#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ptj s LYS 2 N 0.00 1.94 -0.02 2.12 1.02 -1.26 0.27 119.74 123.81 1ptj s LYS 2 Ca 0.00 -1.04 0.03 0.00 0.02 0.00 0.00 55.97 54.98 1ptj s LYS 2 Cb 0.00 -2.08 -0.00 0.00 -0.52 0.00 0.00 37.83 35.23 1ptj s LYS 2 CO 0.00 0.53 -0.10 -1.50 -0.92 0.00 0.00 175.35 173.36 1ptj s ILE 3 N -0.85 0.80 0.02 2.17 2.07 0.55 -0.39 121.20 125.58 1ptj s ILE 3 Ca 0.13 -0.39 0.05 0.00 -1.41 0.00 0.00 60.65 59.03 1ptj s ILE 3 Cb -0.10 -0.70 -0.02 0.00 0.13 0.00 0.00 42.46 41.77 1ptj s ILE 3 CO 0.03 0.24 -0.16 0.00 -1.91 0.00 0.00 174.94 173.15 1ptj s ALA 4 N 0.03 1.30 -0.21 1.50 0.00 -0.18 -1.32 121.76 122.89 1ptj s ALA 4 Ca -0.01 -0.80 0.01 0.00 0.00 0.00 0.00 51.96 51.17 1ptj s ALA 4 Cb -0.07 -0.26 0.05 0.00 0.00 0.00 0.00 23.12 22.83 1ptj s ALA 4 CO 0.00 0.28 -0.11 0.42 0.00 0.00 0.00 175.76 176.36 1ptj s ILE 5 N -0.65 1.74 0.68 0.00 1.09 -0.76 -1.39 121.20 121.92 1ptj s ILE 5 Ca 0.04 -1.11 -0.07 0.00 -1.10 0.00 0.00 60.65 58.41 1ptj s ILE 5 Cb -0.07 -1.81 0.05 0.00 -1.06 0.00 0.00 42.46 39.56 1ptj s ILE 5 CO 0.01 0.14 1.00 -2.16 -0.10 0.00 0.00 174.94 173.82 1ptj s PRO 6 N 1.35 2.35 0.26 2.79 0.04 -1.25 -1.65 135.00 138.88 1ptj s PRO 6 Ca -0.02 -0.19 -0.23 0.00 0.04 0.00 0.00 61.00 60.59 1ptj s PRO 6 Cb -0.17 -2.18 -0.09 0.00 0.04 0.00 0.00 34.50 32.10 1ptj s PRO 6 CO -0.08 -1.13 0.83 0.21 0.04 0.00 0.00 177.00 176.86 1ptj s LYS 7 N -5.20 4.44 -0.01 4.56 2.36 -1.26 -4.76 119.74 119.86 1ptj s LYS 7 Ca 0.59 1.10 -0.30 0.00 -2.55 0.00 0.00 55.97 54.81 1ptj s LYS 7 Cb -0.11 -2.90 -0.04 0.00 -1.05 0.00 0.00 37.83 33.73 1ptj s LYS 7 CO 0.45 0.37 1.21 -1.21 1.55 0.00 0.00 175.35 177.72 1ptj s GLU 8 N -1.90 4.38 0.00 4.03 0.41 -1.26 -4.92 118.70 119.44 1ptj s GLU 8 Ca 0.45 1.73 0.18 0.00 -0.41 0.00 0.00 54.97 56.92 1ptj s GLU 8 Cb -0.18 -3.48 -0.15 0.00 -1.78 0.00 0.00 34.13 28.54 1ptj s GLU 8 CO 0.23 -0.38 0.81 0.54 -0.49 0.00 0.00 175.26 175.97 1ptj n ARG 9 N 4.73 1.20 -2.27 1.61 5.12 -1.26 -4.93 116.66 120.86 1ptj n ARG 9 Ca 0.10 -0.23 -0.36 0.00 -1.93 0.00 0.00 57.85 55.43 1ptj n ARG 9 Cb 0.46 -1.35 -0.01 0.00 -1.16 0.00 0.00 32.46 30.41 1ptj n ARG 9 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1ptj s ARG 10 N -2.55 3.59 -0.19 5.56 0.52 -1.26 -4.90 118.95 119.71 1ptj s ARG 10 Ca 0.09 1.68 -0.36 0.00 -0.52 0.00 0.00 55.73 56.63 1ptj s ARG 10 Cb 0.14 -2.22 -0.12 0.00 0.52 0.00 0.00 34.95 33.27 1ptj s ARG 10 CO 0.67 -0.67 1.93 -2.30 0.02 0.00 0.00 175.30 174.94 1ptj n PRO 11 N -0.86 1.71 0.00 3.54 -0.02 -1.26 -2.71 135.00 135.41 1ptj n PRO 11 Ca 0.09 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1ptj n PRO 11 Cb 0.49 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1ptj n PRO 11 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ptj n GLY 12 N 4.83 2.76 3.36 -1.23 0.00 -1.26 -5.02 105.19 108.64 1ptj n GLY 12 Ca 0.27 -0.68 -0.56 0.00 0.00 0.00 0.00 46.02 45.05 1ptj n GLY 12 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ptj n GLU 13 N 0.00 0.54 -0.04 1.61 4.07 -1.10 -4.81 120.64 120.90 1ptj n GLU 13 Ca 0.00 0.15 0.07 0.00 -0.06 0.00 0.00 57.16 57.32 1ptj n GLU 13 Cb 0.00 -1.97 0.08 0.00 -0.06 0.00 0.00 31.44 29.50 1ptj n GLU 13 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1ptj n ASP 14 N 8.46 2.35 -4.91 4.31 8.00 -1.26 -4.75 116.55 128.75 1ptj n ASP 14 Ca 0.47 -1.66 -0.27 0.00 0.71 0.00 0.00 54.79 54.04 1ptj n ASP 14 Cb 0.09 -0.06 0.03 0.00 -0.02 0.00 0.00 41.12 41.17 1ptj n ASP 14 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1ptj s ARG 15 N -1.12 2.89 -0.05 -1.24 0.52 -1.26 -3.03 118.95 115.67 1ptj s ARG 15 Ca 0.19 0.08 -0.10 0.00 -0.52 0.00 0.00 55.73 55.38 1ptj s ARG 15 Cb 0.12 -2.22 0.02 0.00 0.52 0.00 0.00 34.95 33.39 1ptj s ARG 15 CO 0.18 -0.77 0.23 0.54 0.02 0.00 0.00 175.30 175.49 1ptj s VAL 16 N -3.07 0.03 -1.50 3.52 0.11 -1.26 -4.45 120.40 113.79 1ptj s VAL 16 Ca 0.55 -0.29 -0.09 0.00 -2.93 0.00 0.00 61.98 59.23 1ptj s VAL 16 Cb -0.11 -0.43 0.00 0.00 -1.53 0.00 0.00 36.38 34.32 1ptj s VAL 16 CO 0.46 -0.16 2.67 0.00 -3.33 0.00 0.00 175.10 174.75 1ptj n ALA 17 N 2.19 7.10 -3.60 1.54 0.00 -1.26 -4.64 120.51 121.83 1ptj n ALA 17 Ca -0.17 -3.78 -0.00 0.00 0.00 0.00 0.00 53.44 49.49 1ptj n ALA 17 Cb 0.57 -3.16 -0.01 0.00 0.00 0.00 0.00 19.45 16.85 1ptj n ALA 17 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1ptj s ILE 18 N 0.98 0.00 0.20 0.00 1.10 -1.26 -4.77 121.20 117.45 1ptj s ILE 18 Ca 0.62 -0.07 -0.23 0.00 -0.51 0.00 0.00 60.65 60.46 1ptj s ILE 18 Cb 0.18 -1.53 0.05 0.00 0.15 0.00 0.00 42.46 41.30 1ptj s ILE 18 CO -0.07 0.00 0.73 -0.94 -2.11 0.00 0.00 174.94 172.54 1ptj s SER 19 N -2.57 -0.36 0.07 4.50 1.04 -1.26 -4.48 113.70 110.64 1ptj s SER 19 Ca 0.13 -0.34 -0.23 0.00 0.48 0.00 0.00 55.95 55.98 1ptj s SER 19 Cb 0.03 0.63 -0.16 0.00 0.10 0.00 0.00 66.02 66.62 1ptj s SER 19 CO -0.04 -1.11 1.64 -0.65 0.98 0.00 0.00 173.24 174.05 1ptj h PRO 20 N 2.00 0.02 -0.83 4.02 0.11 -1.95 -2.90 132.00 132.47 1ptj h PRO 20 Ca -0.25 -0.00 0.16 0.00 0.11 0.00 0.00 66.00 66.02 1ptj h PRO 20 Cb 1.27 -0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.27 1ptj h PRO 20 CO 0.29 0.13 0.39 1.49 -0.21 0.00 0.00 178.00 180.08 1ptj h GLU 21 N -0.08 0.51 0.00 1.05 4.81 -1.97 -1.34 114.58 117.55 1ptj h GLU 21 Ca 0.01 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1ptj h GLU 21 Cb 0.11 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1ptj h GLU 21 CO -0.00 0.33 0.00 0.28 -0.73 0.00 0.00 179.01 178.89 1ptj h VAL 22 N 0.52 0.00 -0.08 0.32 2.07 -1.92 -3.08 116.25 114.07 1ptj h VAL 22 Ca 0.47 -0.59 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 1ptj h VAL 22 Cb 0.73 1.57 0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1ptj h VAL 22 CO -0.41 0.00 -0.38 0.58 0.02 0.00 0.00 177.57 177.38 1ptj h VAL 23 N 0.00 1.41 -0.49 2.57 2.07 -1.05 -2.23 116.25 118.53 1ptj h VAL 23 Ca 0.00 -1.76 0.10 0.00 0.82 0.00 0.00 66.70 65.86 1ptj h VAL 23 Cb 0.60 2.28 -0.10 0.00 -1.52 0.00 0.00 31.29 32.56 1ptj h VAL 23 CO 0.00 0.51 -0.16 0.11 0.02 0.00 0.00 177.57 178.06 1ptj h LYS 24 N -0.07 -0.04 -0.50 1.57 1.57 -1.44 0.32 116.57 117.98 1ptj h LYS 24 Ca -0.02 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1ptj h LYS 24 Cb 1.02 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.32 1ptj h LYS 24 CO 0.08 -0.03 0.18 0.87 -0.57 0.00 0.00 179.45 179.98 1ptj h LYS 25 N -0.04 0.76 -0.82 3.15 1.79 -1.58 -2.03 116.57 117.80 1ptj h LYS 25 Ca 0.23 -0.15 -0.02 0.00 -2.18 0.00 0.00 60.65 58.54 1ptj h LYS 25 Cb 0.40 -0.12 -0.04 0.00 -1.58 0.00 0.00 32.23 30.90 1ptj h LYS 25 CO -0.53 0.69 0.44 -0.07 -1.08 0.00 0.00 179.45 178.91 1ptj h LEU 26 N 0.67 1.02 0.42 2.94 3.38 -0.60 -2.87 115.31 120.27 1ptj h LEU 26 Ca 0.16 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 1ptj h LEU 26 Cb 0.23 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1ptj h LEU 26 CO -0.01 0.83 -0.20 0.58 0.09 0.00 0.00 178.44 179.73 1ptj h VAL 27 N 1.15 0.59 0.00 1.22 2.07 -0.12 -2.46 116.25 118.69 1ptj h VAL 27 Ca 0.29 -0.15 0.00 0.00 0.82 0.00 0.00 66.70 67.65 1ptj h VAL 27 Cb 0.04 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 30.47 1ptj h VAL 27 CO -0.05 0.03 0.17 0.61 0.02 0.00 0.00 177.57 178.35 1ptj n GLY 28 N -1.09 -0.72 0.25 2.17 0.00 -0.79 0.13 105.19 105.14 1ptj n GLY 28 Ca -0.11 0.15 0.13 0.00 0.00 0.00 0.00 46.02 46.19 1ptj n GLY 28 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ptj n LEU 29 N -2.13 1.09 0.00 0.99 4.77 -0.96 -4.93 117.00 115.83 1ptj n LEU 29 Ca -0.01 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.67 1ptj n LEU 29 Cb 0.20 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1ptj n LEU 29 CO 0.07 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1ptj n GLY 30 N 1.37 1.23 3.83 -0.72 0.00 0.12 -4.80 105.19 106.22 1ptj n GLY 30 Ca 0.11 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 1ptj n GLY 30 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ptj s PHE 31 N -2.00 3.47 -0.31 1.61 0.40 -1.00 -3.93 117.98 116.22 1ptj s PHE 31 Ca 0.00 0.41 -0.13 0.00 -0.60 0.00 0.00 56.93 56.61 1ptj s PHE 31 Cb 0.00 -1.88 -0.03 0.00 0.51 0.00 0.00 43.02 41.62 1ptj s PHE 31 CO 0.00 0.66 0.28 -1.21 0.70 0.00 0.00 175.22 175.65 1ptj s GLU 32 N -1.12 3.74 -0.31 0.44 2.02 0.14 -4.30 118.70 119.32 1ptj s GLU 32 Ca 0.16 -0.36 -0.10 0.00 0.02 0.00 0.00 54.97 54.69 1ptj s GLU 32 Cb -0.12 -3.74 -0.01 0.00 0.10 0.00 0.00 34.13 30.37 1ptj s GLU 32 CO 0.05 -0.36 0.15 0.08 0.02 0.00 0.00 175.26 175.21 1ptj s VAL 33 N 1.88 4.58 -0.14 2.63 1.01 -1.26 -0.33 120.40 128.77 1ptj s VAL 33 Ca 0.09 -0.44 -0.01 0.00 0.00 0.00 0.00 61.98 61.62 1ptj s VAL 33 Cb -0.16 -3.34 -0.02 0.00 0.00 0.00 0.00 36.38 32.85 1ptj s VAL 33 CO 0.11 0.06 -0.09 -0.63 0.00 0.00 0.00 175.10 174.54 1ptj s ILE 34 N 1.61 3.40 0.14 2.22 1.09 -0.44 0.86 121.20 130.07 1ptj s ILE 34 Ca 0.04 -0.54 0.11 0.00 -1.10 0.00 0.00 60.65 59.16 1ptj s ILE 34 Cb -0.17 -2.45 -0.04 0.00 -1.06 0.00 0.00 42.46 38.74 1ptj s ILE 34 CO 0.06 0.52 -0.26 -0.69 -0.10 0.00 0.00 174.94 174.46 1ptj s VAL 35 N 0.30 2.27 0.11 2.92 1.01 0.02 -1.82 120.40 125.21 1ptj s VAL 35 Ca -0.07 -1.80 -0.30 0.00 0.00 0.00 0.00 61.98 59.81 1ptj s VAL 35 Cb -0.15 -2.01 -0.06 0.00 0.00 0.00 0.00 36.38 34.16 1ptj s VAL 35 CO 0.04 0.06 1.02 -0.70 0.00 0.00 0.00 175.10 175.52 1ptj s GLU 36 N -2.15 4.63 -0.05 2.72 2.12 -0.66 -0.63 118.70 124.68 1ptj s GLU 36 Ca 0.15 1.55 -0.35 0.00 0.36 0.00 0.00 54.97 56.68 1ptj s GLU 36 Cb -0.10 -3.36 -0.13 0.00 0.26 0.00 0.00 34.13 30.80 1ptj s GLU 36 CO 0.07 0.10 1.75 0.94 -0.54 0.00 0.00 175.26 177.57 1ptj n GLN 37 N 2.93 1.93 -0.93 4.30 0.00 0.63 -0.74 117.38 125.50 1ptj n GLN 37 Ca 0.04 0.70 0.00 0.00 -0.00 0.00 0.00 57.00 57.74 1ptj n GLN 37 Cb 0.48 -2.49 0.00 0.00 0.00 0.00 0.00 30.24 28.23 1ptj n GLN 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1ptj n GLY 38 N 4.01 0.68 0.21 1.69 0.00 -1.26 -4.93 105.19 105.58 1ptj n GLY 38 Ca 0.22 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.29 1ptj n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ptj h ALA 39 N 0.00 1.42 -0.59 4.61 0.00 -1.29 -3.06 119.26 120.35 1ptj h ALA 39 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1ptj h ALA 39 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1ptj h ALA 39 CO 0.00 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.00 1ptj n GLY 40 N -0.61 2.96 0.21 0.00 0.00 -1.25 -4.53 105.19 101.96 1ptj n GLY 40 Ca -0.02 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1ptj n GLY 40 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ptj h VAL 41 N 4.03 1.27 0.00 1.61 2.07 -1.65 0.13 116.25 123.71 1ptj h VAL 41 Ca 0.00 -1.27 0.00 0.00 0.82 0.00 0.00 66.70 66.25 1ptj h VAL 41 Cb 1.89 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 33.21 1ptj h VAL 41 CO 0.44 0.38 0.00 1.23 0.02 0.00 0.00 177.57 179.64 1ptj h GLY 42 N 1.07 0.00 -1.76 2.17 0.00 -1.80 -3.17 103.07 99.59 1ptj h GLY 42 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1ptj h GLY 42 CO 0.05 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.59 1ptj n ALA 43 N -2.02 2.32 -0.88 3.60 0.00 -1.09 -4.35 120.51 118.09 1ptj n ALA 43 Ca 0.04 -1.27 0.00 0.00 0.00 0.00 0.00 53.44 52.21 1ptj n ALA 43 Cb 0.47 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.32 1ptj n ALA 43 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1ptj n SER 44 N 0.79 -2.49 -4.51 0.00 7.64 -0.91 -4.22 113.62 109.92 1ptj n SER 44 Ca 0.16 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.61 1ptj n SER 44 Cb 0.53 -1.74 -0.04 0.00 -1.01 0.00 0.00 64.21 61.94 1ptj n SER 44 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1ptj s ILE 45 N -1.90 4.45 0.62 0.44 1.01 0.42 -4.98 121.20 121.26 1ptj s ILE 45 Ca 0.00 0.19 -0.13 0.00 0.00 0.00 0.00 60.65 60.71 1ptj s ILE 45 Cb 0.00 -4.51 -0.03 0.00 0.01 0.00 0.00 42.46 37.93 1ptj s ILE 45 CO 0.00 -1.07 1.04 0.42 0.00 0.00 0.00 174.94 175.33 1ptj s THR 46 N 3.78 4.17 0.14 2.92 -4.23 -1.26 -3.85 115.64 117.31 1ptj s THR 46 Ca 0.29 0.86 -0.15 0.00 -1.18 0.00 0.00 61.69 61.51 1ptj s THR 46 Cb -0.13 -3.53 0.01 0.00 1.34 0.00 0.00 72.50 70.19 1ptj s THR 46 CO 0.18 -0.77 1.71 0.44 -0.54 0.00 0.00 174.62 175.64 1ptj h ASP 47 N 0.01 0.59 -0.72 3.99 3.32 -1.96 -2.71 116.42 118.94 1ptj h ASP 47 Ca -0.45 -0.15 0.13 0.00 0.02 0.00 0.00 57.03 56.58 1ptj h ASP 47 Cb 1.20 -0.15 -0.09 0.00 0.22 0.00 0.00 39.33 40.51 1ptj h ASP 47 CO 0.59 0.57 0.29 0.44 -1.72 0.00 0.00 179.24 179.41 1ptj h ASP 48 N 0.57 0.28 -0.66 6.45 3.32 -2.01 -2.04 116.42 122.33 1ptj h ASP 48 Ca 0.15 0.10 -0.06 0.00 0.02 0.00 0.00 57.03 57.24 1ptj h ASP 48 Cb 0.15 0.07 -0.03 0.00 0.22 0.00 0.00 39.33 39.75 1ptj h ASP 48 CO -0.02 0.12 0.17 0.00 -1.72 0.00 0.00 179.24 177.80 1ptj h ALA 49 N 1.51 0.87 -0.40 3.45 0.00 -1.88 -2.73 119.26 120.08 1ptj h ALA 49 Ca 0.39 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.96 1ptj h ALA 49 Cb 0.55 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1ptj h ALA 49 CO -0.37 0.58 -0.18 -0.07 0.00 0.00 0.00 179.25 179.21 1ptj h LEU 50 N 0.98 0.76 -0.05 0.00 4.07 -1.09 -2.74 115.31 117.24 1ptj h LEU 50 Ca 0.21 -0.25 -0.00 0.00 0.08 0.00 0.00 57.88 57.91 1ptj h LEU 50 Cb 0.35 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 41.88 1ptj h LEU 50 CO 0.00 0.94 0.01 0.71 -1.08 0.00 0.00 178.44 179.02 1ptj h THR 51 N 0.67 1.20 -0.72 0.22 1.35 -1.37 -2.35 112.91 111.91 1ptj h THR 51 Ca 0.10 -0.59 0.20 0.00 -0.55 0.00 0.00 66.41 65.58 1ptj h THR 51 Cb 0.67 1.51 -0.03 0.00 -1.73 0.00 0.00 68.15 68.57 1ptj h THR 51 CO 0.05 0.16 0.51 0.00 -0.25 0.00 0.00 175.52 175.99 1ptj h ALA 52 N 0.78 2.61 0.00 6.62 0.00 -1.43 0.90 119.26 128.74 1ptj h ALA 52 Ca 0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ptj h ALA 52 Cb 0.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1ptj h ALA 52 CO 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 179.25 178.44 1ptj n ALA 53 N -2.66 2.47 0.00 0.00 0.00 -0.92 -4.91 120.51 114.49 1ptj n ALA 53 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1ptj n ALA 53 Cb 0.76 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.73 1ptj n ALA 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ptj n GLY 54 N 1.09 1.21 3.92 0.00 0.00 0.31 -3.76 105.19 107.96 1ptj n GLY 54 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 1ptj n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ptj s ALA 55 N -2.17 2.13 0.26 4.61 0.00 -0.99 -4.79 121.76 120.82 1ptj s ALA 55 Ca 0.00 -1.21 0.12 0.00 0.00 0.00 0.00 51.96 50.86 1ptj s ALA 55 Cb 0.00 -2.77 -0.05 0.00 0.00 0.00 0.00 23.12 20.30 1ptj s ALA 55 CO 0.00 -2.53 -0.21 0.99 0.00 0.00 0.00 175.76 174.01 1ptj s THR 56 N -3.86 2.45 -0.15 0.00 2.01 0.25 -4.36 115.64 111.97 1ptj s THR 56 Ca 0.74 -2.33 -0.02 0.00 0.31 0.00 0.00 61.69 60.39 1ptj s THR 56 Cb -0.04 -2.26 -0.02 0.00 0.01 0.00 0.00 72.50 70.19 1ptj s THR 56 CO 0.53 -0.34 -0.09 -0.63 -0.69 0.00 0.00 174.62 173.40 1ptj s ILE 57 N -2.34 3.33 -0.12 1.82 1.01 -1.26 -0.80 121.20 122.84 1ptj s ILE 57 Ca 0.28 -0.55 -0.07 0.00 0.00 0.00 0.00 60.65 60.31 1ptj s ILE 57 Cb -0.06 -2.44 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1ptj s ILE 57 CO 0.14 0.50 0.13 0.00 0.00 0.00 0.00 174.94 175.71 1ptj s ALA 58 N 0.54 3.81 0.04 9.38 0.00 0.20 -4.89 121.76 130.84 1ptj s ALA 58 Ca -0.06 -0.66 -0.24 0.00 0.00 0.00 0.00 51.96 51.00 1ptj s ALA 58 Cb -0.15 -1.94 -0.17 0.00 0.00 0.00 0.00 23.12 20.85 1ptj s ALA 58 CO 0.03 0.58 1.52 0.77 0.00 0.00 0.00 175.76 178.67 1ptj h SER 59 N 5.12 -0.03 -2.16 0.00 0.02 -1.95 0.18 113.55 114.73 1ptj h SER 59 Ca -0.54 -0.21 -0.59 0.00 -0.84 0.00 0.00 61.79 59.61 1ptj h SER 59 Cb 1.22 0.01 -0.12 0.00 0.14 0.00 0.00 62.40 63.64 1ptj h SER 59 CO 0.59 0.19 -0.71 0.28 -1.14 0.00 0.00 176.83 176.04 1ptj s THR 60 N -5.31 2.73 0.16 -2.27 -1.32 -1.26 -4.52 115.64 103.84 1ptj s THR 60 Ca -0.14 -2.22 -0.15 0.00 -1.21 0.00 0.00 61.69 57.96 1ptj s THR 60 Cb 0.04 -2.52 0.03 0.00 -1.51 0.00 0.00 72.50 68.54 1ptj s THR 60 CO 0.66 -0.36 1.79 0.00 -2.21 0.00 0.00 174.62 174.50 1ptj h ALA 61 N 2.10 0.59 -0.91 11.08 0.00 -1.97 -1.12 119.26 129.04 1ptj h ALA 61 Ca -0.42 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 54.52 1ptj h ALA 61 Cb 1.26 -0.19 -0.07 0.00 0.00 0.00 0.00 17.79 18.80 1ptj h ALA 61 CO 0.62 0.08 0.59 0.00 0.00 0.00 0.00 179.25 180.53 1ptj h ALA 62 N 1.13 1.60 0.00 0.00 0.00 -1.98 -0.07 119.26 119.94 1ptj h ALA 62 Ca 0.16 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.94 1ptj h ALA 62 Cb 0.00 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1ptj h ALA 62 CO -0.03 0.22 -0.61 0.37 0.00 0.00 0.00 179.25 179.21 1ptj h GLN 63 N 0.93 0.00 -0.57 0.00 4.15 -1.78 -1.79 115.11 116.04 1ptj h GLN 63 Ca 0.42 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.75 1ptj h GLN 63 Cb 0.37 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.04 1ptj h GLN 63 CO -0.18 0.61 0.02 0.00 -1.93 0.00 0.00 178.83 177.35 1ptj h ALA 64 N 1.39 0.77 0.00 3.38 0.00 0.21 -3.18 119.26 121.84 1ptj h ALA 64 Ca -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1ptj h ALA 64 Cb 1.09 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1ptj h ALA 64 CO 0.08 0.58 -0.92 1.28 0.00 0.00 0.00 179.25 180.28 1ptj n LEU 65 N -4.25 0.78 -0.22 0.00 7.99 -0.97 -4.48 117.00 115.85 1ptj n LEU 65 Ca 0.02 0.26 0.01 0.00 -0.01 0.00 0.00 56.01 56.30 1ptj n LEU 65 Cb 0.32 -0.10 0.05 0.00 -0.11 0.00 0.00 43.42 43.59 1ptj n LEU 65 CO 0.43 -0.13 0.36 -1.54 -1.51 0.00 0.00 177.39 175.01 1ptj n SER 66 N -2.44 -0.30 -1.21 -1.43 3.41 -0.68 -1.06 113.62 109.91 1ptj n SER 66 Ca 0.01 1.01 -0.02 0.00 -0.26 0.00 0.00 58.87 59.61 1ptj n SER 66 Cb 0.51 -0.27 0.13 0.00 -0.26 0.00 0.00 64.21 64.32 1ptj n SER 66 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ptj n GLN 67 N -4.90 1.84 -2.68 4.33 6.02 -1.26 -4.70 117.38 116.03 1ptj n GLN 67 Ca 0.08 -3.33 -0.43 0.00 -0.01 0.00 0.00 57.00 53.31 1ptj n GLN 67 Cb 0.26 -1.54 -0.02 0.00 1.02 0.00 0.00 30.24 29.96 1ptj n GLN 67 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ptj s ALA 68 N -2.88 3.50 -0.17 -1.58 0.00 -0.22 -4.69 121.76 115.72 1ptj s ALA 68 Ca 0.40 0.30 0.16 0.00 0.00 0.00 0.00 51.96 52.82 1ptj s ALA 68 Cb 0.38 -3.47 0.04 0.00 0.00 0.00 0.00 23.12 20.07 1ptj s ALA 68 CO -0.06 -0.75 1.34 -0.44 0.00 0.00 0.00 175.76 175.85 1ptj h ASP 69 N 7.22 0.00 -3.27 0.00 3.32 -1.06 -3.43 116.42 119.19 1ptj h ASP 69 Ca -0.27 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.64 1ptj h ASP 69 Cb 1.12 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.39 1ptj h ASP 69 CO 0.90 0.48 -0.35 0.54 -1.72 0.00 0.00 179.24 179.08 1ptj s VAL 70 N -2.98 -0.03 -0.13 -1.35 0.11 -0.54 -2.43 120.40 113.05 1ptj s VAL 70 Ca 0.03 0.11 0.01 0.00 -2.93 0.00 0.00 61.98 59.20 1ptj s VAL 70 Cb 0.08 -0.54 -0.00 0.00 -1.53 0.00 0.00 36.38 34.38 1ptj s VAL 70 CO 0.75 0.04 -0.18 -0.69 -3.33 0.00 0.00 175.10 171.70 1ptj s VAL 71 N 1.33 2.56 -0.13 2.04 1.01 0.26 -1.01 120.40 126.47 1ptj s VAL 71 Ca -0.09 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.04 1ptj s VAL 71 Cb -0.09 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.21 1ptj s VAL 71 CO -0.11 0.53 -0.04 0.26 0.00 0.00 0.00 175.10 175.74 1ptj s TRP 72 N 0.53 3.02 0.16 5.22 0.52 -0.48 -1.72 118.94 126.19 1ptj s TRP 72 Ca -0.11 -0.16 -0.03 0.00 0.02 0.00 0.00 56.10 55.82 1ptj s TRP 72 Cb -0.16 -1.88 -0.03 0.00 -1.15 0.00 0.00 33.47 30.25 1ptj s TRP 72 CO 0.04 0.12 0.14 0.15 0.02 0.00 0.00 176.95 177.42 1ptj s LYS 73 N -0.08 1.06 -0.11 4.98 1.02 -0.83 -3.94 119.74 121.85 1ptj s LYS 73 Ca 0.02 -1.42 -0.08 0.00 0.02 0.00 0.00 55.97 54.51 1ptj s LYS 73 Cb -0.13 0.29 -0.03 0.00 -0.52 0.00 0.00 37.83 37.44 1ptj s LYS 73 CO 0.03 -0.34 -0.15 0.28 -0.92 0.00 0.00 175.35 174.25 1ptj n VAL 74 N -0.17 1.02 -3.99 3.17 0.31 -1.26 -4.22 118.33 113.19 1ptj n VAL 74 Ca -0.04 0.29 -0.23 0.00 -0.01 0.00 0.00 64.34 64.35 1ptj n VAL 74 Cb 0.64 -2.13 -0.03 0.00 -0.91 0.00 0.00 33.84 31.41 1ptj n VAL 74 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1ptj s GLN 75 N -1.98 3.32 0.38 5.55 0.74 -1.26 -1.07 119.66 125.34 1ptj s GLN 75 Ca -0.12 -0.76 -0.27 0.00 0.05 0.00 0.00 55.36 54.26 1ptj s GLN 75 Cb 0.02 -2.85 -0.11 0.00 1.10 0.00 0.00 33.01 31.17 1ptj s GLN 75 CO 0.18 0.46 1.28 2.89 -0.55 0.00 0.00 175.29 179.55 1ptj n ARG 76 N -1.00 2.03 -1.75 1.67 1.85 -1.19 -4.77 116.66 113.49 1ptj n ARG 76 Ca -0.08 0.72 -0.39 0.00 -1.00 0.00 0.00 57.85 57.09 1ptj n ARG 76 Cb 0.56 -2.35 0.03 0.00 -1.05 0.00 0.00 32.46 29.65 1ptj n ARG 76 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 177.63 175.32 1ptj n PRO 77 N 0.32 2.05 -2.52 2.89 -0.02 -1.26 -4.92 135.00 131.55 1ptj n PRO 77 Ca 0.06 0.74 -0.43 0.00 -2.02 0.00 0.00 63.50 61.84 1ptj n PRO 77 Cb 0.38 -2.61 -0.02 0.00 -0.02 0.00 0.00 33.50 31.23 1ptj n PRO 77 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1ptj s MET 78 N -2.60 4.02 0.88 -0.52 -1.94 -1.26 -4.86 119.30 113.02 1ptj s MET 78 Ca 0.65 1.22 -0.11 0.00 -1.71 0.00 0.00 55.69 55.74 1ptj s MET 78 Cb -0.44 -3.80 0.12 0.00 2.01 0.00 0.00 34.83 32.73 1ptj s MET 78 CO 0.54 -0.97 1.15 0.95 -0.01 0.00 0.00 175.02 176.69 1ptj s THR 79 N 3.94 2.20 0.37 2.05 -4.23 -1.26 -2.04 115.64 116.67 1ptj s THR 79 Ca 0.51 0.07 0.17 0.00 -1.18 0.00 0.00 61.69 61.26 1ptj s THR 79 Cb -0.15 -2.21 0.37 0.00 1.34 0.00 0.00 72.50 71.85 1ptj s THR 79 CO 0.18 -0.08 1.70 0.00 -0.54 0.00 0.00 174.62 175.89 1ptj h ALA 80 N -1.60 2.14 0.00 3.99 0.00 -1.93 0.38 119.26 122.25 1ptj h ALA 80 Ca -0.44 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ptj h ALA 80 Cb 1.27 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1ptj h ALA 80 CO 0.43 -0.67 -0.21 -0.85 0.00 0.00 0.00 179.25 177.96 1ptj n GLU 81 N -4.82 0.08 0.06 0.00 -0.00 -1.26 -3.59 120.64 111.11 1ptj n GLU 81 Ca 0.30 0.05 0.12 0.00 -0.00 0.00 0.00 57.16 57.62 1ptj n GLU 81 Cb 0.98 -1.57 0.46 0.00 -0.00 0.00 0.00 31.44 31.31 1ptj n GLU 81 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1ptj n GLU 82 N -1.70 0.13 0.00 3.44 1.02 0.13 -4.87 120.64 118.79 1ptj n GLU 82 Ca 0.06 0.21 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 1ptj n GLU 82 Cb 0.37 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 30.11 1ptj n GLU 82 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ptj n GLY 83 N 0.81 0.50 0.00 0.62 0.00 -1.24 -4.96 105.19 100.93 1ptj n GLY 83 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1ptj n GLY 83 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1ptj n THR 84 N 0.00 0.00 -1.87 2.61 5.66 -1.25 -5.11 114.28 114.32 1ptj n THR 84 Ca 0.00 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.62 1ptj n THR 84 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 1ptj n THR 84 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1ptj s ASP 85 N 0.00 5.04 -0.16 1.09 -1.08 -1.26 -4.48 116.67 115.82 1ptj s ASP 85 Ca 0.00 0.67 -0.01 0.00 -0.52 0.00 0.00 52.55 52.69 1ptj s ASP 85 Cb 0.00 -2.52 -0.23 0.00 -1.46 0.00 0.00 42.92 38.71 1ptj s ASP 85 CO 0.00 -2.49 0.19 -0.62 0.52 0.00 0.00 175.17 172.77 1ptj n GLU 86 N 9.08 0.71 0.31 4.34 1.02 -0.86 -3.81 120.64 131.42 1ptj n GLU 86 Ca 0.26 0.21 0.19 0.00 -0.02 0.00 0.00 57.16 57.81 1ptj n GLU 86 Cb 0.53 -1.65 1.03 0.00 -0.02 0.00 0.00 31.44 31.33 1ptj n GLU 86 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1ptj h VAL 87 N 0.04 0.16 0.00 2.62 2.07 -1.86 0.40 116.25 119.67 1ptj h VAL 87 Ca -0.47 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.05 1ptj h VAL 87 Cb 2.00 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 32.68 1ptj h VAL 87 CO 0.03 0.00 -0.01 0.00 0.02 0.00 0.00 177.57 177.61 1ptj h ALA 88 N 1.82 0.99 0.00 1.67 0.00 -1.91 -3.33 119.26 118.50 1ptj h ALA 88 Ca 0.02 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1ptj h ALA 88 Cb 0.22 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1ptj h ALA 88 CO -0.00 0.00 -0.56 -0.07 0.00 0.00 0.00 179.25 178.62 1ptj h LEU 89 N 0.00 0.00 -8.25 0.00 3.38 -0.34 -3.46 115.31 106.65 1ptj h LEU 89 Ca 0.00 -0.27 -0.80 0.00 0.09 0.00 0.00 57.88 56.90 1ptj h LEU 89 Cb 0.78 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.51 1ptj h LEU 89 CO 0.00 0.95 1.06 -0.38 0.09 0.00 0.00 178.44 180.16 1ptj n ILE 90 N -4.59 0.00 -1.59 1.22 5.41 -1.11 -4.62 119.36 114.08 1ptj n ILE 90 Ca -0.13 0.00 -0.43 0.00 1.00 0.00 0.00 62.75 63.18 1ptj n ILE 90 Cb 0.36 -0.49 -0.01 0.00 -0.71 0.00 0.00 39.64 38.79 1ptj n ILE 90 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1ptj n LYS 91 N 6.06 1.31 -1.69 0.38 4.81 -1.24 -4.89 118.16 122.91 1ptj n LYS 91 Ca 0.45 0.46 -0.38 0.00 -0.87 0.00 0.00 58.31 57.97 1ptj n LYS 91 Cb -0.05 -1.88 0.05 0.00 0.02 0.00 0.00 35.03 33.17 1ptj n LYS 91 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1ptj n GLU 92 N 0.56 1.33 0.00 1.64 2.13 -1.26 -3.13 120.64 121.92 1ptj n GLU 92 Ca 0.10 0.50 0.00 0.00 0.66 0.00 0.00 57.16 58.41 1ptj n GLU 92 Cb 0.34 -2.38 0.00 0.00 0.27 0.00 0.00 31.44 29.67 1ptj n GLU 92 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ptj n GLY 93 N 0.99 2.34 3.86 8.31 0.00 0.71 -4.99 105.19 116.41 1ptj n GLY 93 Ca 0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.84 1ptj n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ptj s ALA 94 N -2.36 1.89 -0.07 4.61 0.00 -1.18 -4.69 121.76 119.96 1ptj s ALA 94 Ca 0.00 -1.18 0.01 0.00 0.00 0.00 0.00 51.96 50.80 1ptj s ALA 94 Cb 0.00 -2.79 -0.03 0.00 0.00 0.00 0.00 23.12 20.30 1ptj s ALA 94 CO 0.00 -2.70 -0.08 0.14 0.00 0.00 0.00 175.76 173.12 1ptj s VAL 95 N -3.73 3.58 0.03 0.00 -7.23 -1.02 -2.07 120.40 109.96 1ptj s VAL 95 Ca 0.74 -0.53 0.08 0.00 -1.81 0.00 0.00 61.98 60.47 1ptj s VAL 95 Cb -0.05 -2.45 -0.03 0.00 0.56 0.00 0.00 36.38 34.41 1ptj s VAL 95 CO 0.54 0.60 -0.24 -0.22 -0.31 0.00 0.00 175.10 175.46 1ptj s LEU 96 N -0.76 2.28 -0.02 1.32 1.98 0.15 0.89 118.68 124.51 1ptj s LEU 96 Ca 0.12 -0.53 -0.00 0.00 -2.89 0.00 0.00 54.13 50.83 1ptj s LEU 96 Cb -0.11 -1.35 0.03 0.00 0.66 0.00 0.00 46.19 45.42 1ptj s LEU 96 CO 0.01 0.27 0.03 -0.04 -1.89 0.00 0.00 176.35 174.73 1ptj s MET 97 N -1.19 0.02 0.00 1.98 -1.94 -0.70 0.83 119.30 118.30 1ptj s MET 97 Ca 0.12 0.18 0.00 0.00 -1.71 0.00 0.00 55.69 54.28 1ptj s MET 97 Cb -0.10 -0.31 0.00 0.00 2.01 0.00 0.00 34.83 36.43 1ptj s MET 97 CO 0.02 -0.17 0.00 0.00 -0.01 0.00 0.00 175.02 174.86 1ptj n HIS 99 N 0.23 2.64 -0.18 0.00 -0.00 -0.24 -1.78 115.22 115.89 1ptj n HIS 99 Ca 0.00 -2.94 0.19 0.00 -0.00 0.00 0.00 57.72 54.97 1ptj n HIS 99 Cb 0.00 -2.16 0.55 0.00 -0.00 0.00 0.00 29.99 28.38 1ptj n HIS 99 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 1ptj h LEU 100 N 6.71 0.32 -0.31 0.27 5.85 -1.86 -3.14 115.31 123.15 1ptj h LEU 100 Ca 0.73 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 59.42 1ptj h LEU 100 Cb 0.35 -0.04 0.01 0.00 0.37 0.00 0.00 40.66 41.36 1ptj h LEU 100 CO 1.65 0.14 -0.09 0.61 -0.34 0.00 0.00 178.44 180.42 1ptj n GLY 101 N -1.55 0.51 0.00 3.75 0.00 -1.26 -4.53 105.19 102.11 1ptj n GLY 101 Ca 0.16 -0.65 0.00 0.00 0.00 0.00 0.00 46.02 45.53 1ptj n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ptj n ALA 102 N -2.05 0.00 0.00 4.61 0.00 -1.26 -2.87 120.51 118.94 1ptj n ALA 102 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1ptj n ALA 102 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1ptj n ALA 102 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ptj n LEU 103 N 0.00 0.00 -0.12 0.00 4.32 -1.26 0.13 117.00 120.08 1ptj n LEU 103 Ca 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 56.01 56.14 1ptj n LEU 103 Cb 0.00 0.00 0.68 0.00 -1.62 0.00 0.00 43.42 42.48 1ptj n LEU 103 CO 0.00 0.00 0.93 0.35 -1.22 0.00 0.00 177.39 177.45 1ptj n THR 104 N -2.55 0.00 -3.34 -5.08 -2.24 -1.14 -4.30 114.28 95.63 1ptj n THR 104 Ca 0.00 -0.06 -0.26 0.00 -2.27 0.00 0.00 64.05 61.46 1ptj n THR 104 Cb 0.00 -0.16 -0.07 0.00 -2.10 0.00 0.00 70.33 68.00 1ptj n THR 104 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1ptj n ASN 105 N -0.89 3.24 -0.29 3.42 3.02 0.35 -4.93 115.26 119.18 1ptj n ASN 105 Ca 0.17 -3.35 -0.05 0.00 -0.03 0.00 0.00 54.58 51.32 1ptj n ASN 105 Cb 0.25 -0.66 0.07 0.00 -0.61 0.00 0.00 39.78 38.83 1ptj n ASN 105 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1ptj h ARG 106 N 4.03 1.15 0.66 3.52 1.12 -1.75 -3.28 114.38 119.83 1ptj h ARG 106 Ca 0.17 -0.17 -0.03 0.00 -1.11 0.00 0.00 59.98 58.84 1ptj h ARG 106 Cb 0.69 -0.21 0.01 0.00 -0.01 0.00 0.00 29.97 30.44 1ptj h ARG 106 CO 0.78 0.88 -0.32 -1.00 -3.11 0.00 0.00 179.97 177.20 1ptj h PRO 107 N 1.13 -0.86 -0.77 0.20 0.13 -1.94 -2.86 132.00 127.02 1ptj h PRO 107 Ca 0.27 0.06 0.22 0.00 -0.87 0.00 0.00 66.00 65.69 1ptj h PRO 107 Cb 0.11 0.19 -0.03 0.00 0.13 0.00 0.00 31.00 31.40 1ptj h PRO 107 CO -0.04 -0.55 0.71 -0.24 -0.23 0.00 0.00 178.00 177.65 1ptj h VAL 108 N -0.96 0.33 -0.15 1.56 3.04 -1.95 0.38 116.25 118.50 1ptj h VAL 108 Ca -0.09 0.00 -0.13 0.00 -1.01 0.00 0.00 66.70 65.47 1ptj h VAL 108 Cb 0.70 0.46 -0.01 0.00 -2.01 0.00 0.00 31.29 30.43 1ptj h VAL 108 CO 0.15 0.00 -0.45 0.58 -1.01 0.00 0.00 177.57 176.84 1ptj h VAL 109 N 0.00 1.32 0.10 1.51 2.07 -1.56 -2.90 116.25 116.78 1ptj h VAL 109 Ca 0.37 -1.63 -0.29 0.00 0.82 0.00 0.00 66.70 65.96 1ptj h VAL 109 Cb 1.78 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 33.24 1ptj h VAL 109 CO -0.00 0.50 -1.48 1.05 0.02 0.00 0.00 177.57 177.66 1ptj h GLU 110 N 0.30 0.21 -0.57 1.57 4.11 -0.24 -2.44 114.58 117.52 1ptj h GLU 110 Ca 0.02 -0.35 0.03 0.00 0.07 0.00 0.00 59.36 59.13 1ptj h GLU 110 Cb 0.91 0.13 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 1ptj h GLU 110 CO 0.08 1.06 0.38 0.00 0.07 0.00 0.00 179.01 180.59 1ptj h ALA 111 N 0.59 1.70 0.07 1.06 0.00 -1.38 0.33 119.26 121.62 1ptj h ALA 111 Ca -0.22 -0.03 -0.26 0.00 0.00 0.00 0.00 54.91 54.41 1ptj h ALA 111 Cb 1.99 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 19.60 1ptj h ALA 111 CO 0.15 0.24 -1.11 -0.07 0.00 0.00 0.00 179.25 178.47 1ptj h LEU 112 N 0.67 0.57 -1.78 0.00 3.38 -1.58 -2.77 115.31 113.79 1ptj h LEU 112 Ca 0.23 -0.52 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 1ptj h LEU 112 Cb 0.07 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1ptj h LEU 112 CO -0.06 1.35 -0.13 0.74 0.09 0.00 0.00 178.44 180.43 1ptj h THR 113 N 0.19 0.50 0.00 0.22 2.02 -0.50 0.32 112.91 115.67 1ptj h THR 113 Ca -0.12 -0.62 -0.25 0.00 0.77 0.00 0.00 66.41 66.19 1ptj h THR 113 Cb 1.78 1.42 -0.04 0.00 -1.74 0.00 0.00 68.15 69.57 1ptj h THR 113 CO 0.19 0.13 -1.35 0.11 0.37 0.00 0.00 175.52 174.96 1ptj h LYS 114 N 0.00 0.00 -0.60 6.66 6.56 -0.39 -3.25 116.57 125.54 1ptj h LYS 114 Ca -0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1ptj h LYS 114 Cb 0.41 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.07 1ptj h LYS 114 CO 0.02 0.71 0.00 0.54 -2.06 0.00 0.00 179.45 178.66 1ptj n ARG 115 N -3.18 1.88 -3.84 3.15 5.12 -1.01 -4.87 116.66 113.90 1ptj n ARG 115 Ca -0.09 -0.86 -0.25 0.00 -1.93 0.00 0.00 57.85 54.72 1ptj n ARG 115 Cb 0.99 -1.49 0.01 0.00 -1.16 0.00 0.00 32.46 30.81 1ptj n ARG 115 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1ptj n LYS 116 N 0.16 -4.36 -4.53 5.56 4.76 -1.13 -3.25 118.16 115.36 1ptj n LYS 116 Ca 0.08 0.53 -0.33 0.00 -2.87 0.00 0.00 58.31 55.72 1ptj n LYS 116 Cb 0.38 -5.00 -0.13 0.00 -1.84 0.00 0.00 35.03 28.45 1ptj n LYS 116 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1ptj s ILE 117 N -3.70 3.62 -0.33 -0.18 1.01 0.07 -0.21 121.20 121.48 1ptj s ILE 117 Ca 0.13 -0.46 -0.18 0.00 0.00 0.00 0.00 60.65 60.14 1ptj s ILE 117 Cb -0.06 -2.56 -0.01 0.00 0.01 0.00 0.00 42.46 39.83 1ptj s ILE 117 CO 0.85 0.51 0.51 -0.89 0.00 0.00 0.00 174.94 175.91 1ptj s THR 118 N 0.28 5.03 0.00 2.92 2.01 -0.88 -4.16 115.64 120.84 1ptj s THR 118 Ca -0.05 0.43 0.08 0.00 0.31 0.00 0.00 61.69 62.45 1ptj s THR 118 Cb -0.15 -3.94 -0.02 0.00 0.01 0.00 0.00 72.50 68.41 1ptj s THR 118 CO 0.04 -0.16 -0.25 0.00 -0.69 0.00 0.00 174.62 173.55 1ptj s ALA 119 N 2.37 2.24 -0.20 7.40 0.00 -0.69 0.33 121.76 133.21 1ptj s ALA 119 Ca 0.19 -1.16 -0.02 0.00 0.00 0.00 0.00 51.96 50.97 1ptj s ALA 119 Cb -0.15 -0.56 0.00 0.00 0.00 0.00 0.00 23.12 22.41 1ptj s ALA 119 CO 0.13 0.53 -0.11 0.71 0.00 0.00 0.00 175.76 177.02 1ptj s TYR 120 N -0.69 2.88 -0.79 0.00 1.51 0.24 -2.86 117.35 117.64 1ptj s TYR 120 Ca 0.11 -1.18 -0.20 0.00 -1.01 0.00 0.00 57.07 54.79 1ptj s TYR 120 Cb -0.10 -2.02 0.10 0.00 -0.11 0.00 0.00 41.96 39.83 1ptj s TYR 120 CO 0.00 -0.62 1.02 0.00 -1.11 0.00 0.00 175.55 174.85 1ptj s ALA 121 N 1.33 3.26 0.45 3.71 0.00 -1.04 -1.97 121.76 127.49 1ptj s ALA 121 Ca 0.04 -2.34 0.31 0.00 0.00 0.00 0.00 51.96 49.98 1ptj s ALA 121 Cb -0.14 -3.93 1.71 0.00 0.00 0.00 0.00 23.12 20.77 1ptj s ALA 121 CO -0.06 -2.84 1.95 0.52 0.00 0.00 0.00 175.76 175.33 1ptj h MET 122 N 9.17 0.00 -0.01 0.00 2.86 -1.67 -1.72 114.93 123.57 1ptj h MET 122 Ca -0.07 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 1ptj h MET 122 Cb 1.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.71 1ptj h MET 122 CO 1.14 0.00 -0.01 -0.85 1.06 0.00 0.00 176.91 178.25 1ptj n GLU 123 N -2.74 1.20 -0.18 1.72 0.00 -1.26 -3.21 120.64 116.17 1ptj n GLU 123 Ca -0.02 -0.35 0.10 0.00 0.00 0.00 0.00 57.16 56.89 1ptj n GLU 123 Cb 0.21 -1.49 0.19 0.00 0.00 0.00 0.00 31.44 30.35 1ptj n GLU 123 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1ptj n LEU 124 N -0.59 3.19 -4.61 -1.84 4.77 -0.65 -4.98 117.00 112.29 1ptj n LEU 124 Ca 0.22 -1.60 -0.51 0.00 -0.03 0.00 0.00 56.01 54.09 1ptj n LEU 124 Cb 0.21 -0.24 -0.05 0.00 -2.33 0.00 0.00 43.42 41.00 1ptj n LEU 124 CO 0.18 0.72 0.98 0.80 -1.33 0.00 0.00 177.39 178.74 1ptj n MET 125 N 1.17 1.41 -1.53 3.23 1.56 -1.20 -4.61 117.12 117.16 1ptj n MET 125 Ca 0.16 0.51 -0.36 0.00 -0.27 0.00 0.00 57.70 57.74 1ptj n MET 125 Cb 0.52 -2.18 0.08 0.00 2.15 0.00 0.00 33.22 33.79 1ptj n MET 125 CO 0.00 0.00 0.00 -0.35 -0.73 0.00 0.00 175.97 174.89 1ptj n PRO 126 N 2.77 0.79 -0.71 2.12 -0.04 -1.26 -4.87 135.00 133.80 1ptj n PRO 126 Ca 0.18 0.33 -0.08 0.00 -0.04 0.00 0.00 63.50 63.89 1ptj n PRO 126 Cb 0.22 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.27 1ptj n PRO 126 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ptj n ARG 127 N -2.03 1.41 -3.17 0.54 1.74 -1.26 -4.84 116.66 109.04 1ptj n ARG 127 Ca 0.15 -0.72 -0.36 0.00 -0.77 0.00 0.00 57.85 56.14 1ptj n ARG 127 Cb 0.49 -1.33 -0.06 0.00 -1.02 0.00 0.00 32.46 30.53 1ptj n ARG 127 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1ptj s ILE 128 N -0.86 4.65 0.21 0.55 -4.36 -1.26 -4.97 121.20 115.17 1ptj s ILE 128 Ca 0.18 1.16 0.33 0.00 -0.26 0.00 0.00 60.65 62.06 1ptj s ILE 128 Cb 0.12 -3.83 0.33 0.00 1.25 0.00 0.00 42.46 40.34 1ptj s ILE 128 CO -0.01 0.22 2.02 -1.28 0.24 0.00 0.00 174.94 176.13 1ptj h SER 129 N 3.48 0.00 -0.03 4.36 0.87 -2.01 -1.72 113.55 118.50 1ptj h SER 129 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 1ptj h SER 129 Cb 1.19 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.15 1ptj h SER 129 CO 0.65 0.00 0.00 -2.11 -0.53 0.00 0.00 176.83 174.84 1ptj n ARG 130 N -2.68 1.82 -0.05 2.24 1.85 -1.26 -3.90 116.66 114.69 1ptj n ARG 130 Ca -0.02 -1.19 0.07 0.00 -1.00 0.00 0.00 57.85 55.71 1ptj n ARG 130 Cb 0.07 -1.47 0.09 0.00 -1.05 0.00 0.00 32.46 30.09 1ptj n ARG 130 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1ptj n ALA 131 N 0.45 2.42 -0.25 2.89 0.00 -0.65 -4.53 120.51 120.85 1ptj n ALA 131 Ca 0.18 -0.74 0.15 0.00 0.00 0.00 0.00 53.44 53.03 1ptj n ALA 131 Cb 0.41 -0.49 0.44 0.00 0.00 0.00 0.00 19.45 19.81 1ptj n ALA 131 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1ptj h GLN 132 N 2.69 0.54 0.00 0.00 4.20 -1.68 0.38 115.11 121.24 1ptj h GLN 132 Ca 0.00 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1ptj h GLN 132 Cb 0.63 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.29 1ptj h GLN 132 CO 0.00 0.35 0.00 -1.13 -0.67 0.00 0.00 178.83 177.38 1ptj n SER 133 N -4.54 0.00 0.00 1.46 3.41 -1.26 -2.73 113.62 109.95 1ptj n SER 133 Ca 0.18 0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 1ptj n SER 133 Cb 0.56 -0.30 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1ptj n SER 133 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 175.04 176.03 1ptj n MET 134 N -1.30 1.99 -2.79 4.33 0.00 0.13 -4.28 117.12 115.20 1ptj n MET 134 Ca 0.08 -1.18 -0.43 0.00 0.00 0.00 0.00 57.70 56.17 1ptj n MET 134 Cb 0.14 -0.88 -0.04 0.00 0.00 0.00 0.00 33.22 32.45 1ptj n MET 134 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1ptj s ASP 135 N -0.69 6.49 0.32 3.17 -1.08 -0.77 -4.76 116.67 119.36 1ptj s ASP 135 Ca 0.00 0.08 0.17 0.00 -0.52 0.00 0.00 52.55 52.28 1ptj s ASP 135 Cb 0.00 -2.46 0.23 0.00 -1.46 0.00 0.00 42.92 39.23 1ptj s ASP 135 CO 0.00 -1.12 1.52 0.16 0.52 0.00 0.00 175.17 176.25 1ptj h ILE 136 N 6.09 0.75 -0.40 4.11 3.07 -1.91 -2.91 117.51 126.32 1ptj h ILE 136 Ca -0.24 -1.93 -0.01 0.00 1.55 0.00 0.00 64.86 64.23 1ptj h ILE 136 Cb 1.07 2.28 -0.02 0.00 -0.27 0.00 0.00 36.82 39.88 1ptj h ILE 136 CO 1.05 0.41 0.22 -0.07 -1.05 0.00 0.00 178.15 178.71 1ptj h LEU 137 N 0.00 0.49 0.36 0.16 3.38 -1.91 -2.46 115.31 115.33 1ptj h LEU 137 Ca -0.00 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 1ptj h LEU 137 Cb 1.24 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1ptj h LEU 137 CO 0.05 0.43 -0.17 0.28 0.09 0.00 0.00 178.44 179.12 1ptj h SER 138 N 0.51 -0.41 -0.21 -0.43 0.02 -1.95 0.38 113.55 111.47 1ptj h SER 138 Ca 0.14 -0.11 0.06 0.00 -0.84 0.00 0.00 61.79 61.04 1ptj h SER 138 Cb 0.05 0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.68 1ptj h SER 138 CO -0.02 -0.12 0.18 0.77 -1.14 0.00 0.00 176.83 176.50 1ptj h SER 139 N -0.70 0.00 0.16 3.07 4.64 -1.53 -0.69 113.55 118.49 1ptj h SER 139 Ca -0.05 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.91 1ptj h SER 139 Cb 0.49 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 1ptj h SER 139 CO 0.08 0.00 -1.98 0.00 -0.87 0.00 0.00 176.83 174.06 1ptj n GLN 140 N -4.10 0.75 -0.03 4.77 1.13 -0.93 -3.82 117.38 115.14 1ptj n GLN 140 Ca 0.02 0.26 -0.08 0.00 -1.94 0.00 0.00 57.00 55.26 1ptj n GLN 140 Cb 0.32 -1.72 -0.02 0.00 0.11 0.00 0.00 30.24 28.93 1ptj n GLN 140 CO 0.00 0.00 0.00 0.77 -1.44 0.00 0.00 177.06 176.39 1ptj h SER 141 N 0.07 -0.34 -0.62 1.08 0.02 0.37 -0.25 113.55 113.88 1ptj h SER 141 Ca -0.41 0.08 0.13 0.00 -0.84 0.00 0.00 61.79 60.75 1ptj h SER 141 Cb 2.03 0.18 -0.11 0.00 0.14 0.00 0.00 62.40 64.65 1ptj h SER 141 CO 0.09 -0.13 -0.03 -1.13 -1.14 0.00 0.00 176.83 174.48 1ptj h ASN 142 N -0.09 -0.35 0.22 3.07 -1.24 -1.31 0.19 115.58 116.07 1ptj h ASN 142 Ca 0.11 0.16 -0.11 0.00 0.71 0.00 0.00 56.30 57.17 1ptj h ASN 142 Cb 0.25 0.30 -0.01 0.00 0.73 0.00 0.00 38.32 39.58 1ptj h ASN 142 CO -0.24 -0.14 -0.41 -0.07 -1.29 0.00 0.00 177.43 175.28 1ptj h LEU 143 N 0.09 0.26 -1.10 0.34 3.38 -1.53 -2.85 115.31 113.90 1ptj h LEU 143 Ca 0.32 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 1ptj h LEU 143 Cb 0.52 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.17 1ptj h LEU 143 CO -0.56 0.65 0.14 0.00 0.09 0.00 0.00 178.44 178.76 1ptj h ALA 144 N 1.37 1.28 -0.26 1.53 0.00 0.11 -0.33 119.26 122.95 1ptj h ALA 144 Ca 0.02 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.64 1ptj h ALA 144 Cb 0.81 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1ptj h ALA 144 CO 0.06 0.51 -0.28 0.78 0.00 0.00 0.00 179.25 180.32 1ptj h GLY 145 N 0.93 0.58 0.64 0.00 0.00 -0.83 -1.34 103.07 103.04 1ptj h GLY 145 Ca 0.17 -0.50 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 1ptj h GLY 145 CO -0.00 0.45 -0.26 -1.82 0.00 0.00 0.00 176.54 174.91 1ptj h TYR 146 N 0.46 -0.67 -0.16 5.60 3.20 -1.29 -3.13 116.97 120.97 1ptj h TYR 146 Ca 0.06 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.96 1ptj h TYR 146 Cb 0.73 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.22 1ptj h TYR 146 CO 0.03 -0.36 0.28 -0.09 -1.64 0.00 0.00 178.16 176.38 1ptj h ARG 147 N -1.10 0.00 -0.08 1.82 9.65 -1.03 -1.93 114.38 121.70 1ptj h ARG 147 Ca -0.07 0.00 -0.01 0.00 -1.10 0.00 0.00 59.98 58.79 1ptj h ARG 147 Cb 0.61 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.19 1ptj h ARG 147 CO 0.12 0.00 0.00 0.00 2.80 0.00 0.00 179.97 182.89 1ptj h ALA 148 N 1.59 0.11 -0.78 2.80 0.00 -1.18 0.22 119.26 122.02 1ptj h ALA 148 Ca 0.08 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1ptj h ALA 148 Cb 0.64 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1ptj h ALA 148 CO -0.00 -0.21 0.36 0.28 0.00 0.00 0.00 179.25 179.68 1ptj h VAL 149 N -0.13 1.25 0.52 0.00 2.07 -1.39 0.55 116.25 119.12 1ptj h VAL 149 Ca 0.02 -0.72 -0.03 0.00 0.82 0.00 0.00 66.70 66.80 1ptj h VAL 149 Cb 0.34 0.27 0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1ptj h VAL 149 CO 0.00 0.30 -0.25 0.40 0.02 0.00 0.00 177.57 178.05 1ptj h ILE 150 N 1.11 0.48 -0.47 4.57 1.08 -1.29 0.19 117.51 123.19 1ptj h ILE 150 Ca 0.27 -0.11 0.04 0.00 -0.39 0.00 0.00 64.86 64.66 1ptj h ILE 150 Cb 0.14 0.53 -0.03 0.00 -3.07 0.00 0.00 36.82 34.39 1ptj h ILE 150 CO -0.03 0.02 0.31 0.44 -0.69 0.00 0.00 178.15 178.20 1ptj h ASP 151 N -0.77 0.43 -0.19 1.72 3.32 -0.25 0.31 116.42 120.99 1ptj h ASP 151 Ca -0.07 -0.00 -0.05 0.00 0.02 0.00 0.00 57.03 56.92 1ptj h ASP 151 Cb 0.57 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 40.01 1ptj h ASP 151 CO 0.12 0.29 -0.09 1.23 -1.72 0.00 0.00 179.24 179.07 1ptj h GLY 152 N 0.49 0.43 1.64 2.75 0.00 0.53 -2.16 103.07 106.77 1ptj h GLY 152 Ca 0.19 -0.39 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 1ptj h GLY 152 CO -0.05 0.35 0.19 0.00 0.00 0.00 0.00 176.54 177.03 1ptj h ALA 153 N 0.70 1.67 0.01 3.60 0.00 0.20 -0.54 119.26 124.90 1ptj h ALA 153 Ca 0.04 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1ptj h ALA 153 Cb 0.56 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ptj h ALA 153 CO 0.03 0.28 -0.00 -0.92 0.00 0.00 0.00 179.25 178.63 1ptj h TYR 154 N 0.49 -0.01 0.00 0.00 3.20 -0.69 -3.17 116.97 116.80 1ptj h TYR 154 Ca 0.13 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.96 1ptj h TYR 154 Cb 0.02 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 1ptj h TYR 154 CO 0.00 0.31 -0.15 0.93 -1.64 0.00 0.00 178.16 177.61 1ptj h GLU 155 N -0.33 0.00 -6.64 1.82 4.39 -1.18 -3.44 114.58 109.20 1ptj h GLU 155 Ca -0.00 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.18 1ptj h GLU 155 Cb 0.32 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 28.98 1ptj h GLU 155 CO 0.00 0.15 0.50 0.12 -1.16 0.00 0.00 179.01 178.62 1ptj s PHE 156 N -3.53 3.55 -2.34 4.33 5.36 -0.23 -4.95 117.98 120.17 1ptj s PHE 156 Ca 0.02 1.55 0.24 0.00 -0.96 0.00 0.00 56.93 57.77 1ptj s PHE 156 Cb 0.09 -3.31 0.91 0.00 -0.34 0.00 0.00 43.02 40.36 1ptj s PHE 156 CO 0.63 -0.76 1.65 0.00 -1.46 0.00 0.00 175.22 175.27 1ptj n ALA 157 N 2.53 2.55 -2.48 11.12 0.00 -1.26 -4.88 120.51 128.09 1ptj n ALA 157 Ca 0.03 -0.47 -0.24 0.00 0.00 0.00 0.00 53.44 52.76 1ptj n ALA 157 Cb 0.46 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.70 1ptj n ALA 157 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ptj s ARG 158 N -1.88 2.22 0.37 0.00 0.52 -1.26 -5.12 118.95 113.79 1ptj s ARG 158 Ca 0.35 -1.76 -0.11 0.00 -0.52 0.00 0.00 55.73 53.69 1ptj s ARG 158 Cb 0.19 -2.01 -0.07 0.00 0.52 0.00 0.00 34.95 33.58 1ptj s ARG 158 CO 0.29 -0.01 0.73 0.00 0.02 0.00 0.00 175.30 176.34 1ptj s ALA 159 N -2.54 3.37 -0.06 2.13 0.00 -1.26 -5.03 121.76 118.36 1ptj s ALA 159 Ca 0.39 -0.18 -0.26 0.00 0.00 0.00 0.00 51.96 51.91 1ptj s ALA 159 Cb 0.02 -2.67 -0.23 0.00 0.00 0.00 0.00 23.12 20.23 1ptj s ALA 159 CO 0.22 0.11 1.04 0.74 0.00 0.00 0.00 175.76 177.88 1ptj h PHE 160 N 1.58 0.11 -3.99 0.00 -1.00 -1.92 -3.37 116.94 108.36 1ptj h PHE 160 Ca -0.47 -0.05 -0.48 0.00 2.81 0.00 0.00 57.97 59.77 1ptj h PHE 160 Cb 1.18 -0.01 0.01 0.00 3.61 0.00 0.00 35.95 40.74 1ptj h PHE 160 CO 0.61 0.80 0.27 -1.25 -1.61 0.00 0.00 178.31 177.13 1ptj s PRO 161 N -3.28 3.86 0.32 1.51 0.04 -0.80 -0.42 135.00 136.23 1ptj s PRO 161 Ca -0.17 0.73 -0.27 0.00 0.04 0.00 0.00 61.00 61.33 1ptj s PRO 161 Cb 0.00 -2.24 -0.09 0.00 0.04 0.00 0.00 34.50 32.21 1ptj s PRO 161 CO 0.71 -0.19 1.02 1.41 0.04 0.00 0.00 177.00 179.99 1ptj s MET 162 N -4.04 4.53 -0.17 4.56 -2.45 -1.26 -4.54 119.30 115.94 1ptj s MET 162 Ca 0.55 1.57 -0.05 0.00 -1.25 0.00 0.00 55.69 56.51 1ptj s MET 162 Cb -0.10 -2.94 0.08 0.00 1.25 0.00 0.00 34.83 33.12 1ptj s MET 162 CO 0.33 0.18 0.29 -1.64 1.05 0.00 0.00 175.02 175.23 1ptj s MET 163 N -1.82 0.21 -0.28 4.11 -1.94 -0.59 -4.96 119.30 114.03 1ptj s MET 163 Ca 0.49 0.65 -0.23 0.00 -1.71 0.00 0.00 55.69 54.89 1ptj s MET 163 Cb -0.25 -0.29 -0.01 0.00 2.01 0.00 0.00 34.83 36.30 1ptj s MET 163 CO 0.32 -0.41 0.74 -1.64 -0.01 0.00 0.00 175.02 174.02 1ptj s MET 164 N 2.45 4.05 0.26 2.03 -1.94 -1.26 -1.98 119.30 122.91 1ptj s MET 164 Ca 0.04 0.63 0.09 0.00 -1.71 0.00 0.00 55.69 54.74 1ptj s MET 164 Cb -0.13 -3.69 -0.05 0.00 2.01 0.00 0.00 34.83 32.97 1ptj s MET 164 CO -0.11 -0.56 -0.13 0.95 -0.01 0.00 0.00 175.02 175.16 1ptj s THR 165 N 2.78 1.98 -0.27 2.05 -4.23 -0.81 -5.00 115.64 112.13 1ptj s THR 165 Ca 0.31 -2.24 0.22 0.00 -1.18 0.00 0.00 61.69 58.79 1ptj s THR 165 Cb -0.15 -2.31 0.22 0.00 1.34 0.00 0.00 72.50 71.60 1ptj s THR 165 CO 0.10 -0.41 1.66 0.00 -0.54 0.00 0.00 174.62 175.43 1ptj n ALA 166 N -0.56 1.17 -0.27 3.99 0.00 -1.26 -0.66 120.51 122.92 1ptj n ALA 166 Ca -0.06 0.17 0.08 0.00 0.00 0.00 0.00 53.44 53.63 1ptj n ALA 166 Cb 0.62 -1.33 0.22 0.00 0.00 0.00 0.00 19.45 18.96 1ptj n ALA 166 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ptj n ALA 167 N -1.77 2.28 0.00 0.00 0.00 -1.26 -5.06 120.51 114.70 1ptj n ALA 167 Ca -0.01 -1.23 0.00 0.00 0.00 0.00 0.00 53.44 52.20 1ptj n ALA 167 Cb 0.07 -0.64 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1ptj n ALA 167 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ptj n GLY 168 N 0.94 2.14 3.62 0.00 0.00 0.16 -5.04 105.19 107.02 1ptj n GLY 168 Ca 0.17 -2.17 -0.37 0.00 0.00 0.00 0.00 46.02 43.65 1ptj n GLY 168 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ptj s THR 169 N -1.80 5.25 -0.44 2.61 2.01 -1.26 -1.92 115.64 120.09 1ptj s THR 169 Ca 0.00 0.14 -0.20 0.00 0.31 0.00 0.00 61.69 61.94 1ptj s THR 169 Cb 0.00 -3.46 0.03 0.00 0.01 0.00 0.00 72.50 69.07 1ptj s THR 169 CO 0.00 0.32 0.64 0.54 -0.69 0.00 0.00 174.62 175.43 1ptj s VAL 170 N 1.28 4.84 0.80 3.82 0.11 -0.84 -4.99 120.40 125.43 1ptj s VAL 170 Ca 0.07 0.05 -0.12 0.00 -2.93 0.00 0.00 61.98 59.05 1ptj s VAL 170 Cb -0.14 -4.21 0.08 0.00 -1.53 0.00 0.00 36.38 30.58 1ptj s VAL 170 CO 0.06 -0.61 1.16 -2.16 -3.33 0.00 0.00 175.10 170.22 1ptj s PRO 171 N 2.79 1.78 0.37 1.54 0.04 -1.26 -1.55 135.00 138.72 1ptj s PRO 171 Ca 0.22 1.56 -0.25 0.00 0.04 0.00 0.00 61.00 62.57 1ptj s PRO 171 Cb -0.15 -1.81 -0.09 0.00 0.04 0.00 0.00 34.50 32.49 1ptj s PRO 171 CO 0.18 -2.07 1.01 -1.25 0.04 0.00 0.00 177.00 174.92 1ptj s PRO 172 N -4.36 4.31 0.62 0.56 0.04 -1.26 -4.46 135.00 130.45 1ptj s PRO 172 Ca 0.69 1.43 -0.18 0.00 0.04 0.00 0.00 61.00 62.98 1ptj s PRO 172 Cb -0.24 -2.61 -0.02 0.00 0.04 0.00 0.00 34.50 31.66 1ptj s PRO 172 CO 0.51 0.01 1.21 0.00 0.04 0.00 0.00 177.00 178.77 1ptj s ALA 173 N -1.67 2.47 -0.26 8.56 0.00 0.44 -4.80 121.76 126.50 1ptj s ALA 173 Ca 0.55 0.98 -0.03 0.00 0.00 0.00 0.00 51.96 53.46 1ptj s ALA 173 Cb -0.20 -3.45 0.03 0.00 0.00 0.00 0.00 23.12 19.49 1ptj s ALA 173 CO 0.26 -1.29 -0.03 1.03 0.00 0.00 0.00 175.76 175.73 1ptj s ARG 174 N -3.46 2.84 0.01 0.00 0.52 -1.26 -1.82 118.95 115.77 1ptj s ARG 174 Ca 0.77 -0.99 0.02 0.00 -0.52 0.00 0.00 55.73 55.00 1ptj s ARG 174 Cb -0.30 -3.09 -0.04 0.00 0.52 0.00 0.00 34.95 32.05 1ptj s ARG 174 CO 0.36 -0.44 0.01 0.08 0.02 0.00 0.00 175.30 175.33 1ptj s VAL 175 N 1.35 4.20 -0.07 3.52 1.01 -0.05 -0.85 120.40 129.51 1ptj s VAL 175 Ca -0.00 -0.62 0.00 0.00 0.00 0.00 0.00 61.98 61.36 1ptj s VAL 175 Cb -0.17 -2.89 0.02 0.00 0.00 0.00 0.00 36.38 33.34 1ptj s VAL 175 CO -0.03 0.35 -0.06 -0.22 0.00 0.00 0.00 175.10 175.14 1ptj s LEU 176 N -1.66 1.20 -0.20 3.92 0.20 -0.10 0.72 118.68 122.77 1ptj s LEU 176 Ca 0.21 -0.18 -0.00 0.00 0.69 0.00 0.00 54.13 54.84 1ptj s LEU 176 Cb -0.12 -0.59 0.02 0.00 -0.43 0.00 0.00 46.19 45.07 1ptj s LEU 176 CO 0.12 -0.08 -0.15 0.54 -0.29 0.00 0.00 176.35 176.48 1ptj s VAL 177 N 1.25 2.38 -0.42 1.68 0.11 0.24 -1.79 120.40 123.84 1ptj s VAL 177 Ca -0.05 -0.90 -0.22 0.00 -2.93 0.00 0.00 61.98 57.88 1ptj s VAL 177 Cb -0.14 -2.06 0.02 0.00 -1.53 0.00 0.00 36.38 32.67 1ptj s VAL 177 CO -0.02 0.46 0.72 -0.36 -3.33 0.00 0.00 175.10 172.57 1ptj s PHE 178 N 1.32 3.06 0.00 1.54 0.08 -0.40 -2.50 117.98 121.07 1ptj s PHE 178 Ca 0.04 0.21 0.00 0.00 0.12 0.00 0.00 56.93 57.30 1ptj s PHE 178 Cb -0.14 -3.45 0.00 0.00 -0.57 0.00 0.00 43.02 38.86 1ptj s PHE 178 CO -0.10 -0.85 0.00 0.41 -0.10 0.00 0.00 175.22 174.58 1ptj n GLY 179 N 4.87 0.45 2.69 4.36 0.00 -0.09 -0.93 105.19 116.55 1ptj n GLY 179 Ca 0.01 -0.83 -0.39 0.00 0.00 0.00 0.00 46.02 44.80 1ptj n GLY 179 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ptj n VAL 180 N 1.04 5.55 -0.65 1.61 0.31 -1.26 -4.08 118.33 120.86 1ptj n VAL 180 Ca 0.00 -5.80 0.00 0.00 -0.01 0.00 0.00 64.34 58.53 1ptj n VAL 180 Cb 0.00 -1.51 0.00 0.00 -0.91 0.00 0.00 33.84 31.42 1ptj n VAL 180 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ptj n GLY 181 N -0.12 1.66 0.44 2.92 0.00 -1.26 -4.56 105.19 104.26 1ptj n GLY 181 Ca 0.46 -1.78 -0.17 0.00 0.00 0.00 0.00 46.02 44.53 1ptj n GLY 181 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ptj h VAL 182 N 0.00 0.00 -0.95 1.61 2.07 -1.95 0.21 116.25 117.24 1ptj h VAL 182 Ca 0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.65 1ptj h VAL 182 Cb 0.00 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.69 1ptj h VAL 182 CO 0.00 0.00 0.60 0.00 0.02 0.00 0.00 177.57 178.19 1ptj h ALA 183 N -1.46 1.65 -0.14 1.67 0.00 -1.89 -2.42 119.26 116.67 1ptj h ALA 183 Ca -0.11 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.63 1ptj h ALA 183 Cb 0.85 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1ptj h ALA 183 CO 0.17 0.11 -0.68 0.78 0.00 0.00 0.00 179.25 179.64 1ptj h GLY 184 N 0.87 0.63 0.99 0.00 0.00 -1.66 -1.95 103.07 101.95 1ptj h GLY 184 Ca 0.47 -0.84 -0.04 0.00 0.00 0.00 0.00 47.33 46.93 1ptj h GLY 184 CO -0.23 0.75 0.21 1.41 0.00 0.00 0.00 176.54 178.67 1ptj h LEU 185 N 0.41 0.79 -0.78 3.11 3.38 -0.11 -1.24 115.31 120.87 1ptj h LEU 185 Ca -0.02 -0.18 -0.13 0.00 0.09 0.00 0.00 57.88 57.64 1ptj h LEU 185 Cb 1.26 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1ptj h LEU 185 CO 0.13 0.76 -0.50 -0.61 0.09 0.00 0.00 178.44 178.31 1ptj h GLN 186 N 0.78 0.27 -0.44 1.13 5.75 -1.49 -1.12 115.11 119.99 1ptj h GLN 186 Ca 0.19 -0.15 -0.06 0.00 -0.15 0.00 0.00 58.65 58.47 1ptj h GLN 186 Cb 0.23 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 28.77 1ptj h GLN 186 CO -0.01 0.71 0.01 0.00 -2.65 0.00 0.00 178.83 176.89 1ptj h ALA 187 N 1.26 1.20 -0.26 3.38 0.00 -1.00 -0.40 119.26 123.43 1ptj h ALA 187 Ca 0.01 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1ptj h ALA 187 Cb 0.96 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1ptj h ALA 187 CO 0.08 0.53 -0.14 0.82 0.00 0.00 0.00 179.25 180.53 1ptj h ILE 188 N 0.67 1.30 0.27 0.00 2.04 -0.68 -1.76 117.51 119.35 1ptj h ILE 188 Ca 0.14 -1.24 -0.01 0.00 1.00 0.00 0.00 64.86 64.74 1ptj h ILE 188 Cb 0.40 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 38.03 1ptj h ILE 188 CO 0.01 0.39 -0.13 0.00 0.00 0.00 0.00 178.15 178.42 1ptj h ALA 189 N 0.73 -0.37 -0.50 1.87 0.00 -0.79 0.74 119.26 120.94 1ptj h ALA 189 Ca 0.06 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1ptj h ALA 189 Cb 0.66 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1ptj h ALA 189 CO 0.04 -0.66 0.15 1.15 0.00 0.00 0.00 179.25 179.93 1ptj h THR 190 N -0.46 1.20 -0.50 0.00 2.02 -1.15 -1.43 112.91 112.60 1ptj h THR 190 Ca -0.04 -0.69 -0.10 0.00 0.77 0.00 0.00 66.41 66.36 1ptj h THR 190 Cb 0.35 0.66 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1ptj h THR 190 CO 0.06 0.26 -0.06 0.00 0.37 0.00 0.00 175.52 176.15 1ptj h ALA 191 N 1.45 0.68 0.00 6.16 0.00 -1.09 -2.57 119.26 123.89 1ptj h ALA 191 Ca 0.17 -0.32 -0.05 0.00 0.00 0.00 0.00 54.91 54.71 1ptj h ALA 191 Cb 0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1ptj h ALA 191 CO -0.01 0.55 -0.22 -0.22 0.00 0.00 0.00 179.25 179.35 1ptj h LYS 192 N 0.79 0.00 -0.18 0.00 3.11 -0.12 -2.71 116.57 117.46 1ptj h LYS 192 Ca 0.13 0.00 -0.02 0.00 -2.81 0.00 0.00 60.65 57.96 1ptj h LYS 192 Cb 0.61 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 31.83 1ptj h LYS 192 CO 0.04 0.22 0.05 0.00 -2.81 0.00 0.00 179.45 176.94 1ptj h ARG 193 N 0.00 0.28 0.00 1.90 3.08 -0.89 -2.65 114.38 116.11 1ptj h ARG 193 Ca -0.00 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1ptj h ARG 193 Cb 0.39 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1ptj h ARG 193 CO 0.03 0.42 0.00 1.28 -1.07 0.00 0.00 179.97 180.62 1ptj n LEU 194 N -4.80 0.00 0.00 3.04 4.77 -1.08 -4.86 117.00 114.07 1ptj n LEU 194 Ca -0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 1ptj n LEU 194 Cb 0.16 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.25 1ptj n LEU 194 CO 0.35 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 1ptj n GLY 195 N 0.14 0.67 3.86 -0.72 0.00 -1.00 -1.90 105.19 106.26 1ptj n GLY 195 Ca 0.11 -0.43 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 1ptj n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ptj s ALA 196 N -2.00 3.36 -0.11 4.61 0.00 -1.04 -4.24 121.76 122.34 1ptj s ALA 196 Ca 0.00 -0.10 -0.27 0.00 0.00 0.00 0.00 51.96 51.58 1ptj s ALA 196 Cb 0.00 -2.70 -0.02 0.00 0.00 0.00 0.00 23.12 20.40 1ptj s ALA 196 CO 0.00 0.20 0.90 0.08 0.00 0.00 0.00 175.76 176.94 1ptj s VAL 197 N -2.14 4.86 -0.09 0.00 1.01 -0.76 -4.50 120.40 118.79 1ptj s VAL 197 Ca 0.52 1.82 -0.01 0.00 0.00 0.00 0.00 61.98 64.31 1ptj s VAL 197 Cb -0.10 -4.21 -0.03 0.00 0.00 0.00 0.00 36.38 32.03 1ptj s VAL 197 CO 0.24 0.07 -0.04 -0.69 0.00 0.00 0.00 175.10 174.67 1ptj s VAL 198 N 1.77 3.90 0.00 2.92 1.01 -1.26 -0.88 120.40 127.86 1ptj s VAL 198 Ca 0.44 -0.40 0.08 0.00 0.00 0.00 0.00 61.98 62.10 1ptj s VAL 198 Cb -0.18 -2.62 -0.02 0.00 0.00 0.00 0.00 36.38 33.56 1ptj s VAL 198 CO 0.17 0.59 -0.24 -0.32 0.00 0.00 0.00 175.10 175.30 1ptj s MET 199 N -0.66 1.81 0.15 2.72 1.75 0.22 -2.42 119.30 122.88 1ptj s MET 199 Ca 0.10 -0.90 -0.11 0.00 -1.25 0.00 0.00 55.69 53.54 1ptj s MET 199 Cb -0.12 -1.82 0.00 0.00 2.84 0.00 0.00 34.83 35.74 1ptj s MET 199 CO 0.02 0.49 0.30 0.00 -0.65 0.00 0.00 175.02 175.18 1ptj s ALA 200 N -0.63 -0.25 -0.08 4.11 0.00 -1.03 0.79 121.76 124.67 1ptj s ALA 200 Ca 0.09 -0.67 -0.30 0.00 0.00 0.00 0.00 51.96 51.08 1ptj s ALA 200 Cb -0.09 0.76 0.07 0.00 0.00 0.00 0.00 23.12 23.86 1ptj s ALA 200 CO -0.00 -0.64 0.71 -0.08 0.00 0.00 0.00 175.76 175.75 1ptj s THR 201 N -3.92 0.00 0.10 0.00 -1.32 -1.04 -0.72 115.64 108.74 1ptj s THR 201 Ca 0.12 0.00 -0.20 0.00 -1.21 0.00 0.00 61.69 60.40 1ptj s THR 201 Cb 0.03 -1.00 0.05 0.00 -1.51 0.00 0.00 72.50 70.07 1ptj s THR 201 CO -0.04 0.00 0.49 -0.62 -2.21 0.00 0.00 174.62 172.24 1ptj s ASP 202 N -1.01 -0.39 -0.02 8.08 -1.08 -1.26 -0.91 116.67 120.07 1ptj s ASP 202 Ca -0.09 -0.04 -0.21 0.00 -0.52 0.00 0.00 52.55 51.69 1ptj s ASP 202 Cb -0.01 0.51 -0.26 0.00 -1.46 0.00 0.00 42.92 41.70 1ptj s ASP 202 CO 0.08 -0.82 1.01 -0.37 0.52 0.00 0.00 175.17 175.60 1ptj h VAL 203 N 2.47 1.48 -2.05 1.11 -1.51 -2.01 -3.43 116.25 112.32 1ptj h VAL 203 Ca -0.33 -2.22 -0.59 0.00 -1.23 0.00 0.00 66.70 62.33 1ptj h VAL 203 Cb 1.25 2.85 0.01 0.00 -2.13 0.00 0.00 31.29 33.27 1ptj h VAL 203 CO 0.43 0.63 1.25 0.54 -1.23 0.00 0.00 177.57 179.19 1ptj n ARG 204 N -4.24 2.28 0.25 5.19 1.74 -1.26 -4.85 116.66 115.78 1ptj n ARG 204 Ca -0.11 0.79 0.12 0.00 -0.77 0.00 0.00 57.85 57.87 1ptj n ARG 204 Cb 0.70 -2.87 0.68 0.00 -1.02 0.00 0.00 32.46 29.94 1ptj n ARG 204 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ptj h ALA 205 N 11.12 1.30 0.00 7.54 0.00 -2.04 -2.79 119.26 134.39 1ptj h ALA 205 Ca -0.46 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1ptj h ALA 205 Cb 1.26 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1ptj h ALA 205 CO 0.95 0.17 0.00 0.00 0.00 0.00 0.00 179.25 180.38 1ptj n ALA 206 N -2.30 2.05 -0.04 0.00 0.00 -1.26 -3.39 120.51 115.57 1ptj n ALA 206 Ca -0.02 -0.07 -0.00 0.00 0.00 0.00 0.00 53.44 53.35 1ptj n ALA 206 Cb 0.26 -1.19 -0.00 0.00 0.00 0.00 0.00 19.45 18.52 1ptj n ALA 206 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1ptj h THR 207 N 0.00 0.00 -0.36 0.00 2.02 -1.87 -3.38 112.91 109.32 1ptj h THR 207 Ca 0.00 -0.79 0.14 0.00 0.77 0.00 0.00 66.41 66.52 1ptj h THR 207 Cb 0.00 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 66.35 1ptj h THR 207 CO 0.00 0.00 0.15 1.17 0.37 0.00 0.00 175.52 177.21 1ptj n LYS 208 N -4.19 -0.02 0.37 6.66 4.81 -1.22 0.13 118.16 124.70 1ptj n LYS 208 Ca -0.01 0.50 -0.17 0.00 -0.87 0.00 0.00 58.31 57.76 1ptj n LYS 208 Cb 0.03 -0.88 -0.09 0.00 0.02 0.00 0.00 35.03 34.11 1ptj n LYS 208 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1ptj h GLU 209 N 0.00 -0.90 -0.72 1.64 4.22 -1.79 -2.47 114.58 114.56 1ptj h GLU 209 Ca 0.28 0.06 0.12 0.00 0.08 0.00 0.00 59.36 59.90 1ptj h GLU 209 Cb 0.71 0.21 -0.08 0.00 0.50 0.00 0.00 28.75 30.08 1ptj h GLU 209 CO -0.29 -0.58 0.31 1.96 -2.18 0.00 0.00 179.01 178.23 1ptj h GLN 210 N -1.02 0.47 -0.00 1.92 4.20 0.83 -2.12 115.11 119.39 1ptj h GLN 210 Ca -0.10 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.60 1ptj h GLN 210 Cb 0.74 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1ptj h GLN 210 CO 0.16 0.31 -0.06 0.28 -0.67 0.00 0.00 178.83 178.85 1ptj h VAL 211 N 0.49 0.85 -0.02 -0.54 2.07 -1.41 -2.48 116.25 115.20 1ptj h VAL 211 Ca 0.38 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.89 1ptj h VAL 211 Cb 0.51 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1ptj h VAL 211 CO -0.35 0.00 -0.03 -0.33 0.02 0.00 0.00 177.57 176.89 1ptj h GLU 212 N -0.10 0.03 0.00 1.57 5.08 -0.93 -2.10 114.58 118.13 1ptj h GLU 212 Ca 0.03 -0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.31 1ptj h GLU 212 Cb 0.13 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1ptj h GLU 212 CO -0.06 0.06 -0.34 0.66 -1.00 0.00 0.00 179.01 178.33 1ptj h SER 213 N 0.03 0.00 1.43 1.42 4.64 -0.96 -3.15 113.55 116.96 1ptj h SER 213 Ca 0.01 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.27 1ptj h SER 213 Cb 0.07 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1ptj h SER 213 CO 0.00 0.34 -0.58 -0.07 -0.87 0.00 0.00 176.83 175.65 1ptj h LEU 214 N 0.00 0.00 0.00 5.97 3.38 -1.08 -3.47 115.31 120.11 1ptj h LEU 214 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ptj h LEU 214 Cb 1.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1ptj h LEU 214 CO 0.04 0.24 0.00 0.61 0.09 0.00 0.00 178.44 179.43 1ptj n GLY 215 N 1.20 1.02 3.87 0.83 0.00 -1.10 -4.95 105.19 106.06 1ptj n GLY 215 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 1ptj n GLY 215 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ptj s GLY 216 N -0.83 1.38 -0.04 -0.02 0.00 -0.97 -4.74 107.32 102.10 1ptj s GLY 216 Ca 0.00 -1.39 -0.11 0.00 0.00 0.00 0.00 44.72 43.23 1ptj s GLY 216 CO 0.00 -1.41 0.29 1.25 0.00 0.00 0.00 173.10 173.23 1ptj s LYS 217 N -3.89 3.69 -0.17 2.90 2.20 -1.01 -3.53 119.74 119.92 1ptj s LYS 217 Ca 0.34 0.14 -0.15 0.00 -0.36 0.00 0.00 55.97 55.94 1ptj s LYS 217 Cb -0.08 -3.18 -0.04 0.00 -1.51 0.00 0.00 37.83 33.01 1ptj s LYS 217 CO 0.26 0.71 0.34 0.12 -0.36 0.00 0.00 175.35 176.43 1ptj s PHE 218 N -1.10 3.44 -1.04 4.03 5.36 -1.26 -2.48 117.98 124.93 1ptj s PHE 218 Ca 0.21 0.63 -0.18 0.00 -0.96 0.00 0.00 56.93 56.63 1ptj s PHE 218 Cb -0.14 -2.42 0.13 0.00 -0.34 0.00 0.00 43.02 40.25 1ptj s PHE 218 CO 0.10 0.16 1.29 0.42 -1.46 0.00 0.00 175.22 175.73 1ptj s ILE 219 N 0.73 4.65 0.48 3.12 1.01 0.10 -4.98 121.20 126.32 1ptj s ILE 219 Ca 0.18 -1.76 -0.23 0.00 0.00 0.00 0.00 60.65 58.84 1ptj s ILE 219 Cb -0.14 -4.88 -0.07 0.00 0.01 0.00 0.00 42.46 37.39 1ptj s ILE 219 CO 0.06 -1.63 1.27 -0.89 0.00 0.00 0.00 174.94 173.74 1ptj s THR 220 N 2.82 2.61 0.00 2.92 2.01 -1.26 -4.74 115.64 120.00 1ptj s THR 220 Ca 0.39 0.48 0.00 0.00 0.31 0.00 0.00 61.69 62.86 1ptj s THR 220 Cb -0.03 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.23 1ptj s THR 220 CO -0.06 0.01 0.00 0.55 -0.69 0.00 0.00 174.62 174.43 1ptj n VAL 221 N -0.60 0.00 -0.99 3.82 3.14 -1.26 -4.92 118.33 117.52 1ptj n VAL 221 Ca 0.08 0.00 0.09 0.00 -2.96 0.00 0.00 64.34 61.55 1ptj n VAL 221 Cb 0.46 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 33.19 1ptj n VAL 221 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1ptj n ASP 222 N 0.00 -4.04 0.00 6.55 -0.08 -1.26 -5.11 116.55 112.61 1ptj n ASP 222 Ca 0.00 0.74 0.00 0.00 -1.51 0.00 0.00 54.79 54.02 1ptj n ASP 222 Cb 0.00 -3.30 0.00 0.00 2.34 0.00 0.00 41.12 40.16 1ptj n ASP 222 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ptj n ALA 232 N -3.64 0.00 0.59 -1.67 0.00 -0.74 -5.08 120.51 109.96 1ptj n ALA 232 Ca -0.05 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.42 1ptj n ALA 232 Cb 0.37 0.00 0.14 0.00 0.00 0.00 0.00 19.45 19.96 1ptj n ALA 232 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ptj n GLY 233 N 0.00 1.43 0.00 0.00 0.00 -1.26 -4.57 105.19 100.79 1ptj n GLY 233 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1ptj n GLY 233 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ptj n GLY 234 N 0.48 -0.25 0.00 -0.02 0.00 -1.26 -4.90 105.19 99.24 1ptj n GLY 234 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1ptj n GLY 234 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 1ptj n TYR 235 N 0.00 0.00 -4.35 1.61 0.18 -1.26 -5.17 117.16 108.17 1ptj n TYR 235 Ca 0.00 0.00 -0.18 0.00 1.88 0.00 0.00 57.90 59.60 1ptj n TYR 235 Cb 0.00 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 38.91 1ptj n TYR 235 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1ptj n ALA 236 N -3.00 0.43 -3.18 -3.48 0.00 -1.26 -1.80 120.51 108.23 1ptj n ALA 236 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 53.44 51.93 1ptj n ALA 236 Cb 0.00 1.04 0.00 0.00 0.00 0.00 0.00 19.45 20.49 1ptj n ALA 236 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ptj n LYS 237 N -0.65 0.36 -1.96 0.00 5.02 -1.26 -4.57 118.16 115.09 1ptj n LYS 237 Ca -0.03 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.88 1ptj n LYS 237 Cb 0.45 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.48 1ptj n LYS 237 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1ptj s GLU 238 N -1.98 3.29 -0.03 1.97 8.01 -1.26 -4.95 118.70 123.76 1ptj s GLU 238 Ca 0.00 2.03 0.19 0.00 0.01 0.00 0.00 54.97 57.20 1ptj s GLU 238 Cb 0.00 -2.25 -0.29 0.00 -4.31 0.00 0.00 34.13 27.28 1ptj s GLU 238 CO 0.00 -1.01 0.41 -1.33 0.01 0.00 0.00 175.26 173.34 1ptj n MET 239 N -0.96 0.57 0.00 1.61 2.81 -1.26 -5.11 117.12 114.77 1ptj n MET 239 Ca 0.10 -0.17 0.00 0.00 -1.81 0.00 0.00 57.70 55.82 1ptj n MET 239 Cb 0.47 -1.44 0.00 0.00 -0.71 0.00 0.00 33.22 31.53 1ptj n MET 239 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ptj n GLY 240 N 1.44 1.29 0.47 3.03 0.00 -1.26 -4.43 105.19 105.73 1ptj n GLY 240 Ca -0.03 -1.56 0.29 0.00 0.00 0.00 0.00 46.02 44.71 1ptj n GLY 240 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ptj h GLU 241 N 0.00 0.00 -0.50 1.61 4.57 -2.00 -0.56 114.58 117.70 1ptj h GLU 241 Ca 0.00 0.00 0.04 0.00 -1.18 0.00 0.00 59.36 58.22 1ptj h GLU 241 Cb 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.55 1ptj h GLU 241 CO 0.00 0.00 0.27 1.49 -1.18 0.00 0.00 179.01 179.59 1ptj h GLU 242 N 0.00 0.52 0.24 1.92 4.57 -2.01 -3.05 114.58 116.77 1ptj h GLU 242 Ca 0.42 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.56 1ptj h GLU 242 Cb 1.77 -0.12 0.00 0.00 -0.16 0.00 0.00 28.75 30.25 1ptj h GLU 242 CO -0.00 0.34 -0.12 0.35 -1.18 0.00 0.00 179.01 178.40 1ptj h PHE 243 N 0.53 -0.30 -1.00 0.92 3.57 -1.31 -2.97 116.94 116.38 1ptj h PHE 243 Ca 0.21 -0.01 0.40 0.00 3.53 0.00 0.00 57.97 62.11 1ptj h PHE 243 Cb 0.08 0.10 -0.18 0.00 2.79 0.00 0.00 35.95 38.75 1ptj h PHE 243 CO -0.09 0.07 0.51 -0.09 -2.23 0.00 0.00 178.31 176.48 1ptj h ARG 244 N -0.90 0.03 -0.05 1.11 2.43 -1.56 0.98 114.38 116.42 1ptj h ARG 244 Ca -0.03 -0.00 -0.22 0.00 -0.81 0.00 0.00 59.98 58.91 1ptj h ARG 244 Cb 0.50 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 30.06 1ptj h ARG 244 CO 0.05 0.02 -0.84 0.87 -1.51 0.00 0.00 179.97 178.56 1ptj h LYS 245 N 0.03 0.66 0.00 0.20 1.57 -1.60 -2.50 116.57 114.93 1ptj h LYS 245 Ca 0.82 -0.64 -0.03 0.00 -1.87 0.00 0.00 60.65 58.93 1ptj h LYS 245 Cb 2.13 0.17 -0.00 0.00 0.08 0.00 0.00 32.23 34.60 1ptj h LYS 245 CO -0.76 1.24 -0.15 0.87 -0.57 0.00 0.00 179.45 180.08 1ptj h LYS 246 N 0.31 0.00 0.42 3.15 1.57 0.65 -3.22 116.57 119.45 1ptj h LYS 246 Ca -0.09 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 1ptj h LYS 246 Cb 1.50 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.82 1ptj h LYS 246 CO 0.17 0.15 -0.20 0.37 -0.57 0.00 0.00 179.45 179.37 1ptj h GLN 247 N 0.00 -0.55 0.00 3.15 4.15 0.73 -3.09 115.11 119.51 1ptj h GLN 247 Ca -0.00 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.46 1ptj h GLN 247 Cb 0.51 0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.32 1ptj h GLN 247 CO 0.02 -0.36 0.00 0.00 -1.93 0.00 0.00 178.83 176.56 1ptj n ALA 248 N -2.61 1.12 -1.00 3.38 0.00 -0.95 -3.40 120.51 117.04 1ptj n ALA 248 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1ptj n ALA 248 Cb 0.22 -0.89 0.00 0.00 0.00 0.00 0.00 19.45 18.78 1ptj n ALA 248 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ptj n GLU 249 N -0.02 0.00 0.14 0.00 4.07 -1.17 -3.65 120.64 120.01 1ptj n GLU 249 Ca 0.00 0.00 0.11 0.00 -0.06 0.00 0.00 57.16 57.21 1ptj n GLU 249 Cb 0.00 -0.12 0.51 0.00 -0.06 0.00 0.00 31.44 31.77 1ptj n GLU 249 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ptj n ALA 250 N -3.00 1.46 -0.16 4.31 0.00 -1.24 -2.07 120.51 119.81 1ptj n ALA 250 Ca 0.00 0.12 -0.08 0.00 0.00 0.00 0.00 53.44 53.48 1ptj n ALA 250 Cb 0.00 -1.36 0.01 0.00 0.00 0.00 0.00 19.45 18.10 1ptj n ALA 250 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ptj h VAL 251 N 0.00 1.15 -0.47 0.00 2.07 -1.75 -2.87 116.25 114.38 1ptj h VAL 251 Ca 0.00 -0.33 0.07 0.00 0.82 0.00 0.00 66.70 67.26 1ptj h VAL 251 Cb 0.25 0.51 -0.09 0.00 -1.52 0.00 0.00 31.29 30.44 1ptj h VAL 251 CO 0.00 0.15 -0.46 0.25 0.02 0.00 0.00 177.57 177.53 1ptj h LEU 252 N 0.63 -1.54 -1.21 2.57 5.85 -1.49 0.86 115.31 120.98 1ptj h LEU 252 Ca 0.17 0.23 0.38 0.00 0.84 0.00 0.00 57.88 59.51 1ptj h LEU 252 Cb -0.01 0.67 -0.14 0.00 0.37 0.00 0.00 40.66 41.56 1ptj h LEU 252 CO -0.03 -0.36 0.70 0.11 -0.34 0.00 0.00 178.44 178.51 1ptj h LYS 253 N -0.30 0.16 0.00 1.25 1.57 -1.65 0.12 116.57 117.72 1ptj h LYS 253 Ca 0.14 -0.01 -0.19 0.00 -1.87 0.00 0.00 60.65 58.72 1ptj h LYS 253 Cb 0.58 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.82 1ptj h LYS 253 CO -0.62 0.11 -2.01 0.39 -0.57 0.00 0.00 179.45 176.74 1ptj n GLU 254 N -4.89 0.66 0.16 3.15 -0.58 -0.00 -4.38 120.64 114.76 1ptj n GLU 254 Ca 0.35 -0.03 0.02 0.00 -0.42 0.00 0.00 57.16 57.08 1ptj n GLU 254 Cb 1.23 -1.59 0.24 0.00 -0.57 0.00 0.00 31.44 30.74 1ptj n GLU 254 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1ptj h LEU 255 N 0.00 0.00 -0.51 -4.62 5.85 0.32 -2.22 115.31 114.14 1ptj h LEU 255 Ca -0.26 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1ptj h LEU 255 Cb 1.63 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.66 1ptj h LEU 255 CO 0.02 0.51 0.00 1.33 -0.34 0.00 0.00 178.44 179.96 1ptj n VAL 256 N -3.63 0.03 0.19 1.05 0.24 -0.53 -2.80 118.33 112.88 1ptj n VAL 256 Ca -0.01 -0.14 0.02 0.00 -2.04 0.00 0.00 64.34 62.18 1ptj n VAL 256 Cb 0.58 0.02 0.01 0.00 -1.47 0.00 0.00 33.84 32.97 1ptj n VAL 256 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1ptj n LYS 257 N -0.36 1.11 -2.86 7.34 5.02 -1.03 -4.41 118.16 122.98 1ptj n LYS 257 Ca 0.20 -0.58 -0.37 0.00 -2.02 0.00 0.00 58.31 55.53 1ptj n LYS 257 Cb 0.22 -0.99 -0.06 0.00 -0.02 0.00 0.00 35.03 34.18 1ptj n LYS 257 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1ptj s THR 258 N -0.63 4.29 -0.15 -0.18 2.01 -0.87 -4.72 115.64 115.41 1ptj s THR 258 Ca 0.04 1.71 0.06 0.00 0.31 0.00 0.00 61.69 63.81 1ptj s THR 258 Cb 0.04 -3.99 -0.13 0.00 0.01 0.00 0.00 72.50 68.42 1ptj s THR 258 CO 0.08 0.19 -0.06 0.47 -0.69 0.00 0.00 174.62 174.61 1ptj n ASP 259 N 0.68 2.30 -3.95 3.53 8.00 -0.03 -4.43 116.55 122.65 1ptj n ASP 259 Ca 0.00 -0.05 -0.24 0.00 0.71 0.00 0.00 54.79 55.22 1ptj n ASP 259 Cb 0.50 0.25 -0.17 0.00 -0.02 0.00 0.00 41.12 41.68 1ptj n ASP 259 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1ptj s ILE 260 N -2.32 0.95 -0.14 0.53 -1.09 -1.12 -0.16 121.20 117.85 1ptj s ILE 260 Ca -0.15 -0.33 0.00 0.00 -2.23 0.00 0.00 60.65 57.95 1ptj s ILE 260 Cb 0.05 -0.92 0.02 0.00 -1.58 0.00 0.00 42.46 40.03 1ptj s ILE 260 CO 0.45 0.33 -0.14 0.00 -1.23 0.00 0.00 174.94 174.35 1ptj s ALA 261 N 1.06 1.76 -0.21 9.38 0.00 0.54 -0.92 121.76 133.36 1ptj s ALA 261 Ca -0.08 -0.82 -0.04 0.00 0.00 0.00 0.00 51.96 51.02 1ptj s ALA 261 Cb -0.14 -0.99 -0.01 0.00 0.00 0.00 0.00 23.12 21.97 1ptj s ALA 261 CO -0.01 -0.33 -0.05 0.42 0.00 0.00 0.00 175.76 175.80 1ptj s ILE 262 N 1.42 3.36 -0.25 0.00 1.01 -0.74 0.48 121.20 126.49 1ptj s ILE 262 Ca 0.03 -0.50 -0.08 0.00 0.00 0.00 0.00 60.65 60.10 1ptj s ILE 262 Cb -0.13 -2.52 -0.03 0.00 0.01 0.00 0.00 42.46 39.78 1ptj s ILE 262 CO -0.09 0.43 0.09 0.42 0.00 0.00 0.00 174.94 175.80 1ptj s THR 263 N 1.39 4.54 -0.02 2.92 -4.23 0.53 -1.27 115.64 119.50 1ptj s THR 263 Ca 0.05 -0.10 0.03 0.00 -1.18 0.00 0.00 61.69 60.49 1ptj s THR 263 Cb -0.14 -3.12 0.05 0.00 1.34 0.00 0.00 72.50 70.62 1ptj s THR 263 CO -0.03 0.33 0.93 0.35 -0.54 0.00 0.00 174.62 175.66 1ptj n THR 264 N 4.81 0.89 -2.02 3.99 -2.24 -0.10 -0.70 114.28 118.91 1ptj n THR 264 Ca -0.16 -0.95 -0.42 0.00 -2.27 0.00 0.00 64.05 60.25 1ptj n THR 264 Cb 0.52 0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 69.20 1ptj n THR 264 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ptj s ALA 265 N -1.05 3.68 0.03 6.98 0.00 -1.23 -4.85 121.76 125.31 1ptj s ALA 265 Ca 0.05 1.30 0.00 0.00 0.00 0.00 0.00 51.96 53.31 1ptj s ALA 265 Cb 0.05 -3.58 -0.02 0.00 0.00 0.00 0.00 23.12 19.57 1ptj s ALA 265 CO 0.00 -0.72 -0.04 -0.51 0.00 0.00 0.00 175.76 174.49 1ptj s LEU 266 N 0.61 2.26 -0.23 0.00 1.02 -1.26 -4.41 118.68 116.67 1ptj s LEU 266 Ca 0.65 -0.54 -0.03 0.00 0.02 0.00 0.00 54.13 54.23 1ptj s LEU 266 Cb -0.41 0.07 0.11 0.00 0.02 0.00 0.00 46.19 45.98 1ptj s LEU 266 CO 0.35 -0.31 0.29 -0.63 0.02 0.00 0.00 176.35 176.07 1ptj s ILE 267 N -1.62 -0.44 0.30 -0.59 1.01 -1.26 -4.75 121.20 113.85 1ptj s ILE 267 Ca -0.14 -0.17 -0.25 0.00 0.00 0.00 0.00 60.65 60.10 1ptj s ILE 267 Cb -0.09 -0.78 -0.16 0.00 0.01 0.00 0.00 42.46 41.44 1ptj s ILE 267 CO -0.01 -0.22 0.40 -2.65 0.00 0.00 0.00 174.94 172.45 1ptj n PRO 268 N 5.33 0.14 -0.18 2.79 -0.02 -1.26 -1.96 135.00 139.84 1ptj n PRO 268 Ca -0.04 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1ptj n PRO 268 Cb 0.49 -1.10 0.00 0.00 -0.02 0.00 0.00 33.50 32.87 1ptj n PRO 268 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ptj n GLY 269 N 2.05 0.00 3.24 -1.23 0.00 -1.26 -4.88 105.19 103.11 1ptj n GLY 269 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.93 1ptj n GLY 269 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ptj s LYS 270 N -0.35 1.17 0.42 1.61 -0.14 -0.83 -5.12 119.74 116.50 1ptj s LYS 270 Ca 0.00 -1.00 -0.22 0.00 -1.36 0.00 0.00 55.97 53.39 1ptj s LYS 270 Cb 0.00 -1.31 -0.13 0.00 -1.68 0.00 0.00 37.83 34.71 1ptj s LYS 270 CO 0.00 0.32 0.49 -2.30 -0.76 0.00 0.00 175.35 173.10 1ptj n PRO 271 N 1.51 0.50 -1.78 -1.68 -0.02 -1.26 -4.45 135.00 127.82 1ptj n PRO 271 Ca -0.19 0.18 -0.42 0.00 -2.02 0.00 0.00 63.50 61.06 1ptj n PRO 271 Cb 0.54 -1.45 -0.02 0.00 -0.02 0.00 0.00 33.50 32.54 1ptj n PRO 271 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ptj s ALA 272 N -1.50 3.84 -0.06 3.55 0.00 0.24 -4.71 121.76 123.11 1ptj s ALA 272 Ca 0.63 1.55 -0.30 0.00 0.00 0.00 0.00 51.96 53.84 1ptj s ALA 272 Cb -0.60 -3.66 -0.06 0.00 0.00 0.00 0.00 23.12 18.79 1ptj s ALA 272 CO 0.59 -0.93 1.77 -1.25 0.00 0.00 0.00 175.76 175.94 1ptj s PRO 273 N 0.46 4.06 -0.01 0.00 0.04 -1.26 -4.62 135.00 133.67 1ptj s PRO 273 Ca 0.69 2.23 -0.30 0.00 0.04 0.00 0.00 61.00 63.66 1ptj s PRO 273 Cb -0.48 -4.06 -0.06 0.00 0.04 0.00 0.00 34.50 29.94 1ptj s PRO 273 CO 0.38 -1.00 1.56 0.54 0.04 0.00 0.00 177.00 178.52 1ptj s VAL 274 N 4.55 3.52 -0.02 -0.36 0.11 -1.26 -4.43 120.40 122.51 1ptj s VAL 274 Ca 0.79 0.81 0.02 0.00 -2.93 0.00 0.00 61.98 60.66 1ptj s VAL 274 Cb -0.35 -3.52 -0.03 0.00 -1.53 0.00 0.00 36.38 30.96 1ptj s VAL 274 CO 0.33 -0.04 0.05 0.18 -3.33 0.00 0.00 175.10 172.29 1ptj n LEU 275 N 6.23 0.02 -3.72 2.54 4.77 0.14 -4.91 117.00 122.06 1ptj n LEU 275 Ca 0.16 -0.09 -0.29 0.00 -0.03 0.00 0.00 56.01 55.75 1ptj n LEU 275 Cb 0.43 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.36 1ptj n LEU 275 CO 0.61 0.00 -0.35 -0.63 -1.33 0.00 0.00 177.39 175.70 1ptj s ILE 276 N -1.95 0.66 0.88 -0.08 1.01 -0.80 -4.97 121.20 115.95 1ptj s ILE 276 Ca -0.00 -1.03 -0.13 0.00 0.00 0.00 0.00 60.65 59.48 1ptj s ILE 276 Cb 0.01 -1.37 0.13 0.00 0.01 0.00 0.00 42.46 41.24 1ptj s ILE 276 CO 0.07 -0.51 1.22 0.42 0.00 0.00 0.00 174.94 176.14 1ptj s THR 277 N 1.75 1.99 0.04 2.92 -4.23 -1.26 -4.17 115.64 112.68 1ptj s THR 277 Ca 0.05 0.00 0.33 0.00 -1.18 0.00 0.00 61.69 60.89 1ptj s THR 277 Cb -0.17 -2.96 0.37 0.00 1.34 0.00 0.00 72.50 71.08 1ptj s THR 277 CO -0.20 0.00 1.96 -0.08 -0.54 0.00 0.00 174.62 175.76 1ptj h GLU 278 N -1.32 0.00 0.00 3.99 4.81 -1.98 -1.48 114.58 118.60 1ptj h GLU 278 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1ptj h GLU 278 Cb 1.30 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.68 1ptj h GLU 278 CO 0.56 0.00 -0.04 1.49 -0.73 0.00 0.00 179.01 180.29 1ptj h GLU 279 N 0.00 0.00 0.09 1.92 4.57 -2.00 -3.01 114.58 116.15 1ptj h GLU 279 Ca 0.00 0.00 -0.37 0.00 -1.18 0.00 0.00 59.36 57.81 1ptj h GLU 279 Cb 0.47 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.02 1ptj h GLU 279 CO 0.00 0.00 -2.14 -1.33 -1.18 0.00 0.00 179.01 174.36 1ptj n MET 280 N -2.82 0.73 0.13 1.92 2.81 -0.63 -4.06 117.12 115.20 1ptj n MET 280 Ca 0.04 0.23 0.07 0.00 -1.81 0.00 0.00 57.70 56.23 1ptj n MET 280 Cb 0.50 -1.65 0.55 0.00 -0.71 0.00 0.00 33.22 31.91 1ptj n MET 280 CO 0.00 0.00 0.00 -0.24 1.51 0.00 0.00 175.97 177.24 1ptj h VAL 281 N 0.05 1.03 0.00 2.03 3.04 -1.44 0.18 116.25 121.14 1ptj h VAL 281 Ca -0.47 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.14 1ptj h VAL 281 Cb 1.99 0.77 0.00 0.00 -2.01 0.00 0.00 31.29 32.04 1ptj h VAL 281 CO 0.03 0.04 0.00 0.00 -1.01 0.00 0.00 177.57 176.64 1ptj h THR 282 N 0.24 0.00 -0.02 3.17 1.03 -1.67 -2.35 112.91 113.31 1ptj h THR 282 Ca 0.08 -0.22 0.00 0.00 -0.01 0.00 0.00 66.41 66.26 1ptj h THR 282 Cb 0.03 1.22 0.00 0.00 -1.07 0.00 0.00 68.15 68.33 1ptj h THR 282 CO -0.02 0.00 -0.30 0.29 -0.01 0.00 0.00 175.52 175.49 1ptj n LYS 283 N -3.08 1.63 -2.68 0.00 5.02 0.04 -4.98 118.16 114.12 1ptj n LYS 283 Ca -0.01 -1.34 -0.36 0.00 -2.02 0.00 0.00 58.31 54.58 1ptj n LYS 283 Cb 0.17 -1.46 -0.05 0.00 -0.02 0.00 0.00 35.03 33.66 1ptj n LYS 283 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1ptj s MET 284 N -2.27 4.33 0.45 1.97 -1.94 -0.89 -4.71 119.30 116.25 1ptj s MET 284 Ca 0.22 1.38 -0.22 0.00 -1.71 0.00 0.00 55.69 55.35 1ptj s MET 284 Cb 0.19 -2.58 -0.10 0.00 2.01 0.00 0.00 34.83 34.34 1ptj s MET 284 CO 0.47 0.04 0.79 1.63 -0.01 0.00 0.00 175.02 177.93 1ptj n LYS 285 N 0.07 0.93 -2.19 2.03 5.02 -1.26 -4.88 118.16 117.88 1ptj n LYS 285 Ca 0.04 0.34 -0.39 0.00 -2.02 0.00 0.00 58.31 56.28 1ptj n LYS 285 Cb 0.50 -1.82 -0.02 0.00 -0.02 0.00 0.00 35.03 33.68 1ptj n LYS 285 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ptj s PRO 286 N -1.94 4.14 0.00 1.97 0.04 -1.26 -2.61 135.00 135.33 1ptj s PRO 286 Ca 0.65 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.71 1ptj s PRO 286 Cb -0.55 -2.83 0.00 0.00 0.04 0.00 0.00 34.50 31.16 1ptj s PRO 286 CO 0.56 -0.31 0.00 0.41 0.04 0.00 0.00 177.00 177.70 1ptj n GLY 287 N 0.73 0.74 3.83 0.56 0.00 0.14 -5.02 105.19 106.16 1ptj n GLY 287 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1ptj n GLY 287 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ptj s SER 288 N -2.90 5.47 0.01 1.61 0.01 -1.07 -4.64 113.70 112.19 1ptj s SER 288 Ca 0.00 1.59 0.06 0.00 1.31 0.00 0.00 55.95 58.90 1ptj s SER 288 Cb 0.00 -2.48 -0.02 0.00 0.21 0.00 0.00 66.02 63.73 1ptj s SER 288 CO 0.00 -1.38 -0.17 -0.69 0.41 0.00 0.00 173.24 171.40 1ptj s VAL 289 N -3.06 1.36 -0.15 3.43 1.01 0.77 -0.79 120.40 122.97 1ptj s VAL 289 Ca 0.58 -0.88 0.01 0.00 0.00 0.00 0.00 61.98 61.68 1ptj s VAL 289 Cb -0.14 -1.16 0.02 0.00 0.00 0.00 0.00 36.38 35.10 1ptj s VAL 289 CO 0.55 0.26 -0.15 -0.63 0.00 0.00 0.00 175.10 175.13 1ptj s ILE 290 N -0.58 1.66 -0.43 2.22 1.01 0.13 -0.34 121.20 124.89 1ptj s ILE 290 Ca 0.06 -0.69 -0.14 0.00 0.00 0.00 0.00 60.65 59.88 1ptj s ILE 290 Cb -0.07 -1.54 0.04 0.00 0.01 0.00 0.00 42.46 40.90 1ptj s ILE 290 CO 0.00 0.47 0.31 -0.63 0.00 0.00 0.00 174.94 175.10 1ptj s ILE 291 N 1.42 5.03 -0.49 2.92 -1.09 0.18 0.58 121.20 129.75 1ptj s ILE 291 Ca 0.04 -0.91 -0.17 0.00 -2.23 0.00 0.00 60.65 57.39 1ptj s ILE 291 Cb -0.13 -3.90 0.07 0.00 -1.58 0.00 0.00 42.46 36.92 1ptj s ILE 291 CO -0.11 -0.41 0.51 -0.62 -1.23 0.00 0.00 174.94 173.08 1ptj s ASP 292 N 2.01 6.18 0.29 3.58 -1.08 -0.37 -0.35 116.67 126.94 1ptj s ASP 292 Ca 0.04 -1.15 0.21 0.00 -0.52 0.00 0.00 52.55 51.12 1ptj s ASP 292 Cb -0.21 -2.23 0.12 0.00 -1.46 0.00 0.00 42.92 39.13 1ptj s ASP 292 CO 0.08 -0.77 1.30 -0.07 0.52 0.00 0.00 175.17 176.22 1ptj h LEU 293 N 9.21 0.00 -1.21 -1.34 3.38 -1.22 -3.26 115.31 120.87 1ptj h LEU 293 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1ptj h LEU 293 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1ptj h LEU 293 CO 0.92 0.17 0.00 0.00 0.09 0.00 0.00 178.44 179.62 1ptj n ALA 294 N -2.19 2.54 -0.33 1.53 0.00 -1.22 -4.45 120.51 116.40 1ptj n ALA 294 Ca 0.01 -0.55 0.24 0.00 0.00 0.00 0.00 53.44 53.14 1ptj n ALA 294 Cb 0.62 -0.99 0.52 0.00 0.00 0.00 0.00 19.45 19.60 1ptj n ALA 294 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.50 177.26 1ptj h VAL 295 N 1.69 0.50 -0.00 0.00 3.04 -1.84 0.27 116.25 119.90 1ptj h VAL 295 Ca 0.00 -0.13 0.00 0.00 -1.01 0.00 0.00 66.70 65.56 1ptj h VAL 295 Cb 0.49 0.10 0.00 0.00 -2.01 0.00 0.00 31.29 29.87 1ptj h VAL 295 CO 0.03 0.07 -0.00 -0.62 -1.01 0.00 0.00 177.57 176.03 1ptj n GLU 296 N -4.62 0.57 -0.44 4.17 1.02 -1.26 -2.41 120.64 117.67 1ptj n GLU 296 Ca 0.26 -0.01 0.07 0.00 -0.02 0.00 0.00 57.16 57.47 1ptj n GLU 296 Cb 0.92 -1.50 0.24 0.00 -0.02 0.00 0.00 31.44 31.08 1ptj n GLU 296 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ptj n ALA 297 N -1.21 3.04 0.00 0.62 0.00 0.77 -4.92 120.51 118.81 1ptj n ALA 297 Ca 0.17 -2.43 0.00 0.00 0.00 0.00 0.00 53.44 51.17 1ptj n ALA 297 Cb 0.21 -0.68 0.00 0.00 0.00 0.00 0.00 19.45 18.98 1ptj n ALA 297 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ptj n GLY 298 N -0.69 3.23 0.00 0.00 0.00 -1.01 -0.59 105.19 106.13 1ptj n GLY 298 Ca 0.22 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.34 1ptj n GLY 298 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ptj n GLY 299 N 0.00 2.87 0.20 -0.02 0.00 -0.19 -4.72 105.19 103.34 1ptj n GLY 299 Ca 0.00 -1.88 0.12 0.00 0.00 0.00 0.00 46.02 44.26 1ptj n GLY 299 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ptj n ASN 300 N 0.00 1.08 -3.68 1.61 4.13 -1.26 -4.41 115.26 112.73 1ptj n ASN 300 Ca 0.00 -0.87 -0.26 0.00 1.68 0.00 0.00 54.58 55.13 1ptj n ASN 300 Cb 0.00 0.33 -0.17 0.00 -1.54 0.00 0.00 39.78 38.40 1ptj n ASN 300 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ptj h PRO 302 N 8.33 0.00 0.00 0.00 0.13 -1.84 -1.21 132.00 137.41 1ptj h PRO 302 Ca -0.16 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.89 1ptj h PRO 302 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1ptj h PRO 302 CO 0.31 0.00 -0.40 -0.07 -0.23 0.00 0.00 178.00 177.61 1ptj h LEU 303 N 0.00 0.00 -9.86 1.56 3.38 -1.96 -3.45 115.31 104.99 1ptj h LEU 303 Ca 0.26 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.71 1ptj h LEU 303 Cb 1.78 0.00 0.06 0.00 0.09 0.00 0.00 40.66 42.58 1ptj h LEU 303 CO -0.00 0.40 0.61 -0.94 0.09 0.00 0.00 178.44 178.60 1ptj s SER 304 N -6.67 6.86 -0.12 -0.43 1.04 -0.46 -4.89 113.70 109.03 1ptj s SER 304 Ca -0.02 2.61 -0.01 0.00 0.48 0.00 0.00 55.95 59.02 1ptj s SER 304 Cb 0.13 -2.64 0.03 0.00 0.10 0.00 0.00 66.02 63.63 1ptj s SER 304 CO 0.71 -0.47 -0.06 -1.61 0.98 0.00 0.00 173.24 172.79 1ptj s GLU 305 N -1.66 1.35 -0.19 4.02 2.02 -1.26 -4.97 118.70 118.01 1ptj s GLU 305 Ca 0.48 -0.28 -0.41 0.00 0.02 0.00 0.00 54.97 54.78 1ptj s GLU 305 Cb -0.38 -1.64 -0.18 0.00 0.10 0.00 0.00 34.13 32.03 1ptj s GLU 305 CO 0.50 -0.33 1.46 -0.35 0.02 0.00 0.00 175.26 176.57 1ptj n PRO 306 N 4.96 0.60 -0.58 0.39 -0.04 -1.26 -2.19 135.00 136.88 1ptj n PRO 306 Ca -0.11 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.56 1ptj n PRO 306 Cb 0.49 -1.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.15 1ptj n PRO 306 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ptj n GLY 307 N 3.16 0.79 3.27 0.55 0.00 -0.35 -4.94 105.19 107.66 1ptj n GLY 307 Ca 0.24 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.15 1ptj n GLY 307 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ptj s LYS 308 N -0.42 0.86 -0.08 1.61 -2.85 -0.93 -4.89 119.74 113.04 1ptj s LYS 308 Ca 0.00 -0.52 -0.20 0.00 -1.00 0.00 0.00 55.97 54.25 1ptj s LYS 308 Cb 0.00 0.37 -0.04 0.00 -2.06 0.00 0.00 37.83 36.10 1ptj s LYS 308 CO 0.00 -0.29 0.55 0.42 0.10 0.00 0.00 175.35 176.13 1ptj s ILE 309 N -2.74 5.10 -0.16 3.79 1.01 -1.26 -3.48 121.20 123.46 1ptj s ILE 309 Ca -0.04 1.11 0.02 0.00 0.00 0.00 0.00 60.65 61.74 1ptj s ILE 309 Cb -0.00 -3.88 0.01 0.00 0.01 0.00 0.00 42.46 38.60 1ptj s ILE 309 CO -0.04 0.34 -0.21 -0.69 0.00 0.00 0.00 174.94 174.33 1ptj s VAL 310 N 0.43 2.06 -0.26 2.92 1.01 0.28 -4.96 120.40 121.89 1ptj s VAL 310 Ca 0.29 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 1ptj s VAL 310 Cb -0.16 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 1ptj s VAL 310 CO 0.13 0.54 0.16 -0.69 0.00 0.00 0.00 175.10 175.25 1ptj s VAL 311 N 1.05 5.25 -0.18 2.92 1.01 -1.26 0.58 120.40 129.78 1ptj s VAL 311 Ca -0.01 0.15 -0.06 0.00 0.00 0.00 0.00 61.98 62.05 1ptj s VAL 311 Cb -0.14 -3.47 0.08 0.00 0.00 0.00 0.00 36.38 32.85 1ptj s VAL 311 CO -0.07 0.31 0.38 -0.54 0.00 0.00 0.00 175.10 175.17 1ptj s LYS 312 N 1.36 0.28 -0.74 2.72 -0.14 -0.60 -4.89 119.74 117.74 1ptj s LYS 312 Ca 0.07 0.95 0.00 0.00 -1.36 0.00 0.00 55.97 55.63 1ptj s LYS 312 Cb -0.15 0.23 0.00 0.00 -1.68 0.00 0.00 37.83 36.23 1ptj s LYS 312 CO 0.07 -0.26 0.00 0.72 -0.76 0.00 0.00 175.35 175.12 1ptj n HIS 313 N 5.35 -0.32 -0.22 3.18 8.25 -1.26 -2.97 115.22 127.23 1ptj n HIS 313 Ca -0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 1ptj n HIS 313 Cb 0.50 -2.09 0.00 0.00 1.12 0.00 0.00 29.99 29.52 1ptj n HIS 313 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ptj n GLY 314 N -1.19 1.77 3.69 -1.41 0.00 -1.26 -4.85 105.19 101.96 1ptj n GLY 314 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 1ptj n GLY 314 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ptj s VAL 315 N -2.94 4.49 -0.21 1.61 1.01 -1.16 -0.68 120.40 122.52 1ptj s VAL 315 Ca 0.00 -0.17 -0.16 0.00 0.00 0.00 0.00 61.98 61.64 1ptj s VAL 315 Cb 0.00 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1ptj s VAL 315 CO 0.00 0.59 0.42 -0.75 0.00 0.00 0.00 175.10 175.36 1ptj s LYS 316 N -0.72 4.15 -0.33 2.72 2.20 0.03 -1.55 119.74 126.24 1ptj s LYS 316 Ca 0.12 0.23 -0.03 0.00 -0.36 0.00 0.00 55.97 55.93 1ptj s LYS 316 Cb -0.12 -3.56 0.06 0.00 -1.51 0.00 0.00 37.83 32.70 1ptj s LYS 316 CO 0.02 -0.10 0.06 0.42 -0.36 0.00 0.00 175.35 175.39 1ptj s ILE 317 N 1.50 3.18 0.03 5.43 1.09 0.20 0.22 121.20 132.84 1ptj s ILE 317 Ca 0.20 -1.48 -0.16 0.00 -1.10 0.00 0.00 60.65 58.10 1ptj s ILE 317 Cb -0.15 -2.90 -0.06 0.00 -1.06 0.00 0.00 42.46 38.29 1ptj s ILE 317 CO 0.08 -0.24 0.47 -0.69 -0.10 0.00 0.00 174.94 174.46 1ptj s VAL 318 N 1.25 4.93 -0.35 2.92 1.01 0.19 -0.55 120.40 129.80 1ptj s VAL 318 Ca -0.02 0.97 0.15 0.00 0.00 0.00 0.00 61.98 63.08 1ptj s VAL 318 Cb -0.20 -3.78 0.44 0.00 0.00 0.00 0.00 36.38 32.84 1ptj s VAL 318 CO -0.01 0.56 1.12 0.61 0.00 0.00 0.00 175.10 177.38 1ptj n GLY 319 N 1.76 1.47 3.41 4.51 0.00 -1.23 -1.23 105.19 113.88 1ptj n GLY 319 Ca -0.13 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 44.73 1ptj n GLY 319 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ptj n HIS 320 N -0.31 -1.50 -4.39 1.61 8.25 -1.26 -1.21 115.22 116.40 1ptj n HIS 320 Ca 0.04 0.23 -0.30 0.00 -0.26 0.00 0.00 57.72 57.43 1ptj n HIS 320 Cb 0.83 -1.78 -0.11 0.00 1.12 0.00 0.00 29.99 30.05 1ptj n HIS 320 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1ptj s THR 321 N -2.36 3.24 -1.20 1.59 -4.23 -1.26 -4.52 115.64 106.90 1ptj s THR 321 Ca 0.57 -1.16 -0.08 0.00 -1.18 0.00 0.00 61.69 59.84 1ptj s THR 321 Cb -0.22 -2.46 -0.02 0.00 1.34 0.00 0.00 72.50 71.15 1ptj s THR 321 CO 0.67 0.23 0.77 -3.20 -0.54 0.00 0.00 174.62 172.55 1ptj n ASN 322 N 1.11 -3.58 -0.25 3.99 5.15 -1.26 -4.86 115.26 115.55 1ptj n ASN 322 Ca -0.15 -0.86 0.05 0.00 -0.60 0.00 0.00 54.58 53.02 1ptj n ASN 322 Cb 0.52 -4.06 0.29 0.00 -0.53 0.00 0.00 39.78 36.00 1ptj n ASN 322 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1ptj h VAL 323 N -1.72 1.05 -0.97 3.44 2.07 -1.97 -2.03 116.25 116.11 1ptj h VAL 323 Ca -0.63 -0.31 0.21 0.00 0.82 0.00 0.00 66.70 66.78 1ptj h VAL 323 Cb 1.35 0.05 -0.09 0.00 -1.52 0.00 0.00 31.29 31.08 1ptj h VAL 323 CO 0.51 0.17 0.62 -0.65 0.02 0.00 0.00 177.57 178.24 1ptj h PRO 324 N 0.92 0.55 0.00 1.57 0.11 -1.89 0.62 132.00 133.88 1ptj h PRO 324 Ca 0.36 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.43 1ptj h PRO 324 Cb 0.22 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.21 1ptj h PRO 324 CO -0.13 0.37 0.00 1.03 -0.21 0.00 0.00 178.00 179.06 1ptj h SER 325 N 0.57 0.00 0.79 -2.05 0.87 -1.72 0.15 113.55 112.16 1ptj h SER 325 Ca 0.54 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 61.09 1ptj h SER 325 Cb 1.09 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1ptj h SER 325 CO -0.28 0.00 -0.01 0.03 -0.53 0.00 0.00 176.83 176.04 1ptj h ARG 326 N 0.00 0.00 -1.20 2.24 3.08 0.18 -2.49 114.38 116.20 1ptj h ARG 326 Ca 0.00 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.47 1ptj h ARG 326 Cb 0.22 0.00 -0.42 0.00 0.08 0.00 0.00 29.97 29.85 1ptj h ARG 326 CO 0.00 0.01 -0.73 0.28 -1.07 0.00 0.00 179.97 178.46 1ptj n VAL 327 N -3.10 2.47 -0.15 2.04 0.31 0.52 -4.93 118.33 115.48 1ptj n VAL 327 Ca -0.00 -4.61 -0.04 0.00 -0.01 0.00 0.00 64.34 59.68 1ptj n VAL 327 Cb 0.26 -1.21 0.02 0.00 -0.91 0.00 0.00 33.84 31.99 1ptj n VAL 327 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ptj h ALA 328 N 2.41 0.14 -0.06 3.52 0.00 -1.40 -0.05 119.26 123.82 1ptj h ALA 328 Ca 0.34 0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.43 1ptj h ALA 328 Cb 1.17 0.54 -0.00 0.00 0.00 0.00 0.00 17.79 19.49 1ptj h ALA 328 CO 0.83 -0.55 0.05 0.00 0.00 0.00 0.00 179.25 179.58 1ptj h ALA 329 N 1.22 1.75 0.06 0.00 0.00 -1.76 -1.05 119.26 119.49 1ptj h ALA 329 Ca 0.23 -0.00 -0.38 0.00 0.00 0.00 0.00 54.91 54.76 1ptj h ALA 329 Cb 0.46 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1ptj h ALA 329 CO -0.55 -0.08 -2.23 -0.25 0.00 0.00 0.00 179.25 176.13 1ptj n ASP 330 N -4.05 1.97 -0.24 0.00 8.00 -0.99 -4.35 116.55 116.88 1ptj n ASP 330 Ca -0.02 0.04 -0.02 0.00 0.71 0.00 0.00 54.79 55.51 1ptj n ASP 330 Cb 0.15 -0.58 0.09 0.00 -0.02 0.00 0.00 41.12 40.76 1ptj n ASP 330 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ptj h ALA 331 N 0.09 0.92 0.12 2.24 0.00 -0.72 -3.19 119.26 118.73 1ptj h ALA 331 Ca -0.50 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1ptj h ALA 331 Cb 1.98 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1ptj h ALA 331 CO 0.00 0.13 -0.06 0.77 0.00 0.00 0.00 179.25 180.10 1ptj h SER 332 N 0.78 -0.14 -0.38 0.00 0.02 -1.41 -0.27 113.55 112.15 1ptj h SER 332 Ca 0.29 -0.09 0.08 0.00 -0.84 0.00 0.00 61.79 61.23 1ptj h SER 332 Cb 0.11 0.04 -0.07 0.00 0.14 0.00 0.00 62.40 62.61 1ptj h SER 332 CO -0.15 -0.00 -0.11 -0.65 -1.14 0.00 0.00 176.83 174.78 1ptj h PRO 333 N -0.27 -0.02 -0.47 3.45 0.11 -1.75 0.85 132.00 133.89 1ptj h PRO 333 Ca -0.02 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.12 1ptj h PRO 333 Cb 0.22 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.30 1ptj h PRO 333 CO 0.03 -0.01 0.28 -0.07 -0.21 0.00 0.00 178.00 178.01 1ptj h LEU 334 N -0.02 0.44 -0.21 2.35 3.38 -1.53 -1.68 115.31 118.04 1ptj h LEU 334 Ca 0.18 0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.17 1ptj h LEU 334 Cb 0.30 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1ptj h LEU 334 CO -0.40 0.31 0.11 0.15 0.09 0.00 0.00 178.44 178.70 1ptj h PHE 335 N 0.55 0.21 -0.74 1.13 3.57 -0.18 -0.89 116.94 120.59 1ptj h PHE 335 Ca 0.19 0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.80 1ptj h PHE 335 Cb 0.03 -0.06 -0.05 0.00 2.79 0.00 0.00 35.95 38.66 1ptj h PHE 335 CO -0.07 0.12 0.49 0.00 -2.23 0.00 0.00 178.31 176.62 1ptj h ALA 336 N 1.10 1.84 -0.01 2.41 0.00 -0.46 -1.35 119.26 122.79 1ptj h ALA 336 Ca 0.09 -0.01 -0.17 0.00 0.00 0.00 0.00 54.91 54.82 1ptj h ALA 336 Cb 0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1ptj h ALA 336 CO -0.05 0.01 -0.78 -0.22 0.00 0.00 0.00 179.25 178.20 1ptj h LYS 337 N 0.64 0.11 -0.67 0.00 3.64 -0.53 -1.66 116.57 118.10 1ptj h LYS 337 Ca 0.34 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 1ptj h LYS 337 Cb 0.49 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.30 1ptj h LYS 337 CO -0.12 0.83 0.40 -0.91 -2.27 0.00 0.00 179.45 177.37 1ptj h ASN 338 N 0.07 0.81 -0.45 4.20 2.35 -0.05 0.94 115.58 123.46 1ptj h ASN 338 Ca -0.02 -0.07 -0.12 0.00 -0.55 0.00 0.00 56.30 55.54 1ptj h ASN 338 Cb 1.36 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 39.51 1ptj h ASN 338 CO 0.11 0.64 -0.19 -0.07 -1.65 0.00 0.00 177.43 176.27 1ptj h LEU 339 N 0.91 0.97 -0.28 1.61 3.38 -1.35 -2.12 115.31 118.42 1ptj h LEU 339 Ca 0.24 -0.35 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1ptj h LEU 339 Cb -0.01 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.46 1ptj h LEU 339 CO -0.04 1.13 0.13 0.25 0.09 0.00 0.00 178.44 179.99 1ptj h LEU 340 N 0.83 0.38 -2.04 1.67 5.85 -0.81 -0.77 115.31 120.42 1ptj h LEU 340 Ca 0.11 -0.14 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1ptj h LEU 340 Cb 0.75 -0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.68 1ptj h LEU 340 CO 0.06 0.42 -0.09 0.78 -0.34 0.00 0.00 178.44 179.27 1ptj h ASN 341 N 0.32 0.00 0.68 1.25 2.35 -0.67 -0.07 115.58 119.44 1ptj h ASN 341 Ca 0.10 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.58 1ptj h ASN 341 Cb 0.15 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 1ptj h ASN 341 CO -0.01 0.09 -1.38 0.15 -1.65 0.00 0.00 177.43 174.63 1ptj h PHE 342 N 0.00 0.13 0.00 1.19 3.57 -0.81 -3.41 116.94 117.61 1ptj h PHE 342 Ca -0.00 -0.09 -0.15 0.00 3.53 0.00 0.00 57.97 61.26 1ptj h PHE 342 Cb 0.22 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 1ptj h PHE 342 CO 0.00 1.11 -0.94 1.25 -2.23 0.00 0.00 178.31 177.50 1ptj h LEU 343 N 0.02 0.00 -0.70 0.59 6.46 -0.78 -3.41 115.31 117.49 1ptj h LEU 343 Ca -0.16 -0.37 0.29 0.00 -0.12 0.00 0.00 57.88 57.51 1ptj h LEU 343 Cb 1.92 0.00 -0.13 0.00 -0.73 0.00 0.00 40.66 41.72 1ptj h LEU 343 CO 0.12 1.22 0.36 0.41 -0.62 0.00 0.00 178.44 179.93 1ptj n THR 344 N -4.51 -0.29 0.58 1.05 -1.04 -0.07 -1.08 114.28 108.93 1ptj n THR 344 Ca -0.23 1.42 0.04 0.00 -2.04 0.00 0.00 64.05 63.25 1ptj n THR 344 Cb 0.53 -2.29 0.26 0.00 -1.82 0.00 0.00 70.33 67.01 1ptj n THR 344 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1ptj n PRO 345 N -4.59 0.29 -0.42 -2.82 -0.02 -1.26 -3.05 135.00 123.13 1ptj n PRO 345 Ca 0.26 0.00 0.05 0.00 -2.02 0.00 0.00 63.50 61.79 1ptj n PRO 345 Cb 0.88 -1.48 0.09 0.00 -0.02 0.00 0.00 33.50 32.97 1ptj n PRO 345 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1ptj n HIS 346 N -0.98 0.00 -3.49 6.00 8.25 -0.24 -4.95 115.22 119.82 1ptj n HIS 346 Ca 0.07 -0.66 -0.42 0.00 -0.26 0.00 0.00 57.72 56.45 1ptj n HIS 346 Cb 0.03 -0.13 -0.05 0.00 1.12 0.00 0.00 29.99 30.97 1ptj n HIS 346 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1ptj s VAL 347 N -1.63 4.95 -0.68 1.59 1.01 -1.17 -2.80 120.40 121.67 1ptj s VAL 347 Ca 0.22 -2.95 -0.29 0.00 0.00 0.00 0.00 61.98 58.95 1ptj s VAL 347 Cb 0.20 -4.08 -0.13 0.00 0.00 0.00 0.00 36.38 32.37 1ptj s VAL 347 CO -0.01 -1.02 2.51 -0.90 0.00 0.00 0.00 175.10 175.68 1ptj n ASP 348 N 3.41 1.50 -3.78 3.32 5.75 -1.23 -4.88 116.55 120.63 1ptj n ASP 348 Ca 0.15 -0.14 -0.41 0.00 -0.01 0.00 0.00 54.79 54.38 1ptj n ASP 348 Cb 0.42 -1.29 -0.02 0.00 -1.03 0.00 0.00 41.12 39.20 1ptj n ASP 348 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1ptj n LYS 349 N 8.72 0.00 -2.43 0.11 4.76 -1.26 -3.33 118.16 124.73 1ptj n LYS 349 Ca 0.49 0.00 -0.38 0.00 -2.87 0.00 0.00 58.31 55.55 1ptj n LYS 349 Cb 0.31 -0.86 -0.03 0.00 -1.84 0.00 0.00 35.03 32.60 1ptj n LYS 349 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ptj s ASP 350 N -0.86 6.12 0.00 4.39 1.01 -1.26 -4.19 116.67 121.87 1ptj s ASP 350 Ca 0.55 -1.04 0.00 0.00 0.71 0.00 0.00 52.55 52.77 1ptj s ASP 350 Cb -0.76 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 40.61 1ptj s ASP 350 CO 0.49 -1.85 0.00 0.41 0.21 0.00 0.00 175.17 174.44 1ptj n THR 351 N 7.01 0.00 -3.43 -1.27 -1.04 -1.21 -5.06 114.28 109.28 1ptj n THR 351 Ca 0.29 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 62.08 1ptj n THR 351 Cb 0.50 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 69.07 1ptj n THR 351 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1ptj n LYS 352 N -0.35 -2.13 -3.74 -2.82 5.02 -1.25 -5.03 118.16 107.87 1ptj n LYS 352 Ca 0.00 0.71 -0.13 0.00 -2.02 0.00 0.00 58.31 56.87 1ptj n LYS 352 Cb 0.00 -5.19 -0.10 0.00 -0.02 0.00 0.00 35.03 29.72 1ptj n LYS 352 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1ptj s THR 353 N -3.43 0.01 -0.04 -0.18 -1.32 -1.26 -4.55 115.64 104.88 1ptj s THR 353 Ca 0.43 -0.12 -0.03 0.00 -1.21 0.00 0.00 61.69 60.77 1ptj s THR 353 Cb -0.10 -0.58 -0.04 0.00 -1.51 0.00 0.00 72.50 70.27 1ptj s THR 353 CO 0.79 -0.07 0.12 -0.76 -2.21 0.00 0.00 174.62 172.50 1ptj s LEU 354 N -0.23 4.15 -0.17 9.08 1.43 -1.26 -3.51 118.68 128.17 1ptj s LEU 354 Ca -0.04 0.29 -0.05 0.00 -1.03 0.00 0.00 54.13 53.30 1ptj s LEU 354 Cb -0.03 -2.32 0.08 0.00 0.03 0.00 0.00 46.19 43.95 1ptj s LEU 354 CO 0.02 0.31 0.34 -0.69 0.23 0.00 0.00 176.35 176.55 1ptj s VAL 355 N -1.18 -0.53 -0.60 -1.59 1.01 -1.12 -5.06 120.40 111.32 1ptj s VAL 355 Ca 0.22 0.19 -0.24 0.00 0.00 0.00 0.00 61.98 62.15 1ptj s VAL 355 Cb -0.12 -0.58 0.05 0.00 0.00 0.00 0.00 36.38 35.73 1ptj s VAL 355 CO 0.13 0.06 0.99 -0.04 0.00 0.00 0.00 175.10 176.24 1ptj s MET 356 N 2.51 3.26 0.00 2.72 -1.94 -1.26 -4.69 119.30 119.89 1ptj s MET 356 Ca 0.01 -0.41 0.00 0.00 -1.71 0.00 0.00 55.69 53.58 1ptj s MET 356 Cb -0.12 -4.12 0.00 0.00 2.01 0.00 0.00 34.83 32.60 1ptj s MET 356 CO -0.11 -1.65 0.00 1.17 -0.01 0.00 0.00 175.02 174.41 1ptj n LYS 357 N 7.75 0.00 0.00 2.03 3.00 -1.26 -4.71 118.16 124.97 1ptj n LYS 357 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1ptj n LYS 357 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.50 1ptj n LYS 357 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1ptj n LEU 358 N -2.18 0.00 0.13 3.14 4.77 -1.26 -4.11 117.00 117.48 1ptj n LEU 358 Ca 0.00 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1ptj n LEU 358 Cb 0.00 0.00 0.28 0.00 -2.33 0.00 0.00 43.42 41.37 1ptj n LEU 358 CO 0.00 0.00 0.68 -0.33 -1.33 0.00 0.00 177.39 176.41 1ptj h GLU 359 N 0.00 0.14 -6.47 3.23 3.07 -2.01 -3.41 114.58 109.14 1ptj h GLU 359 Ca 0.00 -0.06 -0.57 0.00 -0.50 0.00 0.00 59.36 58.23 1ptj h GLU 359 Cb 0.00 -0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 27.86 1ptj h GLU 359 CO 0.00 0.52 1.12 0.34 -1.40 0.00 0.00 179.01 179.59 1ptj s ASP 360 N -6.89 6.24 0.00 1.42 2.15 -1.26 -4.87 116.67 113.45 1ptj s ASP 360 Ca -0.04 0.95 0.00 0.00 0.43 0.00 0.00 52.55 53.90 1ptj s ASP 360 Cb 0.14 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.22 1ptj s ASP 360 CO 0.75 -1.49 0.87 -1.84 -0.17 0.00 0.00 175.17 173.29 1ptj n GLU 361 N 8.15 0.00 0.25 4.34 0.28 -1.26 -0.29 120.64 132.10 1ptj n GLU 361 Ca 0.18 0.37 0.13 0.00 -0.16 0.00 0.00 57.16 57.68 1ptj n GLU 361 Cb 0.48 -1.61 0.53 0.00 1.43 0.00 0.00 31.44 32.26 1ptj n GLU 361 CO 0.00 0.00 0.00 1.15 -0.16 0.00 0.00 177.13 178.12 1ptj h THR 362 N 0.00 0.27 0.00 3.84 2.02 -1.93 -0.59 112.91 116.52 1ptj h THR 362 Ca 0.00 -0.85 -0.33 0.00 0.77 0.00 0.00 66.41 65.99 1ptj h THR 362 Cb 0.23 1.68 -0.06 0.00 -1.74 0.00 0.00 68.15 68.26 1ptj h THR 362 CO 0.00 0.11 -2.32 0.52 0.37 0.00 0.00 175.52 174.20 1ptj n VAL 363 N -3.24 1.26 -0.05 3.16 0.31 0.60 -4.26 118.33 116.11 1ptj n VAL 363 Ca 0.01 -0.82 -0.14 0.00 -0.01 0.00 0.00 64.34 63.37 1ptj n VAL 363 Cb 0.39 -0.44 -0.13 0.00 -0.91 0.00 0.00 33.84 32.75 1ptj n VAL 363 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1ptj h SER 364 N 0.00 0.03 0.19 4.52 4.64 -1.46 -1.87 113.55 119.61 1ptj h SER 364 Ca -0.48 -0.91 0.00 0.00 -0.47 0.00 0.00 61.79 59.93 1ptj h SER 364 Cb 2.12 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 64.20 1ptj h SER 364 CO 0.03 0.94 0.00 0.61 -0.87 0.00 0.00 176.83 177.54 1ptj n GLY 365 N 1.37 -0.62 0.21 -0.77 0.00 -0.24 -3.42 105.19 101.71 1ptj n GLY 365 Ca -0.10 -0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 1ptj n GLY 365 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1ptj n THR 366 N -1.38 0.70 -1.66 2.61 -1.04 -1.23 -4.58 114.28 107.71 1ptj n THR 366 Ca 0.03 -0.24 -0.43 0.00 -2.04 0.00 0.00 64.05 61.37 1ptj n THR 366 Cb 0.07 -1.13 -0.03 0.00 -1.82 0.00 0.00 70.33 67.42 1ptj n THR 366 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1ptj h VAL 368 N 6.82 0.81 -2.44 0.00 2.07 -1.86 -3.46 116.25 118.19 1ptj h VAL 368 Ca -0.42 -2.32 -0.31 0.00 0.82 0.00 0.00 66.70 64.47 1ptj h VAL 368 Cb 1.23 2.49 -0.35 0.00 -1.52 0.00 0.00 31.29 33.14 1ptj h VAL 368 CO 0.96 0.70 -0.62 0.28 0.02 0.00 0.00 177.57 178.91 1ptj s THR 369 N -2.49 -0.35 -0.58 2.57 -1.32 -1.26 -5.01 115.64 107.20 1ptj s THR 369 Ca -0.23 -0.16 0.00 0.00 -1.21 0.00 0.00 61.69 60.09 1ptj s THR 369 Cb 0.06 -0.72 0.44 0.00 -1.51 0.00 0.00 72.50 70.77 1ptj s THR 369 CO 0.72 -0.23 1.80 -2.11 -2.21 0.00 0.00 174.62 172.59 1ptj n ARG 370 N 5.32 2.95 0.00 7.08 1.85 -1.26 -1.70 116.66 130.90 1ptj n ARG 370 Ca -0.05 -3.57 0.03 0.00 -1.00 0.00 0.00 57.85 53.26 1ptj n ARG 370 Cb 0.49 -2.28 0.16 0.00 -1.05 0.00 0.00 32.46 29.78 1ptj n ARG 370 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15