#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1npj s THR 5 N 0.00 3.41 0.34 0.00 -4.23 -1.26 -4.88 115.64 109.02 1npj s THR 5 Ca 0.00 0.46 0.03 0.00 -1.18 0.00 0.00 61.69 61.00 1npj s THR 5 Cb 0.00 -3.42 0.28 0.00 1.34 0.00 0.00 72.50 70.70 1npj s THR 5 CO 0.00 -0.60 1.96 0.00 -0.54 0.00 0.00 174.62 175.44 1npj h ALA 6 N -0.71 1.60 -0.33 3.99 0.00 -2.05 -1.65 119.26 120.10 1npj h ALA 6 Ca -0.45 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.39 1npj h ALA 6 Cb 1.26 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1npj h ALA 6 CO 0.63 0.30 0.05 0.00 0.00 0.00 0.00 179.25 180.24 1npj h ALA 7 N 1.57 0.44 -0.65 0.00 0.00 -1.99 -1.91 119.26 116.72 1npj h ALA 7 Ca 0.31 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1npj h ALA 7 Cb 0.14 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1npj h ALA 7 CO -0.10 0.14 0.30 0.93 0.00 0.00 0.00 179.25 180.51 1npj h GLU 8 N 0.37 0.93 0.01 0.00 5.08 -1.73 -2.31 114.58 116.93 1npj h GLU 8 Ca 0.10 -0.13 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1npj h GLU 8 Cb 0.35 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1npj h GLU 8 CO 0.01 0.73 -0.01 0.82 -1.00 0.00 0.00 179.01 179.56 1npj h ILE 9 N 0.93 1.20 -0.40 3.13 1.08 -1.19 -2.83 117.51 119.42 1npj h ILE 9 Ca 0.23 -0.64 0.12 0.00 -0.39 0.00 0.00 64.86 64.17 1npj h ILE 9 Cb 0.12 1.63 -0.02 0.00 -3.07 0.00 0.00 36.82 35.49 1npj h ILE 9 CO -0.03 0.16 0.33 0.00 -0.69 0.00 0.00 178.15 177.93 1npj h ALA 10 N 0.69 2.24 -0.00 1.87 0.00 -1.07 0.53 119.26 123.51 1npj h ALA 10 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1npj h ALA 10 Cb 0.28 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1npj h ALA 10 CO 0.00 -0.54 -0.20 0.00 0.00 0.00 0.00 179.25 178.52 1npj n ALA 11 N -2.51 2.86 -1.78 0.00 0.00 -0.89 -4.91 120.51 113.27 1npj n ALA 11 Ca 0.07 -0.22 -0.36 0.00 0.00 0.00 0.00 53.44 52.93 1npj n ALA 11 Cb 0.52 -1.32 -0.02 0.00 0.00 0.00 0.00 19.45 18.62 1npj n ALA 11 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1npj s LEU 12 N -2.89 3.97 0.52 0.00 1.43 0.17 -4.99 118.68 116.89 1npj s LEU 12 Ca 0.16 2.10 -0.21 0.00 -1.03 0.00 0.00 54.13 55.15 1npj s LEU 12 Cb 0.19 -4.36 -0.06 0.00 0.03 0.00 0.00 46.19 41.99 1npj s LEU 12 CO 0.58 -0.79 1.17 -2.16 0.23 0.00 0.00 176.35 175.39 1npj s PRO 13 N -2.86 3.41 -0.01 1.29 0.04 -1.26 -4.73 135.00 130.87 1npj s PRO 13 Ca 0.64 1.76 0.02 0.00 0.04 0.00 0.00 61.00 63.46 1npj s PRO 13 Cb -0.22 -2.15 -0.03 0.00 0.04 0.00 0.00 34.50 32.13 1npj s PRO 13 CO 0.27 -0.84 -0.05 1.03 0.04 0.00 0.00 177.00 177.45 1npj s ARG 14 N -3.06 2.64 -0.13 4.56 0.52 -1.26 -1.21 118.95 121.01 1npj s ARG 14 Ca 0.70 -0.67 -0.02 0.00 -0.52 0.00 0.00 55.73 55.22 1npj s ARG 14 Cb -0.28 -2.56 0.04 0.00 0.52 0.00 0.00 34.95 32.67 1npj s ARG 14 CO 0.32 0.62 0.03 -1.14 0.02 0.00 0.00 175.30 175.15 1npj s GLN 15 N -1.39 0.47 -0.25 3.54 0.74 -0.43 -4.95 119.66 117.40 1npj s GLN 15 Ca 0.17 -0.08 -0.25 0.00 0.05 0.00 0.00 55.36 55.25 1npj s GLN 15 Cb -0.11 -1.46 -0.00 0.00 1.10 0.00 0.00 33.01 32.53 1npj s GLN 15 CO 0.08 -0.48 0.86 0.15 -0.55 0.00 0.00 175.29 175.35 1npj s LYS 16 N 1.98 4.18 -0.06 1.67 1.02 -1.26 -0.91 119.74 126.36 1npj s LYS 16 Ca 0.02 0.99 -0.03 0.00 0.02 0.00 0.00 55.97 56.98 1npj s LYS 16 Cb -0.14 -3.65 -0.04 0.00 -0.52 0.00 0.00 37.83 33.48 1npj s LYS 16 CO -0.07 -0.55 0.09 0.08 -0.92 0.00 0.00 175.35 173.98 1npj s VAL 17 N 2.92 4.94 -0.22 3.17 1.01 -0.54 -4.95 120.40 126.73 1npj s VAL 17 Ca 0.36 -0.17 -0.06 0.00 0.00 0.00 0.00 61.98 62.12 1npj s VAL 17 Cb -0.15 -3.19 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 1npj s VAL 17 CO 0.07 0.48 0.03 -1.83 0.00 0.00 0.00 175.10 173.86 1npj s GLU 18 N -1.36 3.63 0.46 2.72 1.03 -1.26 -4.66 118.70 119.26 1npj s GLU 18 Ca 0.19 -0.50 -0.21 0.00 0.03 0.00 0.00 54.97 54.48 1npj s GLU 18 Cb -0.12 -3.19 -0.09 0.00 -0.80 0.00 0.00 34.13 29.93 1npj s GLU 18 CO 0.09 -0.08 1.01 -0.51 -1.33 0.00 0.00 175.26 174.44 1npj s LEU 19 N 1.27 3.89 0.08 1.83 1.43 -1.26 -4.74 118.68 121.18 1npj s LEU 19 Ca 0.04 1.85 0.09 0.00 -1.03 0.00 0.00 54.13 55.09 1npj s LEU 19 Cb -0.15 -4.53 -0.03 0.00 0.03 0.00 0.00 46.19 41.51 1npj s LEU 19 CO 0.02 -0.62 -0.25 0.68 0.23 0.00 0.00 176.35 176.41 1npj s VAL 20 N -2.03 2.06 0.26 -1.59 -7.23 -1.26 -4.99 120.40 105.61 1npj s VAL 20 Ca 0.65 -1.48 -0.30 0.00 -1.81 0.00 0.00 61.98 59.04 1npj s VAL 20 Cb -0.14 -1.79 -0.10 0.00 0.56 0.00 0.00 36.38 34.91 1npj s VAL 20 CO 0.18 0.22 1.43 -1.81 -0.31 0.00 0.00 175.10 174.80 1npj s ASP 21 N -1.53 6.65 0.83 4.85 -0.00 -1.26 -4.64 116.67 121.57 1npj s ASP 21 Ca 0.11 2.69 -0.14 0.00 -0.00 0.00 0.00 52.55 55.21 1npj s ASP 21 Cb -0.10 -2.63 0.03 0.00 -0.00 0.00 0.00 42.92 40.22 1npj s ASP 21 CO 0.03 -0.69 0.71 -2.65 -0.00 0.00 0.00 175.17 172.57 1npj n PRO 22 N 2.08 0.05 -0.00 8.23 -0.02 -1.26 -2.66 135.00 141.41 1npj n PRO 22 Ca 0.06 0.07 0.13 0.00 -2.02 0.00 0.00 63.50 61.74 1npj n PRO 22 Cb 0.40 -2.04 0.78 0.00 -0.02 0.00 0.00 33.50 32.62 1npj n PRO 22 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1npj n PRO 23 N -1.93 1.04 -1.82 0.52 -0.04 -1.26 -5.06 135.00 126.46 1npj n PRO 23 Ca 0.10 -0.06 -0.31 0.00 -0.04 0.00 0.00 63.50 63.19 1npj n PRO 23 Cb 0.51 -1.42 0.03 0.00 -0.04 0.00 0.00 33.50 32.58 1npj n PRO 23 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1npj s PHE 24 N -2.00 3.21 -0.05 0.54 0.40 -1.09 -0.31 117.98 118.69 1npj s PHE 24 Ca 0.40 1.42 0.04 0.00 -0.60 0.00 0.00 56.93 58.19 1npj s PHE 24 Cb 0.19 -2.87 0.00 0.00 0.51 0.00 0.00 43.02 40.84 1npj s PHE 24 CO 0.31 -1.02 -0.15 0.08 0.70 0.00 0.00 175.22 175.13 1npj s VAL 25 N -2.89 1.31 0.76 -0.44 1.01 -1.26 -4.65 120.40 114.24 1npj s VAL 25 Ca 0.59 -0.64 -0.16 0.00 0.00 0.00 0.00 61.98 61.77 1npj s VAL 25 Cb -0.14 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.08 1npj s VAL 25 CO 0.48 0.38 0.50 0.00 0.00 0.00 0.00 175.10 176.47 1npj n HIS 26 N 3.27 -0.93 -1.72 5.22 1.44 -1.26 -4.87 115.22 116.38 1npj n HIS 26 Ca -0.19 0.33 -0.40 0.00 -2.01 0.00 0.00 57.72 55.45 1npj n HIS 26 Cb 0.53 -1.89 0.02 0.00 0.12 0.00 0.00 29.99 28.76 1npj n HIS 26 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1npj n ALA 27 N -2.56 1.49 -3.78 1.59 0.00 -1.26 -4.97 120.51 111.02 1npj n ALA 27 Ca 0.09 0.24 -0.02 0.00 0.00 0.00 0.00 53.44 53.76 1npj n ALA 27 Cb 0.50 -2.30 -0.00 0.00 0.00 0.00 0.00 19.45 17.65 1npj n ALA 27 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 1npj s HIS 28 N -1.21 -0.04 -0.11 0.00 -3.43 -1.26 -5.01 115.29 104.23 1npj s HIS 28 Ca 0.62 -0.25 0.03 0.00 -0.80 0.00 0.00 55.06 54.66 1npj s HIS 28 Cb -0.48 0.64 -0.00 0.00 -1.43 0.00 0.00 32.58 31.31 1npj s HIS 28 CO 0.57 -0.74 -0.22 0.45 -2.00 0.00 0.00 174.74 172.80 1npj s SER 29 N -3.14 3.27 0.16 7.38 0.15 -1.26 -5.02 113.70 115.24 1npj s SER 29 Ca 0.16 -0.52 -0.15 0.00 0.70 0.00 0.00 55.95 56.15 1npj s SER 29 Cb -0.01 -1.45 0.07 0.00 -1.71 0.00 0.00 66.02 62.93 1npj s SER 29 CO 0.02 0.16 1.78 1.56 1.20 0.00 0.00 173.24 177.96 1npj h GLN 30 N 6.72 0.40 -5.90 5.44 4.20 -1.97 -3.40 115.11 120.60 1npj h GLN 30 Ca -0.21 -0.02 -0.58 0.00 0.06 0.00 0.00 58.65 57.90 1npj h GLN 30 Cb 1.23 -0.09 -0.07 0.00 0.30 0.00 0.00 27.48 28.86 1npj h GLN 30 CO 0.49 0.26 -0.13 0.08 -0.67 0.00 0.00 178.83 178.86 1npj s VAL 31 N -6.15 5.07 0.12 -0.54 1.01 -1.26 -3.45 120.40 115.19 1npj s VAL 31 Ca -0.13 0.97 -0.34 0.00 0.00 0.00 0.00 61.98 62.49 1npj s VAL 31 Cb 0.12 -3.81 -0.13 0.00 0.00 0.00 0.00 36.38 32.56 1npj s VAL 31 CO 0.72 0.43 1.64 0.00 0.00 0.00 0.00 175.10 177.90 1npj n ALA 32 N 2.85 1.34 -3.12 5.51 0.00 0.26 -4.91 120.51 122.44 1npj n ALA 32 Ca -0.09 0.41 -0.45 0.00 0.00 0.00 0.00 53.44 53.31 1npj n ALA 32 Cb 0.52 -2.39 -0.01 0.00 0.00 0.00 0.00 19.45 17.56 1npj n ALA 32 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1npj s GLU 33 N 1.54 3.83 0.00 0.00 2.02 -1.26 -4.93 118.70 119.89 1npj s GLU 33 Ca 0.81 -2.42 0.00 0.00 0.02 0.00 0.00 54.97 53.38 1npj s GLU 33 Cb -0.67 -4.75 0.00 0.00 0.10 0.00 0.00 34.13 28.81 1npj s GLU 33 CO 0.40 -1.54 0.00 0.41 0.02 0.00 0.00 175.26 174.55 1npj n GLY 34 N 4.23 0.22 1.84 -1.39 0.00 -1.26 -5.03 105.19 103.79 1npj n GLY 34 Ca 0.24 -1.97 -0.16 0.00 0.00 0.00 0.00 46.02 44.13 1npj n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1npj n GLY 35 N 0.13 -3.06 3.72 -0.02 0.00 -1.26 -4.95 105.19 99.75 1npj n GLY 35 Ca 0.00 -1.40 -0.42 0.00 0.00 0.00 0.00 46.02 44.20 1npj n GLY 35 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1npj n PRO 36 N -3.58 2.31 -4.22 1.61 -0.02 -1.26 -5.02 135.00 124.82 1npj n PRO 36 Ca 0.08 0.81 -0.15 0.00 -2.02 0.00 0.00 63.50 62.22 1npj n PRO 36 Cb 0.32 -2.45 -0.09 0.00 -0.02 0.00 0.00 33.50 31.26 1npj n PRO 36 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1npj s LYS 37 N -1.76 1.48 -0.35 -0.52 -2.85 -1.26 -4.43 119.74 110.06 1npj s LYS 37 Ca 0.56 -1.77 -0.11 0.00 -1.00 0.00 0.00 55.97 53.65 1npj s LYS 37 Cb -0.54 0.31 0.00 0.00 -2.06 0.00 0.00 37.83 35.54 1npj s LYS 37 CO 0.61 -0.53 0.20 0.08 0.10 0.00 0.00 175.35 175.81 1npj s VAL 38 N -3.80 4.76 -0.21 1.79 1.01 -0.35 -0.99 120.40 122.61 1npj s VAL 38 Ca 0.38 -0.55 -0.16 0.00 0.00 0.00 0.00 61.98 61.66 1npj s VAL 38 Cb 0.04 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 1npj s VAL 38 CO 0.19 -0.08 0.39 -0.69 0.00 0.00 0.00 175.10 174.91 1npj s VAL 39 N 1.62 5.19 -0.17 2.92 1.01 0.58 -1.31 120.40 130.25 1npj s VAL 39 Ca 0.04 0.69 -0.08 0.00 0.00 0.00 0.00 61.98 62.63 1npj s VAL 39 Cb -0.18 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1npj s VAL 39 CO 0.07 0.24 0.10 -1.61 0.00 0.00 0.00 175.10 173.91 1npj s GLU 40 N 1.41 3.86 0.07 2.72 2.02 -0.09 -1.02 118.70 127.68 1npj s GLU 40 Ca 0.18 -0.24 0.04 0.00 0.02 0.00 0.00 54.97 54.97 1npj s GLU 40 Cb -0.15 -3.26 -0.03 0.00 0.10 0.00 0.00 34.13 30.79 1npj s GLU 40 CO 0.08 0.44 -0.11 -0.06 0.02 0.00 0.00 175.26 175.63 1npj s PHE 41 N -0.07 1.02 -0.01 1.61 0.40 -0.41 -1.46 117.98 119.05 1npj s PHE 41 Ca 0.09 -0.54 0.02 0.00 -0.60 0.00 0.00 56.93 55.90 1npj s PHE 41 Cb -0.12 -0.57 -0.00 0.00 0.51 0.00 0.00 43.02 42.84 1npj s PHE 41 CO 0.00 0.00 -0.08 0.99 0.70 0.00 0.00 175.22 176.83 1npj s THR 42 N -1.72 0.68 -0.05 0.64 2.01 -1.26 -0.59 115.64 115.35 1npj s THR 42 Ca -0.01 -0.34 -0.02 0.00 0.31 0.00 0.00 61.69 61.62 1npj s THR 42 Cb -0.07 -0.59 0.03 0.00 0.01 0.00 0.00 72.50 71.88 1npj s THR 42 CO 0.01 0.20 0.11 -0.04 -0.69 0.00 0.00 174.62 174.22 1npj s MET 43 N -0.01 0.07 -0.18 4.92 -1.94 -0.36 -4.90 119.30 116.89 1npj s MET 43 Ca 0.00 0.29 -0.08 0.00 -1.71 0.00 0.00 55.69 54.19 1npj s MET 43 Cb -0.06 -0.15 -0.04 0.00 2.01 0.00 0.00 34.83 36.59 1npj s MET 43 CO -0.00 -0.14 0.07 0.08 -0.01 0.00 0.00 175.02 175.02 1npj s VAL 44 N 0.94 4.89 -0.03 -6.03 1.01 -1.26 -0.96 120.40 118.94 1npj s VAL 44 Ca -0.07 -0.00 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 1npj s VAL 44 Cb -0.10 -3.20 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 1npj s VAL 44 CO -0.04 0.47 0.98 -0.63 0.00 0.00 0.00 175.10 175.87 1npj s ILE 45 N 0.29 4.85 -0.20 2.22 -1.09 0.71 -1.16 121.20 126.82 1npj s ILE 45 Ca 0.04 2.03 0.01 0.00 -2.23 0.00 0.00 60.65 60.51 1npj s ILE 45 Cb -0.12 -4.31 0.04 0.00 -1.58 0.00 0.00 42.46 36.49 1npj s ILE 45 CO -0.00 0.12 -0.15 -1.61 -1.23 0.00 0.00 174.94 172.07 1npj s GLU 46 N 1.30 2.50 -0.48 2.79 0.41 -0.23 -4.32 118.70 120.66 1npj s GLU 46 Ca 0.50 -0.95 -0.21 0.00 -0.41 0.00 0.00 54.97 53.91 1npj s GLU 46 Cb -0.20 -2.58 0.04 0.00 -1.78 0.00 0.00 34.13 29.61 1npj s GLU 46 CO 0.25 -0.36 0.68 -1.21 -0.49 0.00 0.00 175.26 174.12 1npj s GLU 47 N 1.28 3.22 0.11 1.61 2.02 -1.26 -1.18 118.70 124.50 1npj s GLU 47 Ca -0.00 -0.57 -0.02 0.00 0.02 0.00 0.00 54.97 54.40 1npj s GLU 47 Cb -0.16 -4.02 -0.04 0.00 0.10 0.00 0.00 34.13 30.01 1npj s GLU 47 CO -0.10 -1.16 0.06 -1.59 0.02 0.00 0.00 175.26 172.49 1npj s LYS 48 N 2.89 0.86 0.08 1.61 -2.85 -0.69 -4.98 119.74 116.66 1npj s LYS 48 Ca 0.21 -1.34 -0.23 0.00 -1.00 0.00 0.00 55.97 53.60 1npj s LYS 48 Cb -0.16 0.25 -0.06 0.00 -2.06 0.00 0.00 37.83 35.80 1npj s LYS 48 CO 0.16 -0.23 0.71 0.15 0.10 0.00 0.00 175.35 176.24 1npj s LYS 49 N -4.00 4.45 0.06 1.78 1.02 -1.26 -0.45 119.74 121.33 1npj s LYS 49 Ca 0.18 0.99 0.05 0.00 0.02 0.00 0.00 55.97 57.22 1npj s LYS 49 Cb 0.07 -3.31 -0.03 0.00 -0.52 0.00 0.00 37.83 34.05 1npj s LYS 49 CO -0.02 0.44 -0.15 0.96 -0.92 0.00 0.00 175.35 175.66 1npj s ILE 50 N -0.56 1.18 -0.26 2.17 -4.36 -0.62 -4.92 121.20 113.84 1npj s ILE 50 Ca 0.35 -1.16 -0.09 0.00 -0.26 0.00 0.00 60.65 59.49 1npj s ILE 50 Cb -0.21 -1.09 -0.04 0.00 1.25 0.00 0.00 42.46 42.37 1npj s ILE 50 CO 0.22 -0.07 0.13 -0.69 0.24 0.00 0.00 174.94 174.77 1npj s VAL 51 N -1.02 4.84 -1.85 8.37 1.01 -1.26 -1.50 120.40 128.99 1npj s VAL 51 Ca 0.01 0.01 0.23 0.00 0.00 0.00 0.00 61.98 62.22 1npj s VAL 51 Cb -0.09 -3.28 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 1npj s VAL 51 CO 0.02 0.31 1.10 2.30 0.00 0.00 0.00 175.10 178.83 1npj n ILE 52 N 4.82 0.00 -4.01 2.22 -6.64 -0.09 -4.82 119.36 110.85 1npj n ILE 52 Ca -0.15 -0.21 -0.11 0.00 -1.77 0.00 0.00 62.75 60.51 1npj n ILE 52 Cb 0.52 1.15 -0.04 0.00 -1.44 0.00 0.00 39.64 39.82 1npj n ILE 52 CO 0.00 0.00 0.00 1.51 -1.77 0.00 0.00 176.55 176.29 1npj s ASP 53 N -2.57 0.20 0.00 7.28 3.84 -1.26 -0.66 116.67 123.51 1npj s ASP 53 Ca 0.17 -1.12 0.20 0.00 -0.00 0.00 0.00 52.55 51.80 1npj s ASP 53 Cb 0.18 0.63 1.18 0.00 -1.38 0.00 0.00 42.92 43.53 1npj s ASP 53 CO 0.62 -1.23 1.68 -0.90 -0.00 0.00 0.00 175.17 175.34 1npj n ASP 54 N -0.76 0.00 -0.93 2.11 5.68 -1.26 -2.42 116.55 118.98 1npj n ASP 54 Ca -0.01 -1.14 0.11 0.00 -0.50 0.00 0.00 54.79 53.25 1npj n ASP 54 Cb 0.62 0.00 0.27 0.00 -1.14 0.00 0.00 41.12 40.87 1npj n ASP 54 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1npj n ALA 55 N -0.85 2.46 -1.76 2.12 0.00 -1.26 -4.92 120.51 116.29 1npj n ALA 55 Ca 0.15 -0.81 -0.05 0.00 0.00 0.00 0.00 53.44 52.73 1npj n ALA 55 Cb 0.07 -0.95 -0.01 0.00 0.00 0.00 0.00 19.45 18.56 1npj n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1npj n GLY 56 N 1.36 0.37 3.74 0.00 0.00 -1.01 -4.99 105.19 104.66 1npj n GLY 56 Ca 0.18 -0.73 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 1npj n GLY 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1npj s THR 57 N -2.23 3.20 0.15 2.61 2.01 -1.26 -4.91 115.64 115.21 1npj s THR 57 Ca 0.00 0.99 0.07 0.00 0.31 0.00 0.00 61.69 63.06 1npj s THR 57 Cb 0.00 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.83 1npj s THR 57 CO 0.00 0.15 -0.04 -1.61 -0.69 0.00 0.00 174.62 172.44 1npj s GLU 58 N -0.19 2.31 0.00 4.92 2.02 -1.26 -0.91 118.70 125.60 1npj s GLU 58 Ca 0.56 -1.07 0.01 0.00 0.02 0.00 0.00 54.97 54.49 1npj s GLU 58 Cb -0.36 -2.34 -0.00 0.00 0.10 0.00 0.00 34.13 31.52 1npj s GLU 58 CO 0.39 0.48 -0.03 0.08 0.02 0.00 0.00 175.26 176.20 1npj s VAL 59 N -1.55 0.19 -0.73 2.63 1.01 -0.56 -4.94 120.40 116.45 1npj s VAL 59 Ca 0.25 -0.18 -0.21 0.00 0.00 0.00 0.00 61.98 61.85 1npj s VAL 59 Cb -0.10 -0.18 0.09 0.00 0.00 0.00 0.00 36.38 36.19 1npj s VAL 59 CO 0.17 0.01 0.98 -1.00 0.00 0.00 0.00 175.10 175.26 1npj s HIS 60 N -0.17 2.83 0.46 5.22 3.76 -1.26 -1.58 115.29 124.55 1npj s HIS 60 Ca -0.00 -0.83 -0.20 0.00 -0.15 0.00 0.00 55.06 53.88 1npj s HIS 60 Cb -0.02 -4.26 -0.10 0.00 1.11 0.00 0.00 32.58 29.31 1npj s HIS 60 CO -0.00 -1.57 0.97 0.00 -0.85 0.00 0.00 174.74 173.29 1npj s ALA 61 N 3.54 3.02 -0.39 -1.40 0.00 0.41 -4.85 121.76 122.09 1npj s ALA 61 Ca 0.24 0.35 0.02 0.00 0.00 0.00 0.00 51.96 52.58 1npj s ALA 61 Cb -0.14 -3.15 0.11 0.00 0.00 0.00 0.00 23.12 19.94 1npj s ALA 61 CO 0.04 -0.04 0.15 -1.64 0.00 0.00 0.00 175.76 174.28 1npj s MET 62 N -3.46 1.35 -0.17 0.00 -1.94 -0.83 -1.70 119.30 112.53 1npj s MET 62 Ca 0.62 -1.87 -0.03 0.00 -1.71 0.00 0.00 55.69 52.70 1npj s MET 62 Cb -0.10 -2.72 -0.01 0.00 2.01 0.00 0.00 34.83 34.01 1npj s MET 62 CO 0.19 -1.04 -0.07 0.00 -0.01 0.00 0.00 175.02 174.09 1npj s ALA 63 N 0.69 2.79 0.05 3.03 0.00 -0.33 -2.23 121.76 125.76 1npj s ALA 63 Ca 0.14 -0.99 -0.31 0.00 0.00 0.00 0.00 51.96 50.80 1npj s ALA 63 Cb -0.21 -1.50 -0.06 0.00 0.00 0.00 0.00 23.12 21.34 1npj s ALA 63 CO -0.08 -0.05 1.40 -0.06 0.00 0.00 0.00 175.76 176.96 1npj s PHE 64 N 0.84 2.99 -1.66 0.00 0.08 -1.25 -1.07 117.98 117.91 1npj s PHE 64 Ca -0.02 0.86 0.00 0.00 0.12 0.00 0.00 56.93 57.89 1npj s PHE 64 Cb -0.15 -3.67 0.00 0.00 -0.57 0.00 0.00 43.02 38.63 1npj s PHE 64 CO 0.01 -2.44 0.00 -1.71 -0.10 0.00 0.00 175.22 170.98 1npj n ASN 65 N 4.82 -5.31 -0.00 1.36 5.15 -0.31 -2.62 115.26 118.35 1npj n ASN 65 Ca 0.12 0.39 -0.00 0.00 -0.60 0.00 0.00 54.58 54.49 1npj n ASN 65 Cb 0.43 -4.19 -0.00 0.00 -0.53 0.00 0.00 39.78 35.49 1npj n ASN 65 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1npj n GLY 66 N -0.49 0.45 3.25 8.20 0.00 -0.98 -4.92 105.19 110.71 1npj n GLY 66 Ca -0.16 -0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.72 1npj n GLY 66 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1npj s THR 67 N -1.91 0.88 -0.19 2.61 -4.23 -1.08 -4.96 115.64 106.77 1npj s THR 67 Ca 0.00 -2.01 -0.01 0.00 -1.18 0.00 0.00 61.69 58.49 1npj s THR 67 Cb 0.00 -2.03 0.05 0.00 1.34 0.00 0.00 72.50 71.86 1npj s THR 67 CO 0.00 -0.57 -0.02 -0.69 -0.54 0.00 0.00 174.62 172.80 1npj s VAL 68 N -3.52 0.98 0.98 2.29 1.01 -1.26 -3.20 120.40 117.67 1npj s VAL 68 Ca 0.21 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.32 1npj s VAL 68 Cb 0.05 -1.29 0.18 0.00 0.00 0.00 0.00 36.38 35.32 1npj s VAL 68 CO 0.03 -0.04 1.18 -2.16 0.00 0.00 0.00 175.10 174.11 1npj s PRO 69 N 1.67 0.59 0.97 2.72 0.04 -1.26 -1.84 135.00 137.87 1npj s PRO 69 Ca -0.01 0.02 -0.12 0.00 0.04 0.00 0.00 61.00 60.93 1npj s PRO 69 Cb -0.17 -1.80 0.17 0.00 0.04 0.00 0.00 34.50 32.74 1npj s PRO 69 CO -0.07 -2.52 1.09 0.20 0.04 0.00 0.00 177.00 175.73 1npj s GLY 70 N -4.27 1.60 0.78 0.56 0.00 -0.01 -4.74 107.32 101.24 1npj s GLY 70 Ca 0.68 -0.06 -0.11 0.00 0.00 0.00 0.00 44.72 45.22 1npj s GLY 70 CO 0.53 0.48 1.11 2.56 0.00 0.00 0.00 173.10 177.78 1npj s PRO 71 N -4.82 2.14 -0.12 2.90 0.04 -1.26 -4.54 135.00 129.33 1npj s PRO 71 Ca 0.65 1.27 -0.21 0.00 0.04 0.00 0.00 61.00 62.75 1npj s PRO 71 Cb -0.20 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 1npj s PRO 71 CO 0.59 -1.75 0.63 -1.17 0.04 0.00 0.00 177.00 175.33 1npj s LEU 72 N -5.86 4.25 -0.16 -3.56 2.96 -1.26 -4.29 118.68 110.76 1npj s LEU 72 Ca 0.63 0.98 -0.06 0.00 -0.22 0.00 0.00 54.13 55.46 1npj s LEU 72 Cb -0.19 -2.93 -0.04 0.00 0.50 0.00 0.00 46.19 43.53 1npj s LEU 72 CO 0.54 -0.14 0.05 -0.04 -1.32 0.00 0.00 176.35 175.44 1npj s MET 73 N 1.14 3.78 -0.10 1.98 -1.94 -1.16 -4.60 119.30 118.40 1npj s MET 73 Ca 0.32 -0.34 0.03 0.00 -1.71 0.00 0.00 55.69 53.98 1npj s MET 73 Cb -0.16 -3.14 -0.01 0.00 2.01 0.00 0.00 34.83 33.53 1npj s MET 73 CO 0.14 0.37 -0.21 0.08 -0.01 0.00 0.00 175.02 175.39 1npj s VAL 74 N 0.08 2.35 0.24 -6.03 1.01 -1.26 -0.17 120.40 116.62 1npj s VAL 74 Ca 0.05 -0.92 0.04 0.00 0.00 0.00 0.00 61.98 61.15 1npj s VAL 74 Cb -0.12 -1.92 -0.01 0.00 0.00 0.00 0.00 36.38 34.32 1npj s VAL 74 CO 0.01 0.55 0.23 1.33 0.00 0.00 0.00 175.10 177.23 1npj n VAL 75 N 3.43 0.00 -4.45 2.92 0.24 -0.60 -4.98 118.33 114.89 1npj n VAL 75 Ca -0.19 -1.62 -0.25 0.00 -2.04 0.00 0.00 64.34 60.25 1npj n VAL 75 Cb 0.53 0.84 -0.10 0.00 -1.47 0.00 0.00 33.84 33.65 1npj n VAL 75 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1npj s HIS 76 N -3.08 2.41 0.16 6.34 3.76 -1.26 -1.47 115.29 122.15 1npj s HIS 76 Ca 0.27 -0.39 -0.34 0.00 -0.15 0.00 0.00 55.06 54.45 1npj s HIS 76 Cb 0.01 -1.22 -0.14 0.00 1.11 0.00 0.00 32.58 32.34 1npj s HIS 76 CO 0.19 0.63 1.51 0.94 -0.85 0.00 0.00 174.74 177.16 1npj n GLN 77 N -0.76 1.99 -1.00 1.40 7.27 0.40 -1.79 117.38 124.89 1npj n GLN 77 Ca -0.05 0.72 0.00 0.00 0.07 0.00 0.00 57.00 57.74 1npj n GLN 77 Cb 0.61 -2.45 0.00 0.00 2.41 0.00 0.00 30.24 30.82 1npj n GLN 77 CO 0.00 0.00 0.00 -0.25 0.07 0.00 0.00 177.06 176.88 1npj n ASP 78 N 3.07 -3.27 -4.68 1.69 10.43 0.14 -4.74 116.55 119.20 1npj n ASP 78 Ca 0.16 0.00 -0.26 0.00 2.57 0.00 0.00 54.79 57.26 1npj n ASP 78 Cb 0.28 -0.86 0.11 0.00 1.84 0.00 0.00 41.12 42.48 1npj n ASP 78 CO 0.00 0.00 0.00 -1.81 -1.07 0.00 0.00 177.20 174.32 1npj s ASP 79 N -2.03 4.31 -0.01 -2.24 -0.00 -0.74 -4.66 116.67 111.30 1npj s ASP 79 Ca 0.00 0.20 0.06 0.00 -0.00 0.00 0.00 52.55 52.81 1npj s ASP 79 Cb 0.00 -0.64 -0.03 0.00 -0.00 0.00 0.00 42.92 42.25 1npj s ASP 79 CO 0.00 -1.92 -0.19 -0.31 -0.00 0.00 0.00 175.17 172.75 1npj s TYR 80 N -3.36 2.55 -0.24 4.23 1.51 -0.16 -1.70 117.35 120.17 1npj s TYR 80 Ca 0.65 -0.27 -0.04 0.00 -1.01 0.00 0.00 57.07 56.40 1npj s TYR 80 Cb -0.08 -1.54 -0.00 0.00 -0.11 0.00 0.00 41.96 40.23 1npj s TYR 80 CO 0.46 0.15 -0.02 -1.17 -1.11 0.00 0.00 175.55 173.86 1npj s LEU 81 N -0.93 3.10 -0.29 -1.29 0.20 -0.30 -0.31 118.68 118.86 1npj s LEU 81 Ca 0.12 -0.48 -0.04 0.00 0.69 0.00 0.00 54.13 54.42 1npj s LEU 81 Cb -0.10 -1.76 0.03 0.00 -0.43 0.00 0.00 46.19 43.92 1npj s LEU 81 CO 0.02 -0.06 0.02 -0.70 -0.29 0.00 0.00 176.35 175.34 1npj s GLU 82 N 1.47 2.75 -0.16 1.98 2.12 -0.19 -2.00 118.70 124.68 1npj s GLU 82 Ca 0.05 -1.06 -0.06 0.00 0.36 0.00 0.00 54.97 54.26 1npj s GLU 82 Cb -0.15 -3.23 -0.04 0.00 0.26 0.00 0.00 34.13 30.98 1npj s GLU 82 CO -0.02 -0.52 0.04 -1.17 -0.54 0.00 0.00 175.26 173.05 1npj s LEU 83 N 1.36 3.73 -0.39 2.70 0.20 0.90 -1.29 118.68 125.89 1npj s LEU 83 Ca -0.01 0.09 -0.10 0.00 0.69 0.00 0.00 54.13 54.79 1npj s LEU 83 Cb -0.18 -1.92 0.04 0.00 -0.43 0.00 0.00 46.19 43.71 1npj s LEU 83 CO -0.00 0.22 0.23 -0.89 -0.29 0.00 0.00 176.35 175.62 1npj s THR 84 N 0.06 4.47 -0.20 3.68 2.01 0.24 -1.13 115.64 124.76 1npj s THR 84 Ca 0.04 -1.04 -0.07 0.00 0.31 0.00 0.00 61.69 60.93 1npj s THR 84 Cb -0.12 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.77 1npj s THR 84 CO 0.01 -0.33 0.07 -0.22 -0.69 0.00 0.00 174.62 173.46 1npj s LEU 85 N 1.51 3.69 -0.11 4.42 2.96 -0.38 -1.23 118.68 129.55 1npj s LEU 85 Ca 0.02 -0.02 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 1npj s LEU 85 Cb -0.21 -1.95 -0.00 0.00 0.50 0.00 0.00 46.19 44.53 1npj s LEU 85 CO 0.05 0.10 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.34 1npj s ILE 86 N 0.79 2.30 -0.50 6.68 1.01 -0.14 -1.66 121.20 129.69 1npj s ILE 86 Ca 0.03 -0.93 -0.04 0.00 0.00 0.00 0.00 60.65 59.72 1npj s ILE 86 Cb -0.13 -1.91 0.13 0.00 0.01 0.00 0.00 42.46 40.56 1npj s ILE 86 CO 0.02 0.55 0.32 0.21 0.00 0.00 0.00 174.94 176.04 1npj s ASN 87 N 0.39 5.35 0.56 3.58 2.47 -0.52 -0.20 114.94 126.57 1npj s ASN 87 Ca -0.16 -2.31 -0.19 0.00 0.42 0.00 0.00 52.86 50.62 1npj s ASN 87 Cb -0.17 -1.87 -0.07 0.00 -1.45 0.00 0.00 41.25 37.69 1npj s ASN 87 CO 0.07 -0.51 0.83 -2.65 -3.72 0.00 0.00 177.10 171.13 1npj n PRO 88 N 4.24 0.84 0.25 0.43 -0.02 -1.26 0.92 135.00 140.39 1npj n PRO 88 Ca 0.01 0.32 0.17 0.00 -2.02 0.00 0.00 63.50 61.98 1npj n PRO 88 Cb 0.40 -2.00 0.79 0.00 -0.02 0.00 0.00 33.50 32.67 1npj n PRO 88 CO 0.00 0.00 0.00 1.05 1.98 0.00 0.00 175.50 178.53 1npj h GLU 89 N 0.57 0.00 0.00 -0.52 4.11 -1.89 -1.16 114.58 115.68 1npj h GLU 89 Ca -0.47 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 58.94 1npj h GLU 89 Cb 1.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.62 1npj h GLU 89 CO 0.51 0.00 -0.10 1.79 0.07 0.00 0.00 179.01 181.28 1npj h THR 90 N 0.00 0.24 -4.36 -1.06 1.35 -1.95 -3.44 112.91 103.69 1npj h THR 90 Ca 0.00 -0.81 -0.48 0.00 -0.55 0.00 0.00 66.41 64.57 1npj h THR 90 Cb 0.24 1.66 0.11 0.00 -1.73 0.00 0.00 68.15 68.43 1npj h THR 90 CO 0.00 0.10 0.36 0.20 -0.25 0.00 0.00 175.52 175.92 1npj s ASN 91 N -5.95 4.57 0.00 5.36 0.01 -0.44 -5.01 114.94 113.49 1npj s ASN 91 Ca 0.01 1.16 0.02 0.00 -0.71 0.00 0.00 52.86 53.35 1npj s ASN 91 Cb 0.09 -1.87 -0.00 0.00 0.41 0.00 0.00 41.25 39.88 1npj s ASN 91 CO 0.59 -1.90 0.36 0.35 -1.51 0.00 0.00 177.10 174.99 1npj n THR 92 N -3.37 0.00 -4.35 1.60 -2.24 -1.26 -4.76 114.28 99.90 1npj n THR 92 Ca 0.07 -0.47 -0.20 0.00 -2.27 0.00 0.00 64.05 61.17 1npj n THR 92 Cb 0.57 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.73 1npj n THR 92 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1npj s LEU 93 N -1.10 2.51 0.32 3.22 1.43 -1.26 -4.95 118.68 118.85 1npj s LEU 93 Ca 0.02 -0.96 -0.24 0.00 -1.03 0.00 0.00 54.13 51.92 1npj s LEU 93 Cb 0.02 -0.77 -0.10 0.00 0.03 0.00 0.00 46.19 45.37 1npj s LEU 93 CO 0.06 -0.10 0.91 -0.32 0.23 0.00 0.00 176.35 177.14 1npj s MET 94 N -3.29 4.49 0.12 1.70 -2.45 -1.26 -4.24 119.30 114.36 1npj s MET 94 Ca 0.20 1.23 -0.01 0.00 -1.25 0.00 0.00 55.69 55.86 1npj s MET 94 Cb -0.03 -2.73 -0.04 0.00 1.25 0.00 0.00 34.83 33.28 1npj s MET 94 CO 0.07 0.26 0.05 -1.01 1.05 0.00 0.00 175.02 175.44 1npj s HIS 95 N -1.67 0.78 0.00 4.11 0.09 -0.91 -4.91 115.29 112.77 1npj s HIS 95 Ca 0.51 -1.18 0.00 0.00 -0.00 0.00 0.00 55.06 54.38 1npj s HIS 95 Cb -0.17 -0.44 0.00 0.00 -0.00 0.00 0.00 32.58 31.96 1npj s HIS 95 CO 0.22 -0.51 0.00 0.27 -0.00 0.00 0.00 174.74 174.72 1npj n ASN 96 N -0.07 0.00 -3.73 1.40 6.94 -1.26 -0.74 115.26 117.80 1npj n ASN 96 Ca -0.07 -0.90 -0.12 0.00 -0.02 0.00 0.00 54.58 53.47 1npj n ASN 96 Cb 0.63 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.93 1npj n ASN 96 CO 0.00 0.00 0.00 -0.51 -1.03 0.00 0.00 177.26 175.72 1npj s ILE 97 N -2.88 -0.03 -0.23 1.53 1.10 -1.26 -4.24 121.20 115.19 1npj s ILE 97 Ca 0.00 0.10 -0.01 0.00 -0.51 0.00 0.00 60.65 60.23 1npj s ILE 97 Cb 0.00 -0.43 0.02 0.00 0.15 0.00 0.00 42.46 42.20 1npj s ILE 97 CO 0.00 0.04 -0.09 -0.62 -2.11 0.00 0.00 174.94 172.16 1npj s ASP 98 N 0.99 4.08 -0.32 4.50 -1.08 -0.42 -1.36 116.67 123.06 1npj s ASP 98 Ca -0.07 -0.79 -0.15 0.00 -0.52 0.00 0.00 52.55 51.02 1npj s ASP 98 Cb -0.08 -1.63 -0.02 0.00 -1.46 0.00 0.00 42.92 39.73 1npj s ASP 98 CO -0.07 -0.09 0.35 -0.36 0.52 0.00 0.00 175.17 175.53 1npj s PHE 99 N 1.33 3.22 0.19 -5.34 0.40 0.78 -1.41 117.98 117.15 1npj s PHE 99 Ca 0.01 0.08 0.35 0.00 -0.60 0.00 0.00 56.93 56.77 1npj s PHE 99 Cb -0.16 -2.64 1.70 0.00 0.51 0.00 0.00 43.02 42.44 1npj s PHE 99 CO -0.06 -0.37 2.05 0.45 0.70 0.00 0.00 175.22 177.98 1npj h HIS 100 N 8.40 0.00 0.00 0.36 3.86 -1.49 -0.84 115.15 125.44 1npj h HIS 100 Ca -0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.91 1npj h HIS 100 Cb 1.15 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.62 1npj h HIS 100 CO 0.71 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.50 1npj h ALA 101 N 2.04 1.00 -2.26 2.45 0.00 -1.90 -3.47 119.26 117.12 1npj h ALA 101 Ca 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 54.91 54.43 1npj h ALA 101 Cb 0.22 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.03 1npj h ALA 101 CO 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 179.25 179.15 1npj s ALA 102 N -3.15 3.61 -0.18 0.00 0.00 -0.32 -4.66 121.76 117.06 1npj s ALA 102 Ca 0.09 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.28 1npj s ALA 102 Cb 0.09 -2.25 0.02 0.00 0.00 0.00 0.00 23.12 20.98 1npj s ALA 102 CO 0.63 -0.12 -0.20 0.99 0.00 0.00 0.00 175.76 177.07 1npj s THR 103 N -2.44 2.03 0.00 0.00 2.01 -1.26 -4.64 115.64 111.34 1npj s THR 103 Ca 0.42 -0.92 0.00 0.00 0.31 0.00 0.00 61.69 61.50 1npj s THR 103 Cb -0.10 -1.84 0.00 0.00 0.01 0.00 0.00 72.50 70.58 1npj s THR 103 CO 0.39 0.54 0.00 0.61 -0.69 0.00 0.00 174.62 175.46 1npj n GLY 104 N 4.61 2.78 4.14 4.40 0.00 -1.26 -4.92 105.19 114.94 1npj n GLY 104 Ca -0.21 -1.83 -0.30 0.00 0.00 0.00 0.00 46.02 43.67 1npj n GLY 104 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npj n ALA 105 N 0.47 -2.09 -3.86 4.61 0.00 -1.26 -1.11 120.51 117.28 1npj n ALA 105 Ca 0.00 -0.38 -0.28 0.00 0.00 0.00 0.00 53.44 52.79 1npj n ALA 105 Cb 0.00 -1.32 0.03 0.00 0.00 0.00 0.00 19.45 18.15 1npj n ALA 105 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1npj n LEU 106 N -4.55 -2.68 -0.03 0.00 4.77 -1.26 -0.92 117.00 112.32 1npj n LEU 106 Ca -0.30 -0.79 -0.00 0.00 -0.03 0.00 0.00 56.01 54.89 1npj n LEU 106 Cb 0.68 -2.58 -0.00 0.00 -2.33 0.00 0.00 43.42 39.19 1npj n LEU 106 CO 0.80 0.46 -0.00 0.61 -1.33 0.00 0.00 177.39 177.92 1npj n GLY 107 N -1.68 0.39 0.00 -0.72 0.00 -0.26 -2.43 105.19 100.49 1npj n GLY 107 Ca -0.05 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1npj n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1npj n GLY 108 N -1.85 1.18 0.32 -0.02 0.00 -0.10 -0.16 105.19 104.56 1npj n GLY 108 Ca -0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1npj n GLY 108 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1npj h GLY 109 N 0.00 0.70 2.00 -0.02 0.00 -0.67 -1.90 103.07 103.17 1npj h GLY 109 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.07 1npj h GLY 109 CO 0.00 0.25 0.00 -1.33 0.00 0.00 0.00 176.54 175.46 1npj h GLY 110 N 0.67 0.00 -0.73 4.60 0.00 -1.55 -3.15 103.07 102.90 1npj h GLY 110 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1npj h GLY 110 CO -0.04 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.54 1npj n LEU 111 N -2.71 2.36 -0.32 3.11 4.77 -0.76 -4.67 117.00 118.77 1npj n LEU 111 Ca 0.02 -1.79 0.06 0.00 -0.03 0.00 0.00 56.01 54.27 1npj n LEU 111 Cb 0.31 -0.11 0.10 0.00 -2.33 0.00 0.00 43.42 41.39 1npj n LEU 111 CO 0.25 0.58 0.43 0.35 -1.33 0.00 0.00 177.39 177.67 1npj n THR 112 N 0.17 1.26 -2.22 -5.08 -2.24 -0.94 -4.94 114.28 100.30 1npj n THR 112 Ca 0.06 -1.62 -0.43 0.00 -2.27 0.00 0.00 64.05 59.79 1npj n THR 112 Cb 0.32 0.04 -0.02 0.00 -2.10 0.00 0.00 70.33 68.57 1npj n THR 112 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1npj s GLU 113 N -1.91 3.68 -0.10 -0.78 2.02 -1.25 -4.11 118.70 116.25 1npj s GLU 113 Ca 0.23 1.35 0.02 0.00 0.02 0.00 0.00 54.97 56.59 1npj s GLU 113 Cb 0.21 -4.03 0.01 0.00 0.10 0.00 0.00 34.13 30.42 1npj s GLU 113 CO 0.00 -1.43 -0.17 0.96 0.02 0.00 0.00 175.26 174.64 1npj s ILE 114 N 5.40 1.54 0.77 -1.63 -5.25 0.08 -4.97 121.20 117.15 1npj s ILE 114 Ca 0.67 -0.69 -0.12 0.00 -0.99 0.00 0.00 60.65 59.52 1npj s ILE 114 Cb -0.20 -1.39 0.05 0.00 2.95 0.00 0.00 42.46 43.88 1npj s ILE 114 CO 0.30 0.45 1.13 0.20 -1.79 0.00 0.00 174.94 175.22 1npj s ASN 115 N 0.74 4.84 0.26 4.36 0.02 -1.26 -2.14 114.94 121.76 1npj s ASN 115 Ca -0.12 1.04 -0.31 0.00 -1.02 0.00 0.00 52.86 52.45 1npj s ASN 115 Cb -0.16 -1.71 -0.12 0.00 0.02 0.00 0.00 41.25 39.28 1npj s ASN 115 CO 0.02 -1.72 1.57 -2.65 0.02 0.00 0.00 177.10 174.35 1npj n PRO 116 N -3.24 2.55 -0.04 -0.60 -0.02 -1.26 -1.27 135.00 131.12 1npj n PRO 116 Ca 0.07 0.91 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 1npj n PRO 116 Cb 0.58 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.39 1npj n PRO 116 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1npj n GLY 117 N 2.46 0.41 3.72 -1.23 0.00 0.26 -4.71 105.19 106.10 1npj n GLY 117 Ca 0.11 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 1npj n GLY 117 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1npj s GLU 118 N -0.89 2.35 0.16 1.61 2.02 -0.39 -4.87 118.70 118.68 1npj s GLU 118 Ca 0.00 -1.55 -0.04 0.00 0.02 0.00 0.00 54.97 53.41 1npj s GLU 118 Cb 0.00 -2.16 -0.03 0.00 0.10 0.00 0.00 34.13 32.04 1npj s GLU 118 CO 0.00 0.14 0.16 -1.59 0.02 0.00 0.00 175.26 173.99 1npj s LYS 119 N -3.82 1.08 0.12 1.61 -2.85 -1.26 -1.44 119.74 113.18 1npj s LYS 119 Ca 0.37 -1.39 -0.18 0.00 -1.00 0.00 0.00 55.97 53.77 1npj s LYS 119 Cb -0.03 0.30 0.04 0.00 -2.06 0.00 0.00 37.83 36.08 1npj s LYS 119 CO 0.22 -0.35 0.44 -0.08 0.10 0.00 0.00 175.35 175.68 1npj s THR 120 N -4.04 0.05 -0.15 3.79 -1.32 -0.66 -5.01 115.64 108.30 1npj s THR 120 Ca 0.25 -0.45 -0.00 0.00 -1.21 0.00 0.00 61.69 60.28 1npj s THR 120 Cb 0.06 -1.11 0.03 0.00 -1.51 0.00 0.00 72.50 69.97 1npj s THR 120 CO 0.04 -0.25 -0.09 -0.63 -2.21 0.00 0.00 174.62 171.48 1npj s ILE 121 N -3.63 1.26 -0.05 5.08 -1.09 -1.26 -1.25 121.20 120.27 1npj s ILE 121 Ca 0.02 -0.58 0.03 0.00 -2.23 0.00 0.00 60.65 57.88 1npj s ILE 121 Cb 0.01 -1.32 -0.03 0.00 -1.58 0.00 0.00 42.46 39.55 1npj s ILE 121 CO -0.11 0.28 -0.12 -0.22 -1.23 0.00 0.00 174.94 173.55 1npj s LEU 122 N 1.59 2.90 -0.08 2.97 2.96 -0.29 -4.95 118.68 123.78 1npj s LEU 122 Ca 0.03 -0.15 0.01 0.00 -0.22 0.00 0.00 54.13 53.80 1npj s LEU 122 Cb -0.14 -1.61 0.02 0.00 0.50 0.00 0.00 46.19 44.96 1npj s LEU 122 CO -0.09 0.34 -0.08 -0.60 -1.32 0.00 0.00 176.35 174.61 1npj s ARG 123 N -0.83 1.35 0.07 1.98 3.52 -1.26 -0.07 118.95 123.71 1npj s ARG 123 Ca 0.12 -0.24 0.02 0.00 -0.13 0.00 0.00 55.73 55.50 1npj s ARG 123 Cb -0.11 -1.31 -0.03 0.00 -1.56 0.00 0.00 34.95 31.94 1npj s ARG 123 CO 0.01 -0.13 -0.07 -0.59 -0.81 0.00 0.00 175.30 173.71 1npj s PHE 124 N 1.20 0.80 -0.18 5.12 -0.12 -0.85 -4.97 117.98 118.98 1npj s PHE 124 Ca -0.05 -0.74 -0.18 0.00 -0.05 0.00 0.00 56.93 55.91 1npj s PHE 124 Cb -0.14 -0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 41.75 1npj s PHE 124 CO -0.02 -0.12 0.49 0.21 -0.05 0.00 0.00 175.22 175.73 1npj s LYS 125 N -2.87 4.23 -1.35 1.99 2.20 -1.26 -1.15 119.74 121.52 1npj s LYS 125 Ca 0.02 0.39 -0.14 0.00 -0.36 0.00 0.00 55.97 55.89 1npj s LYS 125 Cb -0.01 -3.53 0.09 0.00 -1.51 0.00 0.00 37.83 32.87 1npj s LYS 125 CO -0.03 -0.06 1.94 0.00 -0.36 0.00 0.00 175.35 176.85 1npj n ALA 126 N 4.46 4.83 0.29 3.13 0.00 -0.69 -4.79 120.51 127.75 1npj n ALA 126 Ca -0.06 -4.01 0.15 0.00 0.00 0.00 0.00 53.44 49.53 1npj n ALA 126 Cb 0.51 -3.38 0.53 0.00 0.00 0.00 0.00 19.45 17.10 1npj n ALA 126 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1npj h THR 127 N 4.40 0.00 -3.31 0.00 1.35 -1.86 0.39 112.91 113.90 1npj h THR 127 Ca 0.47 -0.60 -0.67 0.00 -0.55 0.00 0.00 66.41 65.07 1npj h THR 127 Cb 0.72 1.57 -0.31 0.00 -1.73 0.00 0.00 68.15 68.40 1npj h THR 127 CO 1.66 0.00 -0.84 -0.54 -0.25 0.00 0.00 175.52 175.55 1npj s LYS 128 N -3.50 3.16 0.11 4.72 1.02 -1.26 -4.75 119.74 119.24 1npj s LYS 128 Ca 0.03 -0.81 -0.28 0.00 0.02 0.00 0.00 55.97 54.94 1npj s LYS 128 Cb 0.08 -2.46 -0.06 0.00 -0.52 0.00 0.00 37.83 34.87 1npj s LYS 128 CO 0.56 0.14 0.89 -1.25 -0.92 0.00 0.00 175.35 174.76 1npj s PRO 129 N 0.48 4.64 0.00 -1.68 0.04 -1.26 -4.81 135.00 132.41 1npj s PRO 129 Ca -0.13 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.23 1npj s PRO 129 Cb -0.17 -3.35 0.00 0.00 0.04 0.00 0.00 34.50 31.02 1npj s PRO 129 CO 0.05 0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.80 1npj n GLY 130 N 2.16 -0.57 3.83 0.56 0.00 0.90 -1.82 105.19 110.24 1npj n GLY 130 Ca -0.00 -1.69 -0.38 0.00 0.00 0.00 0.00 46.02 43.95 1npj n GLY 130 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1npj s VAL 131 N -1.49 5.19 0.02 1.61 -7.23 0.91 -0.33 120.40 119.08 1npj s VAL 131 Ca 0.00 0.65 0.01 0.00 -1.81 0.00 0.00 61.98 60.83 1npj s VAL 131 Cb 0.00 -3.63 -0.01 0.00 0.56 0.00 0.00 36.38 33.30 1npj s VAL 131 CO 0.00 0.56 -0.05 -0.36 -0.31 0.00 0.00 175.10 174.94 1npj s PHE 132 N -0.82 0.45 0.48 2.82 0.08 -0.54 -4.47 117.98 115.97 1npj s PHE 132 Ca 0.21 -0.33 -0.16 0.00 0.12 0.00 0.00 56.93 56.77 1npj s PHE 132 Cb -0.15 -0.28 -0.08 0.00 -0.57 0.00 0.00 43.02 41.94 1npj s PHE 132 CO 0.10 -0.07 0.94 0.08 -0.10 0.00 0.00 175.22 176.17 1npj s VAL 133 N -0.86 4.55 0.03 -0.44 1.01 -1.26 -0.98 120.40 122.43 1npj s VAL 133 Ca -0.07 1.18 0.02 0.00 0.00 0.00 0.00 61.98 63.12 1npj s VAL 133 Cb -0.06 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 1npj s VAL 133 CO -0.00 -0.59 -0.08 -0.72 0.00 0.00 0.00 175.10 173.71 1npj s TYR 134 N -2.50 0.68 0.07 5.22 -0.85 -0.55 -1.28 117.35 118.14 1npj s TYR 134 Ca 0.58 -0.33 -0.26 0.00 -0.52 0.00 0.00 57.07 56.54 1npj s TYR 134 Cb -0.10 -0.41 0.08 0.00 0.38 0.00 0.00 41.96 41.91 1npj s TYR 134 CO 0.28 -0.04 0.69 -3.38 -1.52 0.00 0.00 175.55 171.58 1npj s HIS 135 N -0.85 -0.52 0.52 -3.49 -3.43 -0.50 -0.79 115.29 106.24 1npj s HIS 135 Ca -0.04 0.50 -0.20 0.00 -0.80 0.00 0.00 55.06 54.52 1npj s HIS 135 Cb -0.07 0.52 -0.07 0.00 -1.43 0.00 0.00 32.58 31.53 1npj s HIS 135 CO 0.00 -0.71 1.11 0.00 -2.00 0.00 0.00 174.74 173.14 1npj n ALA 137 N -1.16 -0.31 -2.51 0.00 0.00 -1.26 -4.48 120.51 110.79 1npj n ALA 137 Ca 0.11 -1.92 -0.42 0.00 0.00 0.00 0.00 53.44 51.20 1npj n ALA 137 Cb 0.51 -1.17 -0.03 0.00 0.00 0.00 0.00 19.45 18.76 1npj n ALA 137 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1npj s PRO 138 N -0.01 4.45 0.08 0.00 0.04 -1.26 -4.84 135.00 133.45 1npj s PRO 138 Ca 0.30 1.66 -0.37 0.00 0.04 0.00 0.00 61.00 62.63 1npj s PRO 138 Cb 0.25 -3.41 -0.17 0.00 0.04 0.00 0.00 34.50 31.21 1npj s PRO 138 CO -0.16 -0.23 1.27 -2.30 0.04 0.00 0.00 177.00 175.62 1npj n PRO 139 N 4.13 0.93 0.00 0.56 -0.02 -1.26 -0.49 135.00 138.85 1npj n PRO 139 Ca 0.08 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.90 1npj n PRO 139 Cb 0.48 -1.94 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 1npj n PRO 139 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1npj n GLY 140 N 2.29 2.97 0.00 -1.23 0.00 -1.26 -4.72 105.19 103.24 1npj n GLY 140 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1npj n GLY 140 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1npj n MET 141 N -2.00 1.75 0.00 1.61 2.81 0.36 -4.97 117.12 116.67 1npj n MET 141 Ca 0.00 -1.08 0.00 0.00 -1.81 0.00 0.00 57.70 54.81 1npj n MET 141 Cb 0.00 -0.81 0.00 0.00 -0.71 0.00 0.00 33.22 31.70 1npj n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1npj n VAL 142 N -0.30 0.00 -0.02 2.03 0.31 -0.69 -2.48 118.33 117.18 1npj n VAL 142 Ca 0.00 1.44 0.06 0.00 -0.01 0.00 0.00 64.34 65.83 1npj n VAL 142 Cb 0.34 -2.02 0.45 0.00 -0.91 0.00 0.00 33.84 31.70 1npj n VAL 142 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1npj h PRO 143 N 0.00 0.49 -0.36 5.55 0.13 -1.92 -2.70 132.00 133.20 1npj h PRO 143 Ca 0.00 -0.03 0.06 0.00 -0.87 0.00 0.00 66.00 65.16 1npj h PRO 143 Cb 0.00 -0.11 -0.05 0.00 0.13 0.00 0.00 31.00 30.97 1npj h PRO 143 CO 0.00 0.33 0.05 2.35 -0.23 0.00 0.00 178.00 180.50 1npj h TRP 144 N 0.51 0.09 -0.23 1.56 7.01 -1.88 -0.05 115.95 122.95 1npj h TRP 144 Ca 0.18 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.18 1npj h TRP 144 Cb 0.10 0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.16 1npj h TRP 144 CO -0.00 -0.00 0.03 0.00 -2.79 0.00 0.00 178.44 175.68 1npj h ALA 145 N 1.28 0.31 -0.51 2.65 0.00 -1.23 -2.42 119.26 119.34 1npj h ALA 145 Ca 0.17 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1npj h ALA 145 Cb 0.21 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 1npj h ALA 145 CO -0.24 -0.01 0.29 0.28 0.00 0.00 0.00 179.25 179.57 1npj h VAL 146 N 0.18 1.01 -0.01 0.00 2.07 -1.17 -1.58 116.25 116.75 1npj h VAL 146 Ca 0.07 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.40 1npj h VAL 146 Cb 0.34 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1npj h VAL 146 CO 0.01 0.10 0.00 1.33 0.02 0.00 0.00 177.57 179.03 1npj n VAL 147 N -4.83 0.02 -0.09 2.57 0.24 -0.06 -1.93 118.33 114.23 1npj n VAL 147 Ca 0.04 -0.03 0.11 0.00 -2.04 0.00 0.00 64.34 62.42 1npj n VAL 147 Cb 0.10 -0.25 0.29 0.00 -1.47 0.00 0.00 33.84 32.51 1npj n VAL 147 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1npj n SER 148 N -0.72 3.61 0.00 -1.34 7.64 -0.64 -4.67 113.62 117.51 1npj n SER 148 Ca 0.15 -1.99 0.00 0.00 1.01 0.00 0.00 58.87 58.04 1npj n SER 148 Cb 0.09 -0.42 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 1npj n SER 148 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1npj n GLY 149 N 1.58 0.81 3.12 0.23 0.00 -0.82 -1.97 105.19 108.13 1npj n GLY 149 Ca 0.22 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 1npj n GLY 149 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1npj n MET 150 N -2.16 3.34 -3.45 1.61 0.00 -0.95 -4.60 117.12 110.91 1npj n MET 150 Ca 0.00 -3.40 -0.11 0.00 0.00 0.00 0.00 57.70 54.18 1npj n MET 150 Cb 0.00 -3.12 -0.02 0.00 0.00 0.00 0.00 33.22 30.08 1npj n MET 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 175.97 176.51 1npj s ASN 151 N 2.38 -0.51 0.00 6.12 2.20 -1.26 -1.61 114.94 122.26 1npj s ASN 151 Ca 0.44 0.05 0.00 0.00 -0.94 0.00 0.00 52.86 52.41 1npj s ASN 151 Cb 0.06 0.53 0.00 0.00 -2.00 0.00 0.00 41.25 39.84 1npj s ASN 151 CO -0.00 -0.84 0.00 0.61 -2.94 0.00 0.00 177.10 173.93 1npj n GLY 152 N -0.25 3.27 3.74 0.45 0.00 0.03 -0.83 105.19 111.61 1npj n GLY 152 Ca -0.15 -0.46 -0.08 0.00 0.00 0.00 0.00 46.02 45.34 1npj n GLY 152 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npj s ALA 153 N -1.00 -1.00 0.13 4.61 0.00 -1.26 -1.49 121.76 121.76 1npj s ALA 153 Ca 0.00 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 51.59 1npj s ALA 153 Cb 0.00 0.90 -0.04 0.00 0.00 0.00 0.00 23.12 23.98 1npj s ALA 153 CO 0.00 -0.96 -0.02 0.96 0.00 0.00 0.00 175.76 175.74 1npj s ILE 154 N -3.93 0.60 -0.10 0.00 -4.36 -0.15 -2.99 121.20 110.27 1npj s ILE 154 Ca 0.13 -1.95 0.01 0.00 -0.26 0.00 0.00 60.65 58.58 1npj s ILE 154 Cb -0.04 -1.91 0.02 0.00 1.25 0.00 0.00 42.46 41.77 1npj s ILE 154 CO 0.05 -0.65 -0.13 -0.32 0.24 0.00 0.00 174.94 174.13 1npj s MET 155 N -3.90 2.01 -0.55 0.37 -2.45 0.76 -1.47 119.30 114.07 1npj s MET 155 Ca 0.18 -0.48 -0.06 0.00 -1.25 0.00 0.00 55.69 54.08 1npj s MET 155 Cb 0.06 -1.75 0.14 0.00 1.25 0.00 0.00 34.83 34.53 1npj s MET 155 CO -0.00 -0.08 0.39 0.08 1.05 0.00 0.00 175.02 176.46 1npj s VAL 156 N 1.06 3.98 0.54 10.11 1.01 0.55 -1.56 120.40 136.09 1npj s VAL 156 Ca -0.06 -2.34 -0.19 0.00 0.00 0.00 0.00 61.98 59.39 1npj s VAL 156 Cb -0.15 -3.61 -0.06 0.00 0.00 0.00 0.00 36.38 32.57 1npj s VAL 156 CO -0.02 -0.82 1.09 -0.76 0.00 0.00 0.00 175.10 174.59 1npj s LEU 157 N 0.67 3.71 0.62 3.92 1.43 -0.54 -0.07 118.68 128.43 1npj s LEU 157 Ca 0.12 2.05 -0.17 0.00 -1.03 0.00 0.00 54.13 55.10 1npj s LEU 157 Cb -0.22 -4.57 -0.02 0.00 0.03 0.00 0.00 46.19 41.42 1npj s LEU 157 CO -0.03 -1.13 1.12 -2.84 0.23 0.00 0.00 176.35 173.70 1npj s PRO 158 N -3.44 2.98 0.31 1.29 0.02 -1.26 -0.45 135.00 134.44 1npj s PRO 158 Ca 0.70 1.48 0.07 0.00 0.02 0.00 0.00 61.00 63.26 1npj s PRO 158 Cb -0.20 -1.97 0.75 0.00 0.02 0.00 0.00 34.50 33.10 1npj s PRO 158 CO 0.27 -1.13 1.79 0.00 -0.33 0.00 0.00 177.00 177.61 1npj h ARG 159 N 0.43 0.73 -0.72 5.54 2.47 -1.90 -0.76 114.38 120.18 1npj h ARG 159 Ca -0.48 -0.04 -0.02 0.00 -1.26 0.00 0.00 59.98 58.18 1npj h ARG 159 Cb 1.25 -0.17 -0.01 0.00 -1.65 0.00 0.00 29.97 29.40 1npj h ARG 159 CO 0.55 0.49 0.03 -0.85 0.56 0.00 0.00 179.97 180.74 1npj n GLU 160 N -4.73 3.71 -0.02 0.04 0.00 -1.26 0.89 120.64 119.27 1npj n GLU 160 Ca 0.23 -2.26 0.00 0.00 0.00 0.00 0.00 57.16 55.13 1npj n GLU 160 Cb 0.57 -2.04 -0.00 0.00 0.00 0.00 0.00 31.44 29.96 1npj n GLU 160 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1npj n GLY 161 N 0.39 -1.86 3.83 -1.84 0.00 -0.29 -4.83 105.19 100.58 1npj n GLY 161 Ca 0.21 -1.34 -0.33 0.00 0.00 0.00 0.00 46.02 44.56 1npj n GLY 161 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1npj s LEU 162 N 0.00 4.07 0.04 0.99 1.43 -1.26 -4.31 118.68 119.64 1npj s LEU 162 Ca 0.00 1.49 -0.03 0.00 -1.03 0.00 0.00 54.13 54.56 1npj s LEU 162 Cb 0.00 -4.20 -0.02 0.00 0.03 0.00 0.00 46.19 42.00 1npj s LEU 162 CO 0.00 -0.23 0.03 -1.00 0.23 0.00 0.00 176.35 175.38 1npj s HIS 163 N -1.98 0.31 0.00 0.29 3.76 -1.26 -0.91 115.29 115.50 1npj s HIS 163 Ca 0.56 -0.69 0.00 0.00 -0.15 0.00 0.00 55.06 54.78 1npj s HIS 163 Cb -0.11 -0.23 0.00 0.00 1.11 0.00 0.00 32.58 33.35 1npj s HIS 163 CO 0.17 -0.34 0.00 -0.40 -0.85 0.00 0.00 174.74 173.32 1npj n ASP 164 N 0.70 0.00 0.15 1.40 5.68 0.67 -4.82 116.55 120.33 1npj n ASP 164 Ca -0.18 -0.85 0.12 0.00 -0.50 0.00 0.00 54.79 53.38 1npj n ASP 164 Cb 0.59 0.00 0.53 0.00 -1.14 0.00 0.00 41.12 41.10 1npj n ASP 164 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1npj h GLY 165 N 0.00 0.00 -1.28 6.12 0.00 -1.88 -2.92 103.07 103.10 1npj h GLY 165 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1npj h GLY 165 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.82 1npj n LYS 166 N -2.33 2.41 -0.19 4.80 4.01 -1.26 -4.98 118.16 120.63 1npj n LYS 166 Ca 0.01 -1.91 0.00 0.00 -0.51 0.00 0.00 58.31 55.91 1npj n LYS 166 Cb 0.21 -1.28 0.00 0.00 -0.51 0.00 0.00 35.03 33.46 1npj n LYS 166 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1npj n GLY 167 N 0.61 0.80 3.73 0.72 0.00 -1.10 -5.04 105.19 104.91 1npj n GLY 167 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 1npj n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1npj s LYS 168 N -0.67 4.41 0.48 1.61 -0.14 -1.26 -4.72 119.74 119.45 1npj s LYS 168 Ca 0.00 1.99 -0.23 0.00 -1.36 0.00 0.00 55.97 56.37 1npj s LYS 168 Cb 0.00 -3.22 -0.07 0.00 -1.68 0.00 0.00 37.83 32.86 1npj s LYS 168 CO 0.00 -0.22 1.24 0.00 -0.76 0.00 0.00 175.35 175.60 1npj s ALA 169 N 0.20 2.96 -0.23 5.17 0.00 -1.26 -0.23 121.76 128.35 1npj s ALA 169 Ca 0.56 1.08 0.01 0.00 0.00 0.00 0.00 51.96 53.62 1npj s ALA 169 Cb -0.35 -3.45 0.06 0.00 0.00 0.00 0.00 23.12 19.38 1npj s ALA 169 CO 0.37 -0.89 -0.07 -0.51 0.00 0.00 0.00 175.76 174.66 1npj s LEU 170 N -3.11 2.67 -0.18 0.00 1.43 -0.08 -4.78 118.68 114.63 1npj s LEU 170 Ca 0.65 -1.16 0.00 0.00 -1.03 0.00 0.00 54.13 52.59 1npj s LEU 170 Cb -0.33 -1.25 0.01 0.00 0.03 0.00 0.00 46.19 44.65 1npj s LEU 170 CO 0.40 -0.21 -0.16 -0.89 0.23 0.00 0.00 176.35 175.72 1npj s THR 171 N 1.35 2.45 0.20 5.49 2.01 -1.26 -4.01 115.64 121.87 1npj s THR 171 Ca -0.06 -0.82 -0.10 0.00 0.31 0.00 0.00 61.69 61.03 1npj s THR 171 Cb -0.19 -2.05 -0.07 0.00 0.01 0.00 0.00 72.50 70.21 1npj s THR 171 CO -0.06 0.51 0.52 -0.72 -0.69 0.00 0.00 174.62 174.18 1npj s TYR 172 N 1.16 3.46 -0.01 4.92 -0.85 -1.26 -4.86 117.35 119.90 1npj s TYR 172 Ca 0.01 0.86 0.04 0.00 -0.52 0.00 0.00 57.07 57.46 1npj s TYR 172 Cb -0.14 -2.24 -0.25 0.00 0.38 0.00 0.00 41.96 39.71 1npj s TYR 172 CO -0.07 0.32 0.79 -0.44 -1.52 0.00 0.00 175.55 174.62 1npj h ASP 173 N 2.74 0.19 -5.09 -0.18 3.32 -1.06 -3.48 116.42 112.86 1npj h ASP 173 Ca -0.47 -0.31 -0.15 0.00 0.02 0.00 0.00 57.03 56.12 1npj h ASP 173 Cb 1.17 -0.06 -0.17 0.00 0.22 0.00 0.00 39.33 40.49 1npj h ASP 173 CO 0.69 1.27 -0.69 -0.54 -1.72 0.00 0.00 179.24 178.25 1npj s LYS 174 N -2.62 0.55 -0.02 3.56 1.02 -0.83 -5.01 119.74 116.40 1npj s LYS 174 Ca -0.08 -1.05 0.01 0.00 0.02 0.00 0.00 55.97 54.87 1npj s LYS 174 Cb 0.08 0.12 0.01 0.00 -0.52 0.00 0.00 37.83 37.52 1npj s LYS 174 CO 0.83 -0.08 -0.04 -1.50 -0.92 0.00 0.00 175.35 173.64 1npj s ILE 175 N -3.14 0.36 0.06 2.17 1.10 -1.26 -1.56 121.20 118.92 1npj s ILE 175 Ca 0.01 -0.12 0.05 0.00 -0.51 0.00 0.00 60.65 60.08 1npj s ILE 175 Cb 0.02 -0.35 -0.03 0.00 0.15 0.00 0.00 42.46 42.25 1npj s ILE 175 CO -0.07 0.14 -0.15 -0.31 -2.11 0.00 0.00 174.94 172.44 1npj s TYR 176 N 0.34 1.28 -0.21 3.50 2.02 -0.58 -4.39 117.35 119.31 1npj s TYR 176 Ca -0.04 -0.40 0.02 0.00 -0.37 0.00 0.00 57.07 56.28 1npj s TYR 176 Cb -0.07 -0.74 0.04 0.00 -0.40 0.00 0.00 41.96 40.79 1npj s TYR 176 CO -0.00 0.06 -0.13 -0.47 -1.57 0.00 0.00 175.55 173.43 1npj s TYR 177 N -1.03 2.79 -0.33 2.71 5.04 0.57 -0.65 117.35 126.46 1npj s TYR 177 Ca 0.01 -1.85 -0.08 0.00 -2.44 0.00 0.00 57.07 52.70 1npj s TYR 177 Cb -0.09 -1.81 0.02 0.00 0.35 0.00 0.00 41.96 40.44 1npj s TYR 177 CO 0.02 -0.81 0.13 0.08 -1.34 0.00 0.00 175.55 173.63 1npj s VAL 178 N 1.27 4.14 -0.29 3.14 1.01 0.38 -4.09 120.40 125.96 1npj s VAL 178 Ca -0.02 -0.87 -0.12 0.00 0.00 0.00 0.00 61.98 60.97 1npj s VAL 178 Cb -0.17 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 1npj s VAL 178 CO -0.08 -0.10 0.24 -0.83 0.00 0.00 0.00 175.10 174.33 1npj s GLY 179 N 1.49 1.92 -0.15 4.51 0.00 -1.26 -2.13 107.32 111.70 1npj s GLY 179 Ca 0.01 -1.07 -0.11 0.00 0.00 0.00 0.00 44.72 43.56 1npj s GLY 179 CO 0.04 0.75 0.21 1.85 0.00 0.00 0.00 173.10 175.95 1npj s GLU 180 N 1.84 4.02 -0.08 2.90 2.12 -0.58 -1.63 118.70 127.28 1npj s GLU 180 Ca 0.09 -0.05 0.03 0.00 0.36 0.00 0.00 54.97 55.40 1npj s GLU 180 Cb -0.16 -3.36 0.01 0.00 0.26 0.00 0.00 34.13 30.88 1npj s GLU 180 CO 0.11 0.42 -0.18 -1.14 -0.54 0.00 0.00 175.26 173.93 1npj s GLN 181 N -0.02 2.33 -0.23 4.30 2.00 0.11 -4.50 119.66 123.65 1npj s GLN 181 Ca 0.14 -0.63 -0.14 0.00 -2.00 0.00 0.00 55.36 52.72 1npj s GLN 181 Cb -0.12 -1.83 -0.04 0.00 0.80 0.00 0.00 33.01 31.82 1npj s GLN 181 CO 0.02 0.10 0.33 0.16 -0.50 0.00 0.00 175.29 175.40 1npj s ASP 182 N 0.52 6.30 0.07 6.67 3.84 -1.26 -1.19 116.67 131.62 1npj s ASP 182 Ca -0.17 0.35 0.06 0.00 -0.00 0.00 0.00 52.55 52.79 1npj s ASP 182 Cb -0.17 -2.19 -0.04 0.00 -1.38 0.00 0.00 42.92 39.14 1npj s ASP 182 CO 0.06 -0.07 -0.08 -0.36 -0.00 0.00 0.00 175.17 174.72 1npj s PHE 183 N 1.46 2.81 -0.52 2.11 0.08 0.06 -4.77 117.98 119.21 1npj s PHE 183 Ca 0.15 -0.11 0.03 0.00 0.12 0.00 0.00 56.93 57.13 1npj s PHE 183 Cb -0.15 -1.50 0.15 0.00 -0.57 0.00 0.00 43.02 40.95 1npj s PHE 183 CO 0.08 0.41 0.32 0.71 -0.10 0.00 0.00 175.22 176.64 1npj s TYR 184 N -1.15 2.52 -0.27 0.36 1.51 -1.26 -1.25 117.35 117.81 1npj s TYR 184 Ca 0.20 -2.80 -0.18 0.00 -1.01 0.00 0.00 57.07 53.28 1npj s TYR 184 Cb -0.11 -2.16 -0.02 0.00 -0.11 0.00 0.00 41.96 39.56 1npj s TYR 184 CO 0.12 -0.72 0.53 0.08 -1.11 0.00 0.00 175.55 174.45 1npj s VAL 185 N -0.28 5.05 0.69 0.71 1.01 -1.26 -4.76 120.40 121.56 1npj s VAL 185 Ca 0.21 0.84 -0.17 0.00 0.00 0.00 0.00 61.98 62.87 1npj s VAL 185 Cb -0.16 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.37 1npj s VAL 185 CO -0.07 0.04 1.12 -2.65 0.00 0.00 0.00 175.10 173.54 1npj n PRO 186 N 5.60 0.72 -4.29 2.72 -0.02 -1.26 -4.88 135.00 133.60 1npj n PRO 186 Ca -0.04 0.30 -0.20 0.00 -2.02 0.00 0.00 63.50 61.55 1npj n PRO 186 Cb 0.50 -2.36 -0.11 0.00 -0.02 0.00 0.00 33.50 31.50 1npj n PRO 186 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1npj s ARG 187 N -3.39 1.15 0.30 -0.52 0.52 -1.26 -1.58 118.95 114.16 1npj s ARG 187 Ca 0.77 -1.33 -0.03 0.00 -0.52 0.00 0.00 55.73 54.63 1npj s ARG 187 Cb -0.36 -1.10 0.06 0.00 0.52 0.00 0.00 34.95 34.07 1npj s ARG 187 CO 0.46 0.22 0.40 -0.40 0.02 0.00 0.00 175.30 176.00 1npj n ASP 188 N 0.39 0.28 0.00 0.23 5.68 0.78 -4.86 116.55 119.05 1npj n ASP 188 Ca -0.14 -1.30 0.06 0.00 -0.50 0.00 0.00 54.79 52.91 1npj n ASP 188 Cb 0.57 -0.29 0.31 0.00 -1.14 0.00 0.00 41.12 40.58 1npj n ASP 188 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1npj n GLU 189 N -1.80 0.20 -0.30 0.11 -0.58 -1.26 -2.24 120.64 114.77 1npj n GLU 189 Ca 0.06 0.15 0.07 0.00 -0.42 0.00 0.00 57.16 57.02 1npj n GLU 189 Cb 0.21 -1.50 0.20 0.00 -0.57 0.00 0.00 31.44 29.77 1npj n GLU 189 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1npj n ASN 190 N -1.25 3.34 0.00 1.62 5.03 -1.26 -4.95 115.26 117.79 1npj n ASN 190 Ca 0.06 -2.52 0.00 0.00 0.87 0.00 0.00 54.58 52.99 1npj n ASN 190 Cb 0.09 -0.38 0.00 0.00 -1.02 0.00 0.00 39.78 38.47 1npj n ASN 190 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1npj n GLY 191 N -0.07 0.50 3.82 7.41 0.00 -0.95 -5.01 105.19 110.88 1npj n GLY 191 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1npj n GLY 191 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1npj s LYS 192 N -0.37 4.14 0.30 1.61 2.20 -1.26 -4.82 119.74 121.54 1npj s LYS 192 Ca 0.00 0.67 -0.29 0.00 -0.36 0.00 0.00 55.97 55.99 1npj s LYS 192 Cb 0.00 -3.20 -0.10 0.00 -1.51 0.00 0.00 37.83 33.02 1npj s LYS 192 CO 0.00 0.63 1.24 0.71 -0.36 0.00 0.00 175.35 177.57 1npj s TYR 193 N -1.14 3.26 0.26 4.03 1.51 -1.26 -0.15 117.35 123.85 1npj s TYR 193 Ca 0.29 1.49 -0.12 0.00 -1.01 0.00 0.00 57.07 57.72 1npj s TYR 193 Cb -0.19 -3.54 -0.08 0.00 -0.11 0.00 0.00 41.96 38.05 1npj s TYR 193 CO 0.18 -1.42 0.62 0.15 -1.11 0.00 0.00 175.55 173.97 1npj s LYS 194 N -1.44 3.88 0.18 -0.62 1.02 -0.62 -4.84 119.74 117.31 1npj s LYS 194 Ca 0.48 0.43 0.09 0.00 0.02 0.00 0.00 55.97 56.99 1npj s LYS 194 Cb -0.37 -2.58 -0.04 0.00 -0.52 0.00 0.00 37.83 34.32 1npj s LYS 194 CO 0.47 0.27 -0.07 0.15 -0.92 0.00 0.00 175.35 175.25 1npj s LYS 195 N -2.84 2.15 0.04 1.68 1.02 -1.26 -4.74 119.74 115.80 1npj s LYS 195 Ca 0.49 -1.24 0.00 0.00 0.02 0.00 0.00 55.97 55.24 1npj s LYS 195 Cb -0.11 -2.20 -0.03 0.00 -0.52 0.00 0.00 37.83 34.97 1npj s LYS 195 CO 0.20 0.43 -0.04 0.71 -0.92 0.00 0.00 175.35 175.73 1npj s TYR 196 N -1.75 0.50 -0.98 3.18 2.02 -1.26 -5.05 117.35 114.01 1npj s TYR 196 Ca 0.26 -0.76 0.23 0.00 -0.37 0.00 0.00 57.07 56.43 1npj s TYR 196 Cb -0.09 -0.33 0.12 0.00 -0.40 0.00 0.00 41.96 41.26 1npj s TYR 196 CO 0.16 -0.23 1.14 0.39 -1.57 0.00 0.00 175.55 175.44 1npj n GLU 197 N 0.85 0.02 -3.89 -0.62 1.02 -1.26 -4.93 120.64 111.83 1npj n GLU 197 Ca -0.19 -0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 56.84 1npj n GLU 197 Cb 0.58 -1.50 -0.12 0.00 -0.02 0.00 0.00 31.44 30.37 1npj n GLU 197 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1npj s ALA 198 N -3.01 -0.08 0.13 0.62 0.00 -1.26 -5.06 121.76 113.09 1npj s ALA 198 Ca 0.09 -0.08 -0.21 0.00 0.00 0.00 0.00 51.96 51.76 1npj s ALA 198 Cb 0.17 -0.00 -0.02 0.00 0.00 0.00 0.00 23.12 23.27 1npj s ALA 198 CO 0.79 -0.08 1.69 -1.35 0.00 0.00 0.00 175.76 176.81 1npj h PRO 199 N 5.49 -0.07 0.00 0.00 0.11 -1.96 -1.63 132.00 133.94 1npj h PRO 199 Ca -0.27 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 1npj h PRO 199 Cb 1.21 0.02 -0.00 0.00 0.11 0.00 0.00 31.00 32.33 1npj h PRO 199 CO 0.45 -0.05 -0.03 0.78 -0.21 0.00 0.00 178.00 178.95 1npj h GLY 200 N -0.07 0.00 1.87 -0.55 0.00 -2.00 -2.68 103.07 99.63 1npj h GLY 200 Ca 0.10 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.37 1npj h GLY 200 CO -0.23 0.00 -0.23 -0.55 0.00 0.00 0.00 176.54 175.53 1npj h ASP 201 N 0.00 0.16 0.03 0.19 3.45 -1.71 -3.03 116.42 115.51 1npj h ASP 201 Ca -0.00 -0.04 0.00 0.00 0.43 0.00 0.00 57.03 57.42 1npj h ASP 201 Cb 0.10 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 38.83 1npj h ASP 201 CO 0.00 0.39 -0.07 0.00 -1.57 0.00 0.00 179.24 178.00 1npj n ALA 202 N -2.49 2.70 0.21 3.45 0.00 -1.01 -4.58 120.51 118.79 1npj n ALA 202 Ca -0.01 -0.48 -0.17 0.00 0.00 0.00 0.00 53.44 52.78 1npj n ALA 202 Cb 0.32 -1.10 -0.10 0.00 0.00 0.00 0.00 19.45 18.58 1npj n ALA 202 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1npj h TYR 203 N 2.44 -1.45 -0.35 0.00 5.03 -1.62 0.23 116.97 121.25 1npj h TYR 203 Ca 0.00 0.02 0.06 0.00 2.58 0.00 0.00 58.73 61.40 1npj h TYR 203 Cb 0.58 0.59 -0.06 0.00 1.55 0.00 0.00 36.73 39.39 1npj h TYR 203 CO 0.00 -0.63 -0.00 1.49 -1.32 0.00 0.00 178.16 177.70 1npj h GLU 204 N -0.88 0.09 -0.77 1.82 4.81 -1.82 -0.65 114.58 117.18 1npj h GLU 204 Ca -0.04 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1npj h GLU 204 Cb 0.81 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.13 1npj h GLU 204 CO -0.17 0.06 0.38 -0.44 -0.73 0.00 0.00 179.01 178.11 1npj h ASP 205 N 0.09 1.01 -0.56 1.04 3.45 -1.84 -2.89 116.42 116.73 1npj h ASP 205 Ca 0.17 -0.13 -0.11 0.00 0.43 0.00 0.00 57.03 57.39 1npj h ASP 205 Cb 0.23 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.73 1npj h ASP 205 CO -0.29 0.86 -0.06 0.74 -1.57 0.00 0.00 179.24 178.92 1npj h THR 206 N 1.09 1.27 -0.50 0.35 2.02 -0.35 -2.94 112.91 113.85 1npj h THR 206 Ca 0.27 -1.21 -0.05 0.00 0.77 0.00 0.00 66.41 66.18 1npj h THR 206 Cb 0.11 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.39 1npj h THR 206 CO -0.03 0.43 0.11 0.58 0.37 0.00 0.00 175.52 176.98 1npj h VAL 207 N 0.93 1.22 -0.78 3.16 2.07 -1.04 0.54 116.25 122.35 1npj h VAL 207 Ca 0.15 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1npj h VAL 207 Cb 0.62 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.07 1npj h VAL 207 CO 0.04 0.29 0.44 0.50 0.02 0.00 0.00 177.57 178.87 1npj h LYS 208 N 0.74 1.08 -0.35 1.57 3.64 -1.34 -1.43 116.57 120.49 1npj h LYS 208 Ca 0.16 -0.12 -0.16 0.00 -1.27 0.00 0.00 60.65 59.27 1npj h LYS 208 Cb 0.29 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1npj h LYS 208 CO -0.00 0.79 -0.41 0.28 -2.27 0.00 0.00 179.45 177.83 1npj h VAL 209 N 1.08 1.28 -0.72 2.00 2.07 -1.22 -3.03 116.25 117.70 1npj h VAL 209 Ca 0.28 -1.59 0.02 0.00 0.82 0.00 0.00 66.70 66.23 1npj h VAL 209 Cb 0.01 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 1npj h VAL 209 CO -0.05 0.52 0.48 0.24 0.02 0.00 0.00 177.57 178.78 1npj h MET 210 N 0.70 0.89 0.00 1.57 2.86 -0.55 -1.65 114.93 118.75 1npj h MET 210 Ca 0.05 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1npj h MET 210 Cb 0.99 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.45 1npj h MET 210 CO 0.10 0.59 0.00 0.00 1.06 0.00 0.00 176.91 178.66 1npj h ARG 211 N 0.92 0.00 0.00 1.72 3.08 -1.14 -1.11 114.38 117.85 1npj h ARG 211 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 1npj h ARG 211 Cb -0.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1npj h ARG 211 CO -0.07 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.08 1npj n THR 212 N -2.58 0.11 -2.15 2.04 -2.24 -0.62 -4.88 114.28 103.96 1npj n THR 212 Ca 0.00 0.03 -0.16 0.00 -2.27 0.00 0.00 64.05 61.65 1npj n THR 212 Cb 0.17 -0.56 -0.02 0.00 -2.10 0.00 0.00 70.33 67.82 1npj n THR 212 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1npj n LEU 213 N -1.47 -1.36 -3.82 3.22 4.77 -0.42 -4.92 117.00 112.99 1npj n LEU 213 Ca 0.08 0.19 -0.30 0.00 -0.03 0.00 0.00 56.01 55.95 1npj n LEU 213 Cb 0.31 -2.40 -0.15 0.00 -2.33 0.00 0.00 43.42 38.85 1npj n LEU 213 CO 0.25 -0.35 -0.33 -0.89 -1.33 0.00 0.00 177.39 174.74 1npj s THR 214 N -2.65 1.31 0.61 -5.08 2.01 -1.26 -5.12 115.64 105.46 1npj s THR 214 Ca 0.00 -1.68 -0.18 0.00 0.31 0.00 0.00 61.69 60.14 1npj s THR 214 Cb 0.00 -1.98 -0.03 0.00 0.01 0.00 0.00 72.50 70.51 1npj s THR 214 CO 0.00 -0.64 1.21 -2.16 -0.69 0.00 0.00 174.62 172.34 1npj s PRO 215 N 1.40 2.86 0.15 4.92 0.04 -1.26 -4.91 135.00 138.19 1npj s PRO 215 Ca 0.10 1.83 0.16 0.00 0.04 0.00 0.00 61.00 63.13 1npj s PRO 215 Cb -0.18 -1.91 -0.06 0.00 0.04 0.00 0.00 34.50 32.39 1npj s PRO 215 CO -0.20 -1.29 1.06 1.79 0.04 0.00 0.00 177.00 178.40 1npj h THR 216 N 0.73 0.61 -3.75 1.26 1.35 -1.53 -3.47 112.91 108.11 1npj h THR 216 Ca -0.50 -2.03 -0.20 0.00 -0.55 0.00 0.00 66.41 63.12 1npj h THR 216 Cb 1.30 2.15 -0.25 0.00 -1.73 0.00 0.00 68.15 69.62 1npj h THR 216 CO 0.54 0.35 -0.68 -1.00 -0.25 0.00 0.00 175.52 174.48 1npj s HIS 217 N -2.96 0.06 -0.19 4.73 3.76 -1.12 -4.87 115.29 114.70 1npj s HIS 217 Ca -0.00 -0.11 -0.03 0.00 -0.15 0.00 0.00 55.06 54.76 1npj s HIS 217 Cb 0.08 -0.05 0.06 0.00 1.11 0.00 0.00 32.58 33.78 1npj s HIS 217 CO 0.79 -0.08 0.05 0.08 -0.85 0.00 0.00 174.74 174.73 1npj s VAL 218 N -0.49 0.37 0.23 -0.90 1.01 -0.57 -0.76 120.40 119.29 1npj s VAL 218 Ca -0.05 -0.48 0.04 0.00 0.00 0.00 0.00 61.98 61.48 1npj s VAL 218 Cb -0.03 -0.93 -0.05 0.00 0.00 0.00 0.00 36.38 35.36 1npj s VAL 218 CO -0.00 -0.25 -0.02 0.68 0.00 0.00 0.00 175.10 175.51 1npj s VAL 219 N 1.93 1.10 -0.06 2.92 -7.23 -0.33 -0.09 120.40 118.64 1npj s VAL 219 Ca 0.00 -2.04 -0.00 0.00 -1.81 0.00 0.00 61.98 58.13 1npj s VAL 219 Cb -0.17 -2.32 -0.03 0.00 0.56 0.00 0.00 36.38 34.42 1npj s VAL 219 CO -0.09 -0.35 -0.02 -0.36 -0.31 0.00 0.00 175.10 173.98 1npj s PHE 220 N -3.37 3.08 -1.52 2.82 0.08 -1.26 0.06 117.98 117.87 1npj s PHE 220 Ca 0.28 0.12 -0.10 0.00 0.12 0.00 0.00 56.93 57.35 1npj s PHE 220 Cb 0.05 -1.74 0.08 0.00 -0.57 0.00 0.00 43.02 40.84 1npj s PHE 220 CO 0.08 0.44 0.75 -1.71 -0.10 0.00 0.00 175.22 174.68 1npj n ASN 221 N 1.94 -2.80 0.00 1.36 2.85 -0.65 -2.85 115.26 115.11 1npj n ASN 221 Ca -0.17 -0.91 0.00 0.00 -0.11 0.00 0.00 54.58 53.39 1npj n ASN 221 Cb 0.53 -3.37 0.00 0.00 1.24 0.00 0.00 39.78 38.18 1npj n ASN 221 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1npj n GLY 222 N -1.66 1.81 3.49 8.20 0.00 -0.77 -4.78 105.19 111.48 1npj n GLY 222 Ca -0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.83 1npj n GLY 222 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npj s ALA 223 N -2.89 -1.76 0.28 4.61 0.00 -1.13 -4.59 121.76 116.28 1npj s ALA 223 Ca 0.00 0.99 -0.30 0.00 0.00 0.00 0.00 51.96 52.64 1npj s ALA 223 Cb 0.00 0.33 -0.12 0.00 0.00 0.00 0.00 23.12 23.33 1npj s ALA 223 CO 0.00 -0.61 1.54 0.28 0.00 0.00 0.00 175.76 176.98 1npj n VAL 224 N 0.05 1.05 -0.94 0.00 0.31 0.17 -1.74 118.33 117.22 1npj n VAL 224 Ca -0.13 -0.26 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 1npj n VAL 224 Cb 0.61 -1.83 0.00 0.00 -0.91 0.00 0.00 33.84 31.71 1npj n VAL 224 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1npj n GLY 225 N 2.09 0.18 0.18 2.92 0.00 -1.26 -4.84 105.19 104.45 1npj n GLY 225 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.07 1npj n GLY 225 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npj h ALA 226 N 0.00 0.34 -0.84 4.61 0.00 -1.56 -2.40 119.26 119.41 1npj h ALA 226 Ca 0.00 0.15 -0.67 0.00 0.00 0.00 0.00 54.91 54.38 1npj h ALA 226 Cb 0.58 0.27 -0.24 0.00 0.00 0.00 0.00 17.79 18.41 1npj h ALA 226 CO 0.00 -0.42 0.83 1.28 0.00 0.00 0.00 179.25 180.94 1npj n LEU 227 N -5.27 7.17 -4.27 0.00 4.77 -1.26 -4.53 117.00 113.62 1npj n LEU 227 Ca 0.03 -4.56 -0.15 0.00 -0.03 0.00 0.00 56.01 51.31 1npj n LEU 227 Cb 0.23 -1.12 -0.10 0.00 -2.33 0.00 0.00 43.42 40.10 1npj n LEU 227 CO 0.16 1.74 -0.30 0.42 -1.33 0.00 0.00 177.39 178.09 1npj s THR 228 N -4.10 0.60 0.00 -5.08 -4.23 -0.90 -0.93 115.64 101.00 1npj s THR 228 Ca 0.54 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 59.07 1npj s THR 228 Cb 0.42 -2.35 0.00 0.00 1.34 0.00 0.00 72.50 71.91 1npj s THR 228 CO -0.34 -0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.09 1npj n GLY 229 N -0.34 3.65 0.14 3.99 0.00 -1.26 -0.96 105.19 110.41 1npj n GLY 229 Ca -0.03 0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.24 1npj n GLY 229 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1npj n ASP 230 N 6.42 0.40 -0.17 1.61 5.75 -1.26 -1.76 116.55 127.53 1npj n ASP 230 Ca 0.00 0.64 0.09 0.00 -0.01 0.00 0.00 54.79 55.51 1npj n ASP 230 Cb 0.00 -0.66 0.14 0.00 -1.03 0.00 0.00 41.12 39.57 1npj n ASP 230 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1npj n LYS 231 N -2.05 1.23 -2.28 0.11 5.02 -0.13 -5.04 118.16 115.02 1npj n LYS 231 Ca -0.01 -2.57 -0.39 0.00 -2.02 0.00 0.00 58.31 53.32 1npj n LYS 231 Cb 0.14 -1.45 -0.02 0.00 -0.02 0.00 0.00 35.03 33.68 1npj n LYS 231 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1npj s ALA 232 N -2.74 3.23 0.53 7.82 0.00 -0.72 -3.91 121.76 125.97 1npj s ALA 232 Ca 0.31 1.01 -0.17 0.00 0.00 0.00 0.00 51.96 53.10 1npj s ALA 232 Cb 0.28 -3.39 -0.07 0.00 0.00 0.00 0.00 23.12 19.94 1npj s ALA 232 CO 0.01 -0.51 1.01 -1.64 0.00 0.00 0.00 175.76 174.64 1npj s MET 233 N -2.13 3.76 0.23 0.00 -1.94 -0.30 -4.82 119.30 114.10 1npj s MET 233 Ca 0.54 1.11 0.09 0.00 -1.71 0.00 0.00 55.69 55.72 1npj s MET 233 Cb -0.32 -2.10 -0.05 0.00 2.01 0.00 0.00 34.83 34.37 1npj s MET 233 CO 0.41 -0.44 -0.17 0.95 -0.01 0.00 0.00 175.02 175.76 1npj s THR 234 N -2.44 2.03 0.17 2.05 -4.23 -1.26 -0.54 115.64 111.42 1npj s THR 234 Ca 0.62 -2.24 -0.21 0.00 -1.18 0.00 0.00 61.69 58.68 1npj s THR 234 Cb -0.13 -2.11 0.07 0.00 1.34 0.00 0.00 72.50 71.67 1npj s THR 234 CO 0.30 -0.48 0.99 0.00 -0.54 0.00 0.00 174.62 174.89 1npj n ALA 235 N -0.37 -2.60 -2.89 3.99 0.00 -0.93 -4.92 120.51 112.78 1npj n ALA 235 Ca -0.08 -0.98 -0.09 0.00 0.00 0.00 0.00 53.44 52.29 1npj n ALA 235 Cb 0.60 0.54 -0.10 0.00 0.00 0.00 0.00 19.45 20.48 1npj n ALA 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1npj s ALA 236 N -1.99 0.03 0.16 0.00 0.00 -1.26 -2.00 121.76 116.70 1npj s ALA 236 Ca 0.22 -0.54 -0.33 0.00 0.00 0.00 0.00 51.96 51.31 1npj s ALA 236 Cb -0.03 0.17 -0.16 0.00 0.00 0.00 0.00 23.12 23.10 1npj s ALA 236 CO 0.05 -0.21 1.16 0.28 0.00 0.00 0.00 175.76 177.04 1npj n VAL 237 N 1.31 0.83 0.00 0.00 0.31 0.28 -0.45 118.33 120.62 1npj n VAL 237 Ca -0.22 -0.21 0.00 0.00 -0.01 0.00 0.00 64.34 63.90 1npj n VAL 237 Cb 0.56 -0.81 0.00 0.00 -0.91 0.00 0.00 33.84 32.69 1npj n VAL 237 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1npj n GLY 238 N 2.03 3.13 3.74 2.92 0.00 0.17 -4.98 105.19 112.21 1npj n GLY 238 Ca 0.15 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 1npj n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1npj s GLU 239 N -0.71 4.74 -0.19 1.61 2.02 0.41 -4.80 118.70 121.77 1npj s GLU 239 Ca 0.00 1.58 -0.17 0.00 0.02 0.00 0.00 54.97 56.40 1npj s GLU 239 Cb 0.00 -3.29 -0.04 0.00 0.10 0.00 0.00 34.13 30.91 1npj s GLU 239 CO 0.00 0.31 0.44 0.15 0.02 0.00 0.00 175.26 176.19 1npj s LYS 240 N -0.80 4.19 -0.05 1.61 1.02 -1.26 -1.89 119.74 122.56 1npj s LYS 240 Ca 0.45 0.29 0.03 0.00 0.02 0.00 0.00 55.97 56.75 1npj s LYS 240 Cb -0.27 -3.54 0.00 0.00 -0.52 0.00 0.00 37.83 33.51 1npj s LYS 240 CO 0.34 -0.06 -0.14 0.08 -0.92 0.00 0.00 175.35 174.65 1npj s VAL 241 N 1.35 1.21 -0.20 3.17 1.01 0.09 -0.33 120.40 126.70 1npj s VAL 241 Ca 0.21 -0.57 -0.08 0.00 0.00 0.00 0.00 61.98 61.55 1npj s VAL 241 Cb -0.15 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.12 1npj s VAL 241 CO 0.09 0.36 0.07 -0.22 0.00 0.00 0.00 175.10 175.40 1npj s LEU 242 N 0.31 3.76 -0.33 3.92 2.96 -0.60 -1.20 118.68 127.50 1npj s LEU 242 Ca -0.08 0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 53.83 1npj s LEU 242 Cb -0.13 -1.96 0.06 0.00 0.50 0.00 0.00 46.19 44.66 1npj s LEU 242 CO 0.03 0.13 0.05 -0.63 -1.32 0.00 0.00 176.35 174.60 1npj s ILE 243 N 0.65 3.06 0.09 6.68 -1.09 0.10 -1.53 121.20 129.16 1npj s ILE 243 Ca 0.04 -1.54 -0.22 0.00 -2.23 0.00 0.00 60.65 56.69 1npj s ILE 243 Cb -0.13 -2.84 -0.07 0.00 -1.58 0.00 0.00 42.46 37.84 1npj s ILE 243 CO 0.02 -0.25 0.66 -0.69 -1.23 0.00 0.00 174.94 173.45 1npj s VAL 244 N 1.22 4.63 -0.05 2.92 1.01 0.18 -1.94 120.40 128.38 1npj s VAL 244 Ca -0.02 1.43 -0.03 0.00 0.00 0.00 0.00 61.98 63.37 1npj s VAL 244 Cb -0.20 -4.01 0.03 0.00 0.00 0.00 0.00 36.38 32.20 1npj s VAL 244 CO -0.02 0.51 0.12 -2.28 0.00 0.00 0.00 175.10 173.43 1npj s HIS 245 N -0.89 -0.12 0.14 5.22 2.46 -0.65 -0.47 115.29 120.98 1npj s HIS 245 Ca 0.33 0.37 0.03 0.00 0.47 0.00 0.00 55.06 56.26 1npj s HIS 245 Cb -0.21 -0.06 -0.04 0.00 -0.13 0.00 0.00 32.58 32.14 1npj s HIS 245 CO 0.22 -0.12 -0.07 -1.54 -2.47 0.00 0.00 174.74 170.76 1npj s SER 246 N 0.75 1.54 -0.27 9.88 1.04 -0.90 -0.70 113.70 125.03 1npj s SER 246 Ca -0.06 -1.05 -0.02 0.00 0.48 0.00 0.00 55.95 55.31 1npj s SER 246 Cb -0.08 0.04 0.16 0.00 0.10 0.00 0.00 66.02 66.24 1npj s SER 246 CO -0.03 -0.41 0.46 -1.58 0.98 0.00 0.00 173.24 172.65 1npj s GLN 247 N -3.80 0.43 0.25 4.02 -0.44 -0.87 -1.53 119.66 117.72 1npj s GLN 247 Ca 0.17 0.68 0.26 0.00 -2.50 0.00 0.00 55.36 53.96 1npj s GLN 247 Cb 0.04 -0.10 0.83 0.00 -1.64 0.00 0.00 33.01 32.14 1npj s GLN 247 CO -0.00 -0.66 1.76 0.00 0.50 0.00 0.00 175.29 176.89 1npj h ALA 248 N 8.12 1.00 0.00 1.58 0.00 -1.81 0.23 119.26 128.37 1npj h ALA 248 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1npj h ALA 248 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1npj h ALA 248 CO 0.27 0.00 -0.45 -1.71 0.00 0.00 0.00 179.25 177.35 1npj n ASN 249 N -2.34 2.26 -3.91 0.00 5.15 -1.26 -3.21 115.26 111.95 1npj n ASN 249 Ca 0.05 0.00 -0.10 0.00 -0.60 0.00 0.00 54.58 53.92 1npj n ASN 249 Cb 0.39 0.41 -0.10 0.00 -0.53 0.00 0.00 39.78 39.95 1npj n ASN 249 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1npj s ARG 250 N -1.00 0.43 0.79 1.20 3.52 -1.26 -4.67 118.95 117.96 1npj s ARG 250 Ca 0.00 -0.49 -0.14 0.00 -0.13 0.00 0.00 55.73 54.97 1npj s ARG 250 Cb 0.00 0.17 0.06 0.00 -1.56 0.00 0.00 34.95 33.62 1npj s ARG 250 CO 0.00 -0.09 1.13 -0.25 -0.81 0.00 0.00 175.30 175.27 1npj n ASP 251 N 1.47 0.84 -3.82 -2.12 10.43 -1.26 -3.46 116.55 118.63 1npj n ASP 251 Ca -0.23 0.60 -0.09 0.00 2.57 0.00 0.00 54.79 57.64 1npj n ASP 251 Cb 0.55 -1.48 -0.06 0.00 1.84 0.00 0.00 41.12 41.97 1npj n ASP 251 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1npj s THR 252 N -2.04 0.11 -0.40 -3.53 -1.32 -0.15 -4.81 115.64 103.49 1npj s THR 252 Ca 0.73 -1.06 0.03 0.00 -1.21 0.00 0.00 61.69 60.18 1npj s THR 252 Cb -0.30 -1.41 0.16 0.00 -1.51 0.00 0.00 72.50 69.44 1npj s THR 252 CO 0.51 -0.48 0.30 0.00 -2.21 0.00 0.00 174.62 172.74 1npj s ARG 253 N -3.87 0.86 0.52 7.08 1.70 -1.26 -1.18 118.95 122.81 1npj s ARG 253 Ca 0.07 -1.88 -0.22 0.00 -0.47 0.00 0.00 55.73 53.22 1npj s ARG 253 Cb 0.04 -1.49 -0.06 0.00 -0.57 0.00 0.00 34.95 32.87 1npj s ARG 253 CO -0.09 -1.31 1.37 -2.14 -1.08 0.00 0.00 175.30 172.05 1npj s PRO 254 N 0.37 3.27 -0.21 3.89 0.02 -1.09 0.18 135.00 141.43 1npj s PRO 254 Ca 0.27 2.26 -0.11 0.00 0.02 0.00 0.00 61.00 63.43 1npj s PRO 254 Cb -0.07 -2.34 0.07 0.00 0.02 0.00 0.00 34.50 32.18 1npj s PRO 254 CO -0.12 -1.09 0.50 -1.58 -0.33 0.00 0.00 177.00 174.38 1npj s HIS 255 N -1.29 -0.77 -0.47 6.54 2.46 -0.09 -1.85 115.29 119.82 1npj s HIS 255 Ca 0.69 1.59 -0.18 0.00 0.47 0.00 0.00 55.06 57.63 1npj s HIS 255 Cb -0.41 0.40 0.05 0.00 -0.13 0.00 0.00 32.58 32.49 1npj s HIS 255 CO 0.49 -0.41 0.53 -1.17 -2.47 0.00 0.00 174.74 171.71 1npj s LEU 256 N 1.55 5.04 -0.25 8.88 2.96 -1.26 -0.94 118.68 134.66 1npj s LEU 256 Ca -0.09 -0.89 -0.29 0.00 -0.22 0.00 0.00 54.13 52.63 1npj s LEU 256 Cb -0.08 -2.40 -0.02 0.00 0.50 0.00 0.00 46.19 44.20 1npj s LEU 256 CO -0.15 -0.75 1.59 -0.63 -1.32 0.00 0.00 176.35 175.08 1npj s ILE 257 N 2.31 3.74 0.00 6.68 1.01 0.10 -1.41 121.20 133.63 1npj s ILE 257 Ca 0.13 0.82 0.00 0.00 0.00 0.00 0.00 60.65 61.59 1npj s ILE 257 Cb -0.19 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1npj s ILE 257 CO 0.12 -0.35 0.00 0.61 0.00 0.00 0.00 174.94 175.32 1npj n GLY 258 N 4.72 0.95 0.00 6.18 0.00 -1.26 -3.62 105.19 112.15 1npj n GLY 258 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1npj n GLY 258 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1npj n GLY 259 N -1.38 5.90 3.09 -0.02 0.00 -0.50 -5.00 105.19 107.28 1npj n GLY 259 Ca 0.00 -1.58 -0.11 0.00 0.00 0.00 0.00 46.02 44.33 1npj n GLY 259 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1npj n HIS 260 N 0.00 -1.67 -3.64 1.61 -0.00 -1.26 -4.72 115.22 105.54 1npj n HIS 260 Ca 0.00 -1.90 -0.39 0.00 -0.00 0.00 0.00 57.72 55.43 1npj n HIS 260 Cb 0.00 0.61 -0.09 0.00 -0.00 0.00 0.00 29.99 30.51 1npj n HIS 260 CO 0.00 0.00 0.00 0.20 -0.00 0.00 0.00 176.34 176.54 1npj s GLY 261 N -2.87 2.26 0.21 -1.41 0.00 0.20 -4.72 107.32 100.98 1npj s GLY 261 Ca 0.21 -2.88 -0.10 0.00 0.00 0.00 0.00 44.72 41.95 1npj s GLY 261 CO 0.15 1.10 1.81 -0.55 0.00 0.00 0.00 173.10 175.62 1npj h ASP 262 N 7.78 0.54 -3.35 1.64 3.32 -1.56 -0.39 116.42 124.41 1npj h ASP 262 Ca -0.09 0.03 -0.44 0.00 0.02 0.00 0.00 57.03 56.55 1npj h ASP 262 Cb 1.02 -0.08 -0.36 0.00 0.22 0.00 0.00 39.33 40.14 1npj h ASP 262 CO 0.76 0.35 -0.78 -0.31 -1.72 0.00 0.00 179.24 177.55 1npj s TYR 263 N -6.10 0.87 -0.13 4.55 1.51 -0.89 -1.83 117.35 115.33 1npj s TYR 263 Ca -0.13 -0.29 -0.01 0.00 -1.01 0.00 0.00 57.07 55.63 1npj s TYR 263 Cb 0.16 -0.81 0.03 0.00 -0.11 0.00 0.00 41.96 41.23 1npj s TYR 263 CO 0.76 -0.28 -0.05 0.08 -1.11 0.00 0.00 175.55 174.95 1npj s VAL 264 N 1.33 0.92 -1.13 0.71 1.01 0.15 -0.31 120.40 123.09 1npj s VAL 264 Ca -0.04 -0.38 -0.15 0.00 0.00 0.00 0.00 61.98 61.40 1npj s VAL 264 Cb -0.14 -1.06 0.15 0.00 0.00 0.00 0.00 36.38 35.34 1npj s VAL 264 CO -0.02 0.21 1.35 0.26 0.00 0.00 0.00 175.10 176.90 1npj s TRP 265 N 1.73 3.36 0.27 5.22 0.51 0.47 0.19 118.94 130.69 1npj s TRP 265 Ca 0.03 -1.89 -0.04 0.00 -2.12 0.00 0.00 56.10 52.08 1npj s TRP 265 Cb -0.14 -4.32 0.35 0.00 -0.81 0.00 0.00 33.47 28.55 1npj s TRP 265 CO -0.08 -1.44 1.93 0.00 -0.51 0.00 0.00 176.95 176.85 1npj h ALA 266 N 7.68 1.32 0.00 0.98 0.00 -1.89 0.41 119.26 127.76 1npj h ALA 266 Ca 0.27 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1npj h ALA 266 Cb 0.92 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1npj h ALA 266 CO 1.21 0.60 0.00 0.25 0.00 0.00 0.00 179.25 181.31 1npj n THR 267 N -4.38 0.23 -0.93 0.00 -2.24 -1.26 -4.47 114.28 101.23 1npj n THR 267 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 1npj n THR 267 Cb 0.05 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 67.68 1npj n THR 267 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1npj n GLY 268 N 1.24 0.89 3.53 3.38 0.00 0.08 -4.68 105.19 109.64 1npj n GLY 268 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 1npj n GLY 268 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1npj s LYS 269 N -0.07 3.80 0.53 1.61 -0.14 -1.26 -0.06 119.74 124.15 1npj s LYS 269 Ca 0.00 -0.42 0.31 0.00 -1.36 0.00 0.00 55.97 54.50 1npj s LYS 269 Cb 0.00 -3.26 1.44 0.00 -1.68 0.00 0.00 37.83 34.33 1npj s LYS 269 CO 0.00 0.03 2.03 0.74 -0.76 0.00 0.00 175.35 177.39 1npj h PHE 270 N 7.51 0.00 -0.00 3.18 0.05 -1.73 -2.40 116.94 123.55 1npj h PHE 270 Ca -0.37 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.42 1npj h PHE 270 Cb 1.18 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.13 1npj h PHE 270 CO 0.62 0.10 -0.04 0.09 -0.18 0.00 0.00 178.31 178.90 1npj n ASN 271 N -3.36 0.42 -4.50 2.17 3.02 -1.26 -4.55 115.26 107.19 1npj n ASN 271 Ca -0.01 -0.86 -0.39 0.00 -0.03 0.00 0.00 54.58 53.29 1npj n ASN 271 Cb 0.28 -0.05 -0.11 0.00 -0.61 0.00 0.00 39.78 39.28 1npj n ASN 271 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1npj s THR 272 N -2.22 5.05 0.26 3.41 2.01 -0.90 -5.05 115.64 118.20 1npj s THR 272 Ca 0.38 -0.25 -0.28 0.00 0.31 0.00 0.00 61.69 61.85 1npj s THR 272 Cb 0.21 -3.57 -0.15 0.00 0.01 0.00 0.00 72.50 69.00 1npj s THR 272 CO 0.41 0.04 0.86 -2.65 -0.69 0.00 0.00 174.62 172.59 1npj n PRO 273 N 5.06 0.92 -2.56 4.92 -0.02 -1.26 -4.85 135.00 137.20 1npj n PRO 273 Ca -0.13 0.32 -0.34 0.00 -2.02 0.00 0.00 63.50 61.33 1npj n PRO 273 Cb 0.50 -1.58 -0.04 0.00 -0.02 0.00 0.00 33.50 32.36 1npj n PRO 273 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1npj s PRO 274 N -1.35 3.87 0.62 0.52 0.04 -1.26 -4.91 135.00 132.53 1npj s PRO 274 Ca 0.61 1.28 -0.12 0.00 0.04 0.00 0.00 61.00 62.81 1npj s PRO 274 Cb -0.78 -2.11 -0.04 0.00 0.04 0.00 0.00 34.50 31.61 1npj s PRO 274 CO 0.59 -0.36 1.03 -0.51 0.04 0.00 0.00 177.00 177.79 1npj s ASP 275 N -2.13 6.12 0.16 6.66 1.01 0.13 -4.71 116.67 123.90 1npj s ASP 275 Ca 0.65 1.48 0.06 0.00 0.71 0.00 0.00 52.55 55.45 1npj s ASP 275 Cb -0.14 -2.48 -0.04 0.00 1.01 0.00 0.00 42.92 41.26 1npj s ASP 275 CO 0.20 -0.95 -0.13 0.68 0.21 0.00 0.00 175.17 175.18 1npj s VAL 276 N -3.08 1.45 -1.49 -1.27 -7.23 -1.26 0.34 120.40 107.86 1npj s VAL 276 Ca 0.56 -1.98 -0.06 0.00 -1.81 0.00 0.00 61.98 58.69 1npj s VAL 276 Cb -0.12 -1.80 0.02 0.00 0.56 0.00 0.00 36.38 35.05 1npj s VAL 276 CO 0.51 -0.56 0.61 0.47 -0.31 0.00 0.00 175.10 175.83 1npj n ASP 277 N 0.03 -5.54 -4.75 4.85 10.43 -0.76 -4.94 116.55 115.87 1npj n ASP 277 Ca -0.12 -0.33 -0.41 0.00 2.57 0.00 0.00 54.79 56.51 1npj n ASP 277 Cb 0.59 -4.49 -0.04 0.00 1.84 0.00 0.00 41.12 39.03 1npj n ASP 277 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1npj s GLN 278 N -5.81 4.56 -0.22 -1.24 -1.52 -0.17 -4.84 119.66 110.42 1npj s GLN 278 Ca 0.34 1.87 -0.17 0.00 -1.95 0.00 0.00 55.36 55.45 1npj s GLN 278 Cb -0.16 -3.20 -0.18 0.00 -0.22 0.00 0.00 33.01 29.25 1npj s GLN 278 CO 0.42 0.07 0.07 -0.85 -0.25 0.00 0.00 175.29 174.75 1npj n GLU 279 N 1.62 0.60 -3.71 2.91 0.28 -1.26 -0.63 120.64 120.44 1npj n GLU 279 Ca 0.01 0.45 -0.16 0.00 -0.16 0.00 0.00 57.16 57.30 1npj n GLU 279 Cb 0.44 -1.67 -0.16 0.00 1.43 0.00 0.00 31.44 31.48 1npj n GLU 279 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 1npj s THR 280 N -2.43 -0.13 0.49 3.84 2.01 -1.26 -4.39 115.64 113.78 1npj s THR 280 Ca -0.31 0.29 0.07 0.00 0.31 0.00 0.00 61.69 62.06 1npj s THR 280 Cb 0.08 -0.21 0.02 0.00 0.01 0.00 0.00 72.50 72.41 1npj s THR 280 CO 0.59 0.12 0.48 -1.66 -0.69 0.00 0.00 174.62 173.46 1npj s TRP 281 N 1.70 2.06 -0.05 4.92 -2.14 -0.77 -4.97 118.94 119.68 1npj s TRP 281 Ca -0.03 -0.66 0.02 0.00 2.66 0.00 0.00 56.10 58.10 1npj s TRP 281 Cb -0.12 -2.10 0.01 0.00 -3.10 0.00 0.00 33.47 28.16 1npj s TRP 281 CO -0.05 -0.48 -0.10 0.12 -2.66 0.00 0.00 176.95 173.78 1npj s PHE 282 N -2.61 1.21 -0.16 1.66 5.36 -1.26 -2.66 117.98 119.52 1npj s PHE 282 Ca 0.46 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 56.04 1npj s PHE 282 Cb -0.04 -0.90 0.03 0.00 -0.34 0.00 0.00 43.02 41.77 1npj s PHE 282 CO 0.28 -0.21 -0.09 0.42 -1.46 0.00 0.00 175.22 174.15 1npj s ILE 283 N 0.57 1.38 0.49 3.12 1.01 -0.32 -4.71 121.20 122.74 1npj s ILE 283 Ca -0.11 -0.70 -0.21 0.00 0.00 0.00 0.00 60.65 59.64 1npj s ILE 283 Cb -0.14 -1.43 -0.08 0.00 0.01 0.00 0.00 42.46 40.82 1npj s ILE 283 CO 0.02 0.26 1.08 -2.16 0.00 0.00 0.00 174.94 174.14 1npj s PRO 284 N 1.53 3.70 0.21 2.79 0.04 -1.26 -0.97 135.00 141.05 1npj s PRO 284 Ca 0.02 1.49 -0.32 0.00 0.04 0.00 0.00 61.00 62.23 1npj s PRO 284 Cb -0.15 -2.15 -0.14 0.00 0.04 0.00 0.00 34.50 32.10 1npj s PRO 284 CO -0.09 -0.54 1.27 0.41 0.04 0.00 0.00 177.00 178.10 1npj n GLY 285 N 0.01 0.38 0.58 0.56 0.00 -1.23 -1.91 105.19 103.59 1npj n GLY 285 Ca 0.09 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1npj n GLY 285 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1npj n GLY 286 N 2.01 0.84 3.47 -0.02 0.00 0.79 -4.77 105.19 107.51 1npj n GLY 286 Ca 0.13 -0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 1npj n GLY 286 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npj s ALA 287 N -2.00 0.29 0.11 4.61 0.00 -0.80 -4.78 121.76 119.19 1npj s ALA 287 Ca 0.00 -1.20 0.07 0.00 0.00 0.00 0.00 51.96 50.84 1npj s ALA 287 Cb 0.00 1.17 -0.04 0.00 0.00 0.00 0.00 23.12 24.26 1npj s ALA 287 CO 0.00 -0.77 -0.18 0.00 0.00 0.00 0.00 175.76 174.81 1npj s ALA 288 N -3.93 1.70 0.28 0.00 0.00 -1.26 -2.04 121.76 116.52 1npj s ALA 288 Ca 0.28 -1.27 0.03 0.00 0.00 0.00 0.00 51.96 51.00 1npj s ALA 288 Cb 0.02 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 22.91 1npj s ALA 288 CO 0.11 0.26 0.17 0.20 0.00 0.00 0.00 175.76 176.50 1npj s GLY 289 N -2.13 1.96 -0.14 0.00 0.00 0.12 -3.26 107.32 103.87 1npj s GLY 289 Ca 0.07 -1.80 -0.12 0.00 0.00 0.00 0.00 44.72 42.88 1npj s GLY 289 CO 0.04 -1.53 0.37 0.00 0.00 0.00 0.00 173.10 171.98 1npj s ALA 290 N -3.70 -0.92 0.01 3.20 0.00 -0.86 -1.63 121.76 117.85 1npj s ALA 290 Ca 0.37 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.51 1npj s ALA 290 Cb 0.05 -0.65 -0.02 0.00 0.00 0.00 0.00 23.12 22.50 1npj s ALA 290 CO 0.18 -0.19 -0.21 0.00 0.00 0.00 0.00 175.76 175.54 1npj s ALA 291 N 0.40 1.77 -0.16 0.00 0.00 -0.82 -0.40 121.76 122.56 1npj s ALA 291 Ca -0.02 -0.97 -0.00 0.00 0.00 0.00 0.00 51.96 50.97 1npj s ALA 291 Cb -0.04 -0.41 -0.00 0.00 0.00 0.00 0.00 23.12 22.67 1npj s ALA 291 CO -0.02 0.42 -0.14 0.12 0.00 0.00 0.00 175.76 176.14 1npj s PHE 292 N -0.61 2.80 -0.03 0.00 2.19 0.58 0.01 117.98 122.91 1npj s PHE 292 Ca 0.08 -1.01 -0.03 0.00 0.33 0.00 0.00 56.93 56.31 1npj s PHE 292 Cb -0.08 -1.90 0.01 0.00 -1.31 0.00 0.00 43.02 39.73 1npj s PHE 292 CO 0.00 -0.46 0.08 -0.47 1.83 0.00 0.00 175.22 176.21 1npj s TYR 293 N 0.83 -0.09 -0.33 10.12 5.04 -0.34 -1.50 117.35 131.07 1npj s TYR 293 Ca -0.05 0.23 -0.10 0.00 -2.44 0.00 0.00 57.07 54.71 1npj s TYR 293 Cb -0.15 0.02 0.01 0.00 0.35 0.00 0.00 41.96 42.19 1npj s TYR 293 CO -0.00 -0.05 0.17 0.99 -1.34 0.00 0.00 175.55 175.32 1npj s THR 294 N 0.11 4.53 0.31 4.34 2.01 -1.26 -0.74 115.64 124.94 1npj s THR 294 Ca -0.01 -0.62 -0.29 0.00 0.31 0.00 0.00 61.69 61.08 1npj s THR 294 Cb -0.01 -3.40 -0.11 0.00 0.01 0.00 0.00 72.50 68.99 1npj s THR 294 CO -0.00 -0.05 1.50 -0.36 -0.69 0.00 0.00 174.62 175.01 1npj s PHE 295 N 1.58 2.80 0.00 4.92 0.40 -0.79 -4.85 117.98 122.04 1npj s PHE 295 Ca 0.03 1.01 0.00 0.00 -0.60 0.00 0.00 56.93 57.37 1npj s PHE 295 Cb -0.18 -3.96 0.00 0.00 0.51 0.00 0.00 43.02 39.39 1npj s PHE 295 CO 0.06 -3.03 0.17 1.04 0.70 0.00 0.00 175.22 174.17 1npj n GLN 296 N 1.60 2.61 -4.03 0.44 6.02 -1.26 0.46 117.38 123.23 1npj n GLN 296 Ca 0.05 -0.17 -0.14 0.00 -0.01 0.00 0.00 57.00 56.73 1npj n GLN 296 Cb 0.39 -0.61 -0.14 0.00 1.02 0.00 0.00 30.24 30.90 1npj n GLN 296 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1npj s GLN 297 N -0.42 0.26 0.82 -1.09 -1.52 -1.26 -4.58 119.66 111.87 1npj s GLN 297 Ca 0.00 -0.18 -0.09 0.00 -1.95 0.00 0.00 55.36 53.14 1npj s GLN 297 Cb 0.00 -0.21 0.14 0.00 -0.22 0.00 0.00 33.01 32.71 1npj s GLN 297 CO 0.00 0.06 1.15 -1.25 -0.25 0.00 0.00 175.29 175.00 1npj s PRO 298 N -0.25 1.42 0.00 2.91 0.04 -1.26 -4.76 135.00 133.10 1npj s PRO 298 Ca -0.01 -0.49 0.00 0.00 0.04 0.00 0.00 61.00 60.54 1npj s PRO 298 Cb -0.02 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.46 1npj s PRO 298 CO -0.00 -1.80 0.00 0.41 0.04 0.00 0.00 177.00 175.65 1npj n GLY 299 N -3.28 -0.52 3.79 0.56 0.00 0.46 -4.93 105.19 101.27 1npj n GLY 299 Ca 0.13 -2.25 -0.38 0.00 0.00 0.00 0.00 46.02 43.51 1npj n GLY 299 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1npj s ILE 300 N -0.44 4.94 0.10 -0.61 2.07 -1.26 -1.03 121.20 124.98 1npj s ILE 300 Ca 0.00 1.05 0.09 0.00 -1.41 0.00 0.00 60.65 60.38 1npj s ILE 300 Cb 0.00 -3.83 -0.03 0.00 0.13 0.00 0.00 42.46 38.73 1npj s ILE 300 CO 0.00 0.50 -0.22 -0.31 -1.91 0.00 0.00 174.94 173.00 1npj s TYR 301 N -0.62 1.88 0.07 3.50 1.51 0.12 -4.98 117.35 118.82 1npj s TYR 301 Ca 0.27 -0.41 0.05 0.00 -1.01 0.00 0.00 57.07 55.98 1npj s TYR 301 Cb -0.18 -1.03 -0.04 0.00 -0.11 0.00 0.00 41.96 40.60 1npj s TYR 301 CO 0.15 0.22 -0.07 0.00 -1.11 0.00 0.00 175.55 174.74 1npj s ALA 302 N -1.12 3.03 -0.13 3.71 0.00 -1.24 -0.79 121.76 125.22 1npj s ALA 302 Ca 0.08 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1npj s ALA 302 Cb -0.10 -1.02 0.02 0.00 0.00 0.00 0.00 23.12 22.02 1npj s ALA 302 CO 0.04 0.64 -0.15 -0.47 0.00 0.00 0.00 175.76 175.83 1npj s TYR 303 N -1.15 2.13 0.17 0.00 5.04 0.88 0.00 117.35 124.42 1npj s TYR 303 Ca 0.21 -1.12 -0.01 0.00 -2.44 0.00 0.00 57.07 53.71 1npj s TYR 303 Cb -0.11 -1.55 -0.04 0.00 0.35 0.00 0.00 41.96 40.61 1npj s TYR 303 CO 0.12 -0.60 0.08 0.14 -1.34 0.00 0.00 175.55 173.96 1npj s VAL 304 N 1.27 0.15 -0.24 3.14 -7.23 -0.12 -0.07 120.40 117.31 1npj s VAL 304 Ca 0.00 -1.96 -0.23 0.00 -1.81 0.00 0.00 61.98 57.99 1npj s VAL 304 Cb -0.14 -2.27 -0.01 0.00 0.56 0.00 0.00 36.38 34.53 1npj s VAL 304 CO -0.07 -0.26 0.75 0.21 -0.31 0.00 0.00 175.10 175.43 1npj s ASN 305 N -3.12 6.74 0.00 4.85 3.84 -1.05 -0.91 114.94 125.30 1npj s ASN 305 Ca 0.31 0.92 0.00 0.00 0.21 0.00 0.00 52.86 54.30 1npj s ASN 305 Cb 0.07 -2.40 0.00 0.00 -0.55 0.00 0.00 41.25 38.37 1npj s ASN 305 CO 0.07 -0.45 0.55 1.57 -2.79 0.00 0.00 177.10 176.04 1npj n HIS 306 N 5.85 0.00 -3.06 0.43 -0.00 0.13 -3.92 115.22 114.64 1npj n HIS 306 Ca 0.03 -0.10 -0.44 0.00 -0.00 0.00 0.00 57.72 57.22 1npj n HIS 306 Cb 0.48 -0.12 -0.05 0.00 -0.00 0.00 0.00 29.99 30.30 1npj n HIS 306 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1npj s ASN 307 N 0.13 6.22 0.66 0.26 3.84 -1.26 -4.90 114.94 119.89 1npj s ASN 307 Ca 0.00 -1.01 0.42 0.00 0.21 0.00 0.00 52.86 52.48 1npj s ASN 307 Cb 0.00 -2.33 2.29 0.00 -0.55 0.00 0.00 41.25 40.66 1npj s ASN 307 CO 0.00 -1.07 2.29 -0.07 -2.79 0.00 0.00 177.10 175.46 1npj h LEU 308 N 10.16 0.00 -0.10 3.21 3.38 -1.99 0.96 115.31 130.92 1npj h LEU 308 Ca -0.28 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.53 1npj h LEU 308 Cb 1.09 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.84 1npj h LEU 308 CO 1.05 0.00 -0.54 0.40 0.09 0.00 0.00 178.44 179.44 1npj h ILE 309 N 0.00 1.36 -0.36 1.22 2.04 -1.90 0.12 117.51 119.98 1npj h ILE 309 Ca 0.00 -1.85 -0.07 0.00 1.00 0.00 0.00 64.86 63.94 1npj h ILE 309 Cb 0.11 2.19 -0.02 0.00 -0.74 0.00 0.00 36.82 38.36 1npj h ILE 309 CO 0.00 0.56 -0.06 -0.33 0.00 0.00 0.00 178.15 178.32 1npj h GLU 310 N 0.16 0.60 0.01 2.37 5.08 -1.19 0.73 114.58 122.34 1npj h GLU 310 Ca -0.04 -0.16 -0.15 0.00 -1.00 0.00 0.00 59.36 58.01 1npj h GLU 310 Cb 1.19 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.38 1npj h GLU 310 CO 0.11 0.67 -0.57 0.00 -1.00 0.00 0.00 179.01 178.22 1npj h ALA 311 N 1.37 0.05 -0.01 3.43 0.00 -1.08 -0.98 119.26 122.05 1npj h ALA 311 Ca 0.11 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1npj h ALA 311 Cb 0.45 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1npj h ALA 311 CO 0.02 0.32 -0.23 1.19 0.00 0.00 0.00 179.25 180.56 1npj n PHE 312 N -4.25 0.00 -0.03 0.00 3.01 0.40 -2.50 117.46 114.09 1npj n PHE 312 Ca -0.11 0.00 -0.04 0.00 1.01 0.00 0.00 57.45 58.31 1npj n PHE 312 Cb 0.66 0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 40.11 1npj n PHE 312 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1npj n GLU 313 N 0.20 0.50 0.01 -1.08 -0.58 0.14 -4.76 120.64 115.08 1npj n GLU 313 Ca 0.08 0.03 0.11 0.00 -0.42 0.00 0.00 57.16 56.96 1npj n GLU 313 Cb 0.36 -1.12 0.02 0.00 -0.57 0.00 0.00 31.44 30.13 1npj n GLU 313 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1npj n LEU 314 N -2.62 0.67 0.00 -4.62 4.32 -0.56 -5.01 117.00 109.18 1npj n LEU 314 Ca -0.10 -0.15 0.00 0.00 -0.02 0.00 0.00 56.01 55.74 1npj n LEU 314 Cb 0.62 -0.10 0.00 0.00 -1.62 0.00 0.00 43.42 42.32 1npj n LEU 314 CO 0.06 0.11 0.00 0.61 -1.22 0.00 0.00 177.39 176.96 1npj n GLY 315 N 1.43 0.83 2.57 -0.72 0.00 -1.01 -1.52 105.19 106.77 1npj n GLY 315 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1npj n GLY 315 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1npj n ALA 316 N -1.23 6.39 -3.46 4.61 0.00 0.87 -4.26 120.51 123.43 1npj n ALA 316 Ca 0.00 -3.83 -0.12 0.00 0.00 0.00 0.00 53.44 49.49 1npj n ALA 316 Cb 0.00 -3.34 -0.12 0.00 0.00 0.00 0.00 19.45 15.99 1npj n ALA 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1npj s ALA 317 N 2.05 -0.58 0.35 0.00 0.00 -1.25 -2.51 121.76 119.82 1npj s ALA 317 Ca 0.55 0.86 0.05 0.00 0.00 0.00 0.00 51.96 53.43 1npj s ALA 317 Cb 0.15 -0.53 -0.07 0.00 0.00 0.00 0.00 23.12 22.67 1npj s ALA 317 CO -0.07 -0.16 0.02 0.00 0.00 0.00 0.00 175.76 175.55 1npj s ALA 318 N 0.77 2.66 0.16 0.00 0.00 0.90 -4.54 121.76 121.71 1npj s ALA 318 Ca -0.05 -2.13 0.09 0.00 0.00 0.00 0.00 51.96 49.86 1npj s ALA 318 Cb -0.07 0.41 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 1npj s ALA 318 CO -0.05 -0.20 -0.19 -1.01 0.00 0.00 0.00 175.76 174.31 1npj s HIS 319 N -3.04 1.85 -0.06 0.00 3.76 -0.11 -0.08 115.29 117.61 1npj s HIS 319 Ca 0.35 -0.46 0.02 0.00 -0.15 0.00 0.00 55.06 54.82 1npj s HIS 319 Cb 0.08 -0.93 0.01 0.00 1.11 0.00 0.00 32.58 32.86 1npj s HIS 319 CO 0.16 0.33 -0.11 -0.06 -0.85 0.00 0.00 174.74 174.22 1npj s PHE 320 N -1.96 1.34 -0.29 1.40 0.08 0.03 -1.15 117.98 117.42 1npj s PHE 320 Ca 0.15 -0.48 -0.07 0.00 0.12 0.00 0.00 56.93 56.65 1npj s PHE 320 Cb -0.06 -1.00 -0.00 0.00 -0.57 0.00 0.00 43.02 41.38 1npj s PHE 320 CO 0.07 -0.27 0.09 0.15 -0.10 0.00 0.00 175.22 175.16 1npj s LYS 321 N 0.73 3.26 -0.10 0.44 1.02 0.29 -0.70 119.74 124.68 1npj s LYS 321 Ca -0.14 -0.75 0.01 0.00 0.02 0.00 0.00 55.97 55.12 1npj s LYS 321 Cb -0.15 -3.39 -0.02 0.00 -0.52 0.00 0.00 37.83 33.75 1npj s LYS 321 CO 0.03 -0.38 -0.13 0.08 -0.92 0.00 0.00 175.35 174.03 1npj s VAL 322 N 1.54 3.09 0.33 3.17 1.01 -0.20 -2.19 120.40 127.17 1npj s VAL 322 Ca 0.04 -0.67 0.07 0.00 0.00 0.00 0.00 61.98 61.42 1npj s VAL 322 Cb -0.17 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 1npj s VAL 322 CO 0.03 0.55 0.45 0.42 0.00 0.00 0.00 175.10 176.55 1npj s THR 323 N -0.01 4.05 -2.79 3.92 -4.23 -0.85 -0.41 115.64 115.32 1npj s THR 323 Ca -0.03 -1.03 0.00 0.00 -1.18 0.00 0.00 61.69 59.44 1npj s THR 323 Cb -0.14 -3.40 0.00 0.00 1.34 0.00 0.00 72.50 70.30 1npj s THR 323 CO 0.04 -0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 1npj n GLY 324 N -1.61 0.88 3.82 3.99 0.00 -1.26 -0.56 105.19 110.46 1npj n GLY 324 Ca -0.01 -2.11 -0.38 0.00 0.00 0.00 0.00 46.02 43.52 1npj n GLY 324 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1npj s GLU 325 N -1.03 4.07 0.34 1.61 0.41 -1.26 -4.69 118.70 118.14 1npj s GLU 325 Ca 0.00 0.55 -0.27 0.00 -0.41 0.00 0.00 54.97 54.84 1npj s GLU 325 Cb 0.00 -3.24 -0.09 0.00 -1.78 0.00 0.00 34.13 29.01 1npj s GLU 325 CO 0.00 0.63 1.16 -0.46 -0.49 0.00 0.00 175.26 176.10 1npj s TRP 326 N -0.97 3.29 -0.42 1.61 -0.11 -1.26 -4.38 118.94 116.70 1npj s TRP 326 Ca 0.26 1.60 -0.11 0.00 1.22 0.00 0.00 56.10 59.06 1npj s TRP 326 Cb -0.18 -3.38 0.07 0.00 -1.50 0.00 0.00 33.47 28.48 1npj s TRP 326 CO 0.16 -1.04 0.29 1.21 -4.62 0.00 0.00 176.95 172.94 1npj s ASN 327 N -0.95 5.80 0.43 5.86 3.84 -1.26 -4.96 114.94 123.70 1npj s ASN 327 Ca 0.50 -1.35 0.28 0.00 0.21 0.00 0.00 52.86 52.51 1npj s ASN 327 Cb -0.32 -2.05 0.97 0.00 -0.55 0.00 0.00 41.25 39.30 1npj s ASN 327 CO 0.41 -0.54 1.82 0.44 -2.79 0.00 0.00 177.10 176.44 1npj h ASP 328 N 8.51 0.00 -0.31 -4.21 5.19 -1.95 -2.86 116.42 120.78 1npj h ASP 328 Ca -0.25 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.09 1npj h ASP 328 Cb 1.09 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.60 1npj h ASP 328 CO 0.77 0.00 -0.09 -0.78 -3.12 0.00 0.00 179.24 176.02 1npj h ASP 329 N 0.00 0.62 -0.10 6.45 -0.00 -2.02 -3.21 116.42 118.16 1npj h ASP 329 Ca 0.00 -0.37 -0.16 0.00 -0.00 0.00 0.00 57.03 56.50 1npj h ASP 329 Cb 0.64 -0.17 -0.01 0.00 -0.00 0.00 0.00 39.33 39.79 1npj h ASP 329 CO 0.00 0.85 -0.49 -0.07 -0.00 0.00 0.00 179.24 179.52 1npj h LEU 330 N 0.38 0.73 -7.00 2.28 3.38 -1.97 -3.46 115.31 109.65 1npj h LEU 330 Ca 0.08 -0.37 0.01 0.00 0.09 0.00 0.00 57.88 57.69 1npj h LEU 330 Cb 0.58 -0.21 -0.23 0.00 0.09 0.00 0.00 40.66 40.90 1npj h LEU 330 CO 0.03 1.10 0.18 -0.32 0.09 0.00 0.00 178.44 179.52 1npj s MET 331 N -4.13 0.69 -0.02 1.13 0.00 -1.09 -5.14 119.30 110.74 1npj s MET 331 Ca -0.08 0.96 -0.19 0.00 0.00 0.00 0.00 55.69 56.37 1npj s MET 331 Cb 0.11 0.27 0.04 0.00 0.00 0.00 0.00 34.83 35.25 1npj s MET 331 CO 0.85 -0.11 0.42 -0.08 0.00 0.00 0.00 175.02 176.11 1npj s THR 332 N 0.83 0.04 -0.61 10.11 -1.32 -1.26 -4.18 115.64 119.26 1npj s THR 332 Ca -0.03 -0.35 -0.20 0.00 -1.21 0.00 0.00 61.69 59.90 1npj s THR 332 Cb -0.05 -0.76 0.09 0.00 -1.51 0.00 0.00 72.50 70.27 1npj s THR 332 CO -0.08 -0.19 0.77 -0.55 -2.21 0.00 0.00 174.62 172.36 1npj s SER 333 N -1.39 6.18 0.18 8.08 0.15 -1.26 -4.89 113.70 120.75 1npj s SER 333 Ca -0.12 -1.30 -0.11 0.00 0.70 0.00 0.00 55.95 55.12 1npj s SER 333 Cb -0.03 -2.33 0.09 0.00 -1.71 0.00 0.00 66.02 62.04 1npj s SER 333 CO 0.05 -1.20 1.76 0.58 1.20 0.00 0.00 173.24 175.63 1npj h VAL 334 N 5.94 1.22 -3.26 4.45 2.07 -2.02 -3.39 116.25 121.27 1npj h VAL 334 Ca -0.29 -0.65 -0.51 0.00 0.82 0.00 0.00 66.70 66.06 1npj h VAL 334 Cb 1.08 0.47 -0.40 0.00 -1.52 0.00 0.00 31.29 30.93 1npj h VAL 334 CO 1.12 0.26 -0.76 -0.22 0.02 0.00 0.00 177.57 177.99 1npj s LEU 335 N -9.82 1.11 0.78 2.57 2.96 -1.26 -5.14 118.68 109.88 1npj s LEU 335 Ca -0.13 -0.78 -0.12 0.00 -0.22 0.00 0.00 54.13 52.88 1npj s LEU 335 Cb 0.13 -0.57 0.07 0.00 0.50 0.00 0.00 46.19 46.32 1npj s LEU 335 CO 0.79 -0.30 1.13 0.00 -1.32 0.00 0.00 176.35 176.65 1npj s ALA 336 N 1.88 2.07 -0.29 5.97 0.00 -1.26 -4.85 121.76 125.27 1npj s ALA 336 Ca -0.01 0.52 -0.41 0.00 0.00 0.00 0.00 51.96 52.07 1npj s ALA 336 Cb -0.17 -3.37 -0.16 0.00 0.00 0.00 0.00 23.12 19.43 1npj s ALA 336 CO -0.08 -1.96 1.73 -2.30 0.00 0.00 0.00 175.76 173.15 1npj n PRO 337 N -3.34 1.07 -3.81 0.00 -0.02 -1.26 -4.93 135.00 122.72 1npj n PRO 337 Ca 0.11 0.39 -0.08 0.00 -2.02 0.00 0.00 63.50 61.90 1npj n PRO 337 Cb 0.52 -2.06 -0.02 0.00 -0.02 0.00 0.00 33.50 31.92 1npj n PRO 337 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1npj s SER 338 N 3.44 -0.30 0.00 2.55 1.04 -1.26 -5.30 113.70 113.87 1npj s SER 338 Ca 0.99 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 56.88 1npj s SER 338 Cb -1.10 0.71 0.00 0.00 0.10 0.00 0.00 66.02 65.73 1npj s SER 338 CO 0.66 -1.29 0.35 0.61 0.98 0.00 0.00 173.24 174.55