n GLY 571 Ca 0.16 -1.64 -0.05 0.00 0.00 0.00 0.00 46.02 44.49 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 -6.31 1.61 0.00 -1.91 -3.41 114.93 104.90 1fui h MET 572 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 59.70 59.15 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 0.87 0.99 0.34 0.00 0.00 0.00 176.91 179.11 1fui s ASP 573 N -6.67 6.73 0.45 1.22 2.15 -1.26 -4.91 116.67 114.38 1fui s ASP 573 Ca 0.01 2.20 0.18 0.00 0.43 0.00 0.00 52.55 55.38 1fui s ASP 573 Cb 0.10 -2.55 1.13 0.00 -0.30 0.00 0.00 42.92 41.30 1fui s ASP 573 CO 0.80 -0.85 1.93 0.40 -0.17 0.00 0.00 175.17 177.28 1fui h ILE 574 N 5.26 0.77 0.00 4.11 1.08 -2.00 -0.51 117.51 126.23 1fui h ILE 574 Ca -0.38 -0.11 -0.20 0.00 -0.39 0.00 0.00 64.86 63.77 1fui h ILE 574 Cb 1.18 0.41 -0.03 0.00 -3.07 0.00 0.00 36.82 35.31 1fui h ILE 574 CO 0.94 0.06 -1.10 -0.08 -0.69 0.00 0.00 178.15 177.28 1fui h GLU 575 N 0.33 0.01 -0.73 2.37 4.81 -1.95 -3.32 114.58 116.10 1fui h GLU 575 Ca 0.36 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.61 1fui h GLU 575 Cb 0.92 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 30.26 1fui h GLU 575 CO -0.10 1.01 0.45 0.78 -0.73 0.00 0.00 179.01 180.42 1fui h GLY 576 N -0.94 1.07 1.46 1.92 0.00 -1.91 -1.41 103.07 103.25 1fui h GLY 576 Ca -0.30 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 46.69 1fui h GLY 576 CO -0.17 0.25 0.32 0.06 0.00 0.00 0.00 176.54 177.00 1fui h GLN 577 N 0.85 0.72 0.13 4.80 3.07 -1.23 -1.65 115.11 121.80 1fui h GLN 577 Ca 0.31 -0.06 -0.01 0.00 0.09 0.00 0.00 58.65 58.98 1fui h GLN 577 Cb 0.08 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 27.49 1fui h GLN 577 CO -0.14 0.51 -0.06 0.22 0.09 0.00 0.00 178.83 179.45 1fui h ASP 578 N 0.73 -0.15 -0.82 0.06 3.58 -1.38 -0.03 116.42 118.42 1fui h ASP 578 Ca 0.19 -0.34 -0.03 0.00 0.42 0.00 0.00 57.03 57.27 1fui h ASP 578 Cb -0.02 0.04 -0.04 0.00 1.72 0.00 0.00 39.33 41.03 1fui h ASP 578 CO -0.04 0.30 0.39 1.88 -2.88 0.00 0.00 179.24 178.89 1fui h TYR 579 N -0.63 1.18 -0.16 0.28 -1.99 -1.23 -0.59 116.97 113.83 1fui h TYR 579 Ca -0.02 -0.06 -0.02 0.00 2.00 0.00 0.00 58.73 60.64 1fui h TYR 579 Cb 0.48 -0.37 -0.01 0.00 2.00 0.00 0.00 36.73 38.84 1fui h TYR 579 CO 0.06 0.85 0.03 0.00 -0.00 0.00 0.00 178.16 179.11 1fui h ARG 580 N 1.17 0.26 -0.32 4.88 3.08 -1.29 -2.06 114.38 120.10 1fui h ARG 580 Ca 0.28 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.23 1fui h ARG 580 Cb 0.12 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 1fui h ARG 580 CO -0.04 0.43 0.09 0.00 -1.07 0.00 0.00 179.97 179.39 1fui h ALA 581 N 0.82 0.43 -0.80 0.04 0.00 -0.84 -1.30 119.26 117.61 1fui h ALA 581 Ca 0.05 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 1fui h ALA 581 Cb 0.30 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.92 1fui h ALA 581 CO 0.00 0.08 0.41 0.00 0.00 0.00 0.00 179.25 179.74 1fui h GLN 583 N 1.12 0.91 0.42 0.00 4.15 -1.22 0.40 115.11 120.88 1fui h GLN 583 Ca 0.28 -0.36 -0.02 0.00 0.77 0.00 0.00 58.65 59.32 1fui h GLN 583 Cb 0.06 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.71 1fui h GLN 583 CO -0.04 1.01 -0.20 -0.97 -1.93 0.00 0.00 178.83 176.70 1fui h ASN 584 N 0.79 -0.48 0.19 -0.69 -1.24 -0.33 -3.33 115.58 110.49 1fui h ASN 584 Ca 0.11 0.02 -0.12 0.00 0.71 0.00 0.00 56.30 57.02 1fui h ASN 584 Cb 0.73 0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.89 1fui h ASN 584 CO 0.06 -0.33 -0.44 1.88 -1.29 0.00 0.00 177.43 177.31 1fui h TYR 585 N -0.60 0.38 -1.51 0.67 0.05 -1.07 -3.50 116.97 111.39 1fui h TYR 585 Ca -0.06 -0.11 0.14 0.00 0.05 0.00 0.00 58.73 58.75 1fui h TYR 585 Cb 0.43 -0.08 -0.04 0.00 1.01 0.00 0.00 36.73 38.06 1fui h TYR 585 CO 0.12 0.71 -0.19 0.41 -1.05 0.00 0.00 178.16 178.16 1fui n GLY 586 N -0.07 -1.87 3.68 3.88 0.00 0.13 -4.85 105.19 106.08 1fui n GLY 586 Ca -0.02 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.35 1fui n GLY 586 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fui n PRO 587 N -2.19 0.87 -0.02 1.61 -0.04 -1.26 -4.74 135.00 129.23 1fui n PRO 587 Ca 0.00 0.35 -0.06 0.00 -0.04 0.00 0.00 63.50 63.76 1fui n PRO 587 Cb 0.24 -2.38 0.14 0.00 -0.04 0.00 0.00 33.50 31.46 1fui n PRO 587 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1fui h LEU 588 N 0.24 0.61 0.00 1.53 5.85 -1.78 -3.36 115.31 118.40 1fui h LEU 588 Ca -0.49 -0.22 -0.26 0.00 0.84 0.00 0.00 57.88 57.75 1fui h LEU 588 Cb 1.34 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 1fui h LEU 588 CO 0.51 0.86 -2.26 -1.22 -0.34 0.00 0.00 178.44 175.99 1fui n TYR 589 N -4.10 0.02 -3.58 1.25 4.01 -0.49 -4.84 117.16 109.43 1fui n TYR 589 Ca -0.00 0.01 -0.08 0.00 -0.16 0.00 0.00 57.90 57.67 1fui n TYR 589 Cb 0.44 -0.85 -0.04 0.00 -0.31 0.00 0.00 39.34 38.58 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 -2.81 0.46 0.00 -0.72 -2.85 -1.24 -5.01 119.74 107.58 1fui s LYS 590 Ca -0.09 0.03 0.00 0.00 -1.00 0.00 0.00 55.97 54.90 1fui s LYS 590 Cb 0.08 0.22 0.00 0.00 -2.06 0.00 0.00 37.83 36.07 1fui s LYS 590 CO 0.85 -0.16 0.00 -2.13 0.10 0.00 0.00 175.35 174.01