#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 4.26 0.21 0.00 -4.23 -1.26 -4.91 115.64 109.72 1npj s THR 5 Ca 0.00 -0.44 -0.09 0.00 -1.18 0.00 0.00 61.69 59.98 1npj s THR 5 Cb 0.00 -3.58 0.17 0.00 1.34 0.00 0.00 72.50 70.44 1npj s THR 5 CO 0.00 -0.41 1.71 0.00 -0.54 0.00 0.00 174.62 175.38 1npj h ALA 6 N 0.45 0.76 -0.24 3.99 0.00 -2.05 0.06 119.26 122.23 1npj h ALA 6 Ca -0.47 0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.61 1npj h ALA 6 Cb 1.24 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 19.16 1npj h ALA 6 CO 0.58 -0.29 -0.02 0.00 0.00 0.00 0.00 179.25 179.52 1npj h ALA 7 N 1.49 0.19 -0.84 0.00 0.00 -1.99 0.62 119.26 118.74 1npj h ALA 7 Ca 0.33 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1npj h ALA 7 Cb 0.49 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.38 1npj h ALA 7 CO -0.40 -0.44 0.53 0.93 0.00 0.00 0.00 179.25 179.86 1npj h GLU 8 N 0.04 1.12 -0.48 0.00 5.08 -1.62 -1.92 114.58 116.81 1npj h GLU 8 Ca 0.11 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1npj h GLU 8 Cb 0.16 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1npj h GLU 8 CO -0.21 0.77 0.23 0.82 -1.00 0.00 0.00 179.01 179.62 1npj h ILE 9 N 1.14 1.19 0.00 3.13 1.08 -0.32 -2.23 117.51 121.51 1npj h ILE 9 Ca 0.30 -0.54 -0.02 0.00 -0.39 0.00 0.00 64.86 64.22 1npj h ILE 9 Cb -0.09 0.66 -0.00 0.00 -3.07 0.00 0.00 36.82 34.32 1npj h ILE 9 CO -0.06 0.21 -0.08 0.00 -0.69 0.00 0.00 178.15 177.53 1npj h ALA 10 N 1.07 1.32 0.00 1.87 0.00 -0.48 -2.38 119.26 120.66 1npj h ALA 10 Ca 0.17 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1npj h ALA 10 Cb 0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1npj h ALA 10 CO -0.02 0.10 -0.34 0.00 0.00 0.00 0.00 179.25 178.99 1npj h ALA 11 N 1.92 0.82 -3.01 0.00 0.00 -0.75 -3.47 119.26 114.78 1npj h ALA 11 Ca -0.00 -0.19 -0.55 0.00 0.00 0.00 0.00 54.91 54.17 1npj h ALA 11 Cb 0.24 -0.01 0.14 0.00 0.00 0.00 0.00 17.79 18.15 1npj h ALA 11 CO 0.01 0.25 0.56 -0.51 0.00 0.00 0.00 179.25 179.56 1npj s LEU 12 N -6.18 3.75 0.77 0.00 1.43 -0.90 -4.98 118.68 112.57 1npj s LEU 12 Ca 0.05 2.66 -0.11 0.00 -1.03 0.00 0.00 54.13 55.70 1npj s LEU 12 Cb 0.06 -4.42 0.06 0.00 0.03 0.00 0.00 46.19 41.92 1npj s LEU 12 CO 0.71 -1.69 1.10 -2.16 0.23 0.00 0.00 176.35 174.54 1npj s PRO 13 N -3.10 2.21 -0.00 1.29 0.04 -1.26 -4.79 135.00 129.39 1npj s PRO 13 Ca 0.76 1.21 0.04 0.00 0.04 0.00 0.00 61.00 63.05 1npj s PRO 13 Cb -0.38 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.26 1npj s PRO 13 CO 0.43 -1.68 -0.14 1.03 0.04 0.00 0.00 177.00 176.68 1npj s ARG 14 N -4.83 1.08 -0.09 4.56 0.52 -1.26 -1.52 118.95 117.41 1npj s ARG 14 Ca 0.62 -0.51 -0.00 0.00 -0.52 0.00 0.00 55.73 55.31 1npj s ARG 14 Cb -0.18 -1.05 0.02 0.00 0.52 0.00 0.00 34.95 34.27 1npj s ARG 14 CO 0.55 0.29 -0.05 1.14 0.02 0.00 0.00 175.30 177.24 1npj s GLN 15 N -0.41 1.19 -0.18 3.54 -2.07 -0.90 -4.97 119.66 115.86 1npj s GLN 15 Ca 0.05 -0.14 -0.25 0.00 -1.82 0.00 0.00 55.36 53.20 1npj s GLN 15 Cb -0.05 -1.31 -0.01 0.00 -1.09 0.00 0.00 33.01 30.54 1npj s GLN 15 CO -0.00 -0.23 0.82 0.21 -1.32 0.00 0.00 175.29 174.76 1npj s LYS 16 N 1.62 4.28 -0.08 9.60 2.47 -1.26 -0.64 119.74 135.73 1npj s LYS 16 Ca 0.02 0.98 -0.02 0.00 -1.56 0.00 0.00 55.97 55.39 1npj s LYS 16 Cb -0.13 -3.58 -0.03 0.00 -1.46 0.00 0.00 37.83 32.62 1npj s LYS 16 CO -0.05 -0.35 0.03 0.08 0.16 0.00 0.00 175.35 175.22 1npj s VAL 17 N 2.24 4.54 -0.37 4.02 1.01 -0.27 -4.94 120.40 126.63 1npj s VAL 17 Ca 0.37 -0.21 -0.15 0.00 0.00 0.00 0.00 61.98 61.99 1npj s VAL 17 Cb -0.16 -2.94 -0.00 0.00 0.00 0.00 0.00 36.38 33.27 1npj s VAL 17 CO 0.11 0.57 0.35 -1.61 0.00 0.00 0.00 175.10 174.53 1npj s GLU 18 N -1.03 3.36 0.56 2.72 8.01 -1.26 -4.68 118.70 126.39 1npj s GLU 18 Ca 0.15 -0.62 -0.19 0.00 0.01 0.00 0.00 54.97 54.32 1npj s GLU 18 Cb -0.11 -3.87 -0.05 0.00 -4.31 0.00 0.00 34.13 25.79 1npj s GLU 18 CO 0.04 -0.62 1.16 -0.51 0.01 0.00 0.00 175.26 175.35 1npj s LEU 19 N 1.95 3.72 0.22 1.80 1.43 -1.26 -4.79 118.68 121.75 1npj s LEU 19 Ca 0.10 2.26 0.10 0.00 -1.03 0.00 0.00 54.13 55.56 1npj s LEU 19 Cb -0.17 -4.58 -0.05 0.00 0.03 0.00 0.00 46.19 41.42 1npj s LEU 19 CO 0.12 -1.36 -0.18 0.68 0.23 0.00 0.00 176.35 175.84 1npj s VAL 20 N -1.69 2.03 0.30 -1.59 -7.23 -1.26 -5.00 120.40 105.97 1npj s VAL 20 Ca 0.74 -2.20 -0.29 0.00 -1.81 0.00 0.00 61.98 58.43 1npj s VAL 20 Cb -0.27 -2.09 -0.10 0.00 0.56 0.00 0.00 36.38 34.49 1npj s VAL 20 CO 0.29 -0.44 1.14 -1.81 -0.31 0.00 0.00 175.10 173.97 1npj s ASP 21 N -3.19 7.11 0.79 4.85 -0.00 -1.26 -4.57 116.67 120.39 1npj s ASP 21 Ca 0.23 2.34 -0.13 0.00 -0.00 0.00 0.00 52.55 55.00 1npj s ASP 21 Cb -0.04 -2.63 0.08 0.00 -0.00 0.00 0.00 42.92 40.33 1npj s ASP 21 CO 0.10 -0.26 1.17 -2.84 -0.00 0.00 0.00 175.17 173.33 1npj s PRO 22 N -1.61 1.81 0.00 8.23 0.02 -1.26 -1.84 135.00 140.34 1npj s PRO 22 Ca 0.47 1.60 0.08 0.00 0.02 0.00 0.00 61.00 63.17 1npj s PRO 22 Cb -0.33 -1.81 0.50 0.00 0.02 0.00 0.00 34.50 32.88 1npj s PRO 22 CO 0.43 -2.05 1.28 -0.35 -0.33 0.00 0.00 177.00 175.97 1npj n PRO 23 N -3.32 0.94 -1.96 5.54 -0.04 -1.26 -5.05 135.00 129.86 1npj n PRO 23 Ca 0.12 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.28 1npj n PRO 23 Cb 0.51 -1.14 0.02 0.00 -0.04 0.00 0.00 33.50 32.85 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 3.51 -0.01 0.54 0.40 -0.77 -0.59 117.98 119.06 1npj s PHE 24 Ca 0.13 1.15 0.03 0.00 -0.60 0.00 0.00 56.93 57.63 1npj s PHE 24 Cb 0.06 -2.79 -0.01 0.00 0.51 0.00 0.00 43.02 40.79 1npj s PHE 24 CO 0.10 -0.81 -0.11 0.08 0.70 0.00 0.00 175.22 175.18 1npj s VAL 25 N -3.19 0.87 0.79 -0.44 1.01 -1.26 -4.64 120.40 113.54 1npj s VAL 25 Ca 0.55 -0.45 -0.14 0.00 0.00 0.00 0.00 61.98 61.94 1npj s VAL 25 Cb -0.11 -0.74 0.08 0.00 0.00 0.00 0.00 36.38 35.61 1npj s VAL 25 CO 0.52 0.25 1.22 -1.38 0.00 0.00 0.00 175.10 175.71 1npj s HIS 26 N -0.14 1.80 0.30 5.22 -3.43 -1.26 -4.90 115.29 112.88 1npj s HIS 26 Ca 0.02 1.66 -0.29 0.00 -0.80 0.00 0.00 55.06 55.65 1npj s HIS 26 Cb -0.06 -3.52 -0.13 0.00 -1.43 0.00 0.00 32.58 27.45 1npj s HIS 26 CO -0.00 -2.90 1.32 0.00 -2.00 0.00 0.00 174.74 171.15 1npj n ALA 27 N -3.17 1.15 -3.84 -1.38 0.00 -1.26 -4.98 120.51 107.02 1npj n ALA 27 Ca 0.14 0.38 -0.06 0.00 0.00 0.00 0.00 53.44 53.90 1npj n ALA 27 Cb 0.50 -2.25 -0.02 0.00 0.00 0.00 0.00 19.45 17.69 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 -0.71 -0.16 -0.10 0.00 -3.43 -1.26 -5.05 115.29 104.58 1npj s HIS 28 Ca 0.60 -0.28 -0.00 0.00 -0.80 0.00 0.00 55.06 54.58 1npj s HIS 28 Cb -0.61 0.71 -0.02 0.00 -1.43 0.00 0.00 32.58 31.23 1npj s HIS 28 CO 0.57 -1.19 -0.09 0.45 -2.00 0.00 0.00 174.74 172.49 1npj s SER 29 N -2.94 4.44 0.07 7.38 0.15 -1.26 -5.01 113.70 116.52 1npj s SER 29 Ca 0.12 -0.15 -0.19 0.00 0.70 0.00 0.00 55.95 56.42 1npj s SER 29 Cb -0.05 -1.40 -0.11 0.00 -1.71 0.00 0.00 66.02 62.75 1npj s SER 29 CO 0.06 0.26 1.45 1.56 1.20 0.00 0.00 173.24 177.77 1npj h GLN 30 N 6.02 0.43 -5.57 5.44 4.20 -1.97 -3.40 115.11 120.25 1npj h GLN 30 Ca -0.38 -0.18 -0.60 0.00 0.06 0.00 0.00 58.65 57.56 1npj h GLN 30 Cb 1.19 -0.02 -0.10 0.00 0.30 0.00 0.00 27.48 28.84 1npj h GLN 30 CO 0.56 0.69 -0.05 0.08 -0.67 0.00 0.00 178.83 179.44 1npj s VAL 31 N -4.68 5.11 0.28 -0.54 1.01 -1.26 -3.25 120.40 117.07 1npj s VAL 31 Ca -0.14 0.96 -0.30 0.00 0.00 0.00 0.00 61.98 62.50 1npj s VAL 31 Cb 0.07 -3.84 -0.12 0.00 0.00 0.00 0.00 36.38 32.49 1npj s VAL 31 CO 0.76 0.19 1.61 0.00 0.00 0.00 0.00 175.10 177.66 1npj n ALA 32 N 4.65 2.52 -2.80 5.51 0.00 0.19 -4.94 120.51 125.63 1npj n ALA 32 Ca -0.05 0.38 -0.43 0.00 0.00 0.00 0.00 53.44 53.34 1npj n ALA 32 Cb 0.51 -2.46 -0.09 0.00 0.00 0.00 0.00 19.45 17.40 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 -0.22 2.91 0.27 0.00 2.02 -1.26 -4.96 118.70 117.46 1npj s GLU 33 Ca 0.66 -1.24 0.00 0.00 0.02 0.00 0.00 54.97 54.41 1npj s GLU 33 Cb -0.51 -4.00 0.00 0.00 0.10 0.00 0.00 34.13 29.72 1npj s GLU 33 CO 0.46 -0.91 0.00 0.41 0.02 0.00 0.00 175.26 175.24 1npj n GLY 34 N 5.13 -2.40 2.40 -1.39 0.00 -1.26 -5.00 105.19 102.66 1npj n GLY 34 Ca -0.12 -1.84 -0.18 0.00 0.00 0.00 0.00 46.02 43.89 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 -1.26 3.65 -0.02 0.00 -1.26 -5.00 105.19 101.17 1npj n GLY 35 Ca 0.00 -1.71 -0.44 0.00 0.00 0.00 0.00 46.02 43.87 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 -2.72 1.77 -4.25 1.61 -0.02 -1.26 -5.02 135.00 125.11 1npj n PRO 36 Ca 0.10 0.62 -0.14 0.00 -2.02 0.00 0.00 63.50 62.06 1npj n PRO 36 Cb 0.36 -2.15 -0.10 0.00 -0.02 0.00 0.00 33.50 31.59 1npj n PRO 36 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 1npj s LYS 37 N -1.31 1.06 -0.47 -0.52 1.02 -1.26 -4.44 119.74 113.82 1npj s LYS 37 Ca 0.61 -1.43 -0.17 0.00 0.02 0.00 0.00 55.97 55.00 1npj s LYS 37 Cb -0.65 -0.65 0.06 0.00 -0.52 0.00 0.00 37.83 36.06 1npj s LYS 37 CO 0.58 0.08 0.45 0.08 -0.92 0.00 0.00 175.35 175.62 1npj s VAL 38 N -3.22 5.13 -0.22 3.17 1.01 -0.57 -1.03 120.40 124.66 1npj s VAL 38 Ca 0.16 -0.81 -0.21 0.00 0.00 0.00 0.00 61.98 61.12 1npj s VAL 38 Cb 0.02 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 1npj s VAL 38 CO 0.01 -0.60 0.65 -0.69 0.00 0.00 0.00 175.10 174.47 1npj s VAL 39 N 1.95 4.99 -0.20 2.92 1.01 0.58 -2.11 120.40 129.54 1npj s VAL 39 Ca 0.08 1.21 -0.10 0.00 0.00 0.00 0.00 61.98 63.17 1npj s VAL 39 Cb -0.22 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 1npj s VAL 39 CO 0.09 0.07 0.12 -1.61 0.00 0.00 0.00 175.10 173.77 1npj s GLU 40 N 2.19 4.14 0.12 2.72 2.02 0.19 -0.72 118.70 129.35 1npj s GLU 40 Ca 0.29 -0.25 0.06 0.00 0.02 0.00 0.00 54.97 55.09 1npj s GLU 40 Cb -0.16 -3.40 -0.04 0.00 0.10 0.00 0.00 34.13 30.64 1npj s GLU 40 CO 0.10 0.27 -0.16 -0.06 0.02 0.00 0.00 175.26 175.43 1npj s PHE 41 N 0.44 1.49 -0.03 1.61 0.40 -0.48 -1.11 117.98 120.29 1npj s PHE 41 Ca 0.07 -0.51 0.01 0.00 -0.60 0.00 0.00 56.93 55.90 1npj s PHE 41 Cb -0.12 -0.78 0.02 0.00 0.51 0.00 0.00 43.02 42.65 1npj s PHE 41 CO -0.01 0.17 -0.04 0.99 0.70 0.00 0.00 175.22 177.03 1npj s THR 42 N -1.86 0.44 -0.02 0.64 2.01 -1.26 -0.61 115.64 114.99 1npj s THR 42 Ca 0.08 -0.11 0.01 0.00 0.31 0.00 0.00 61.69 61.98 1npj s THR 42 Cb -0.06 -0.46 0.01 0.00 0.01 0.00 0.00 72.50 71.99 1npj s THR 42 CO 0.04 0.19 -0.02 -0.04 -0.69 0.00 0.00 174.62 174.10 1npj s MET 43 N 0.71 0.33 -0.19 4.92 -1.94 -0.64 -4.91 119.30 117.59 1npj s MET 43 Ca -0.09 -0.02 -0.07 0.00 -1.71 0.00 0.00 55.69 53.80 1npj s MET 43 Cb -0.12 -0.42 -0.04 0.00 2.01 0.00 0.00 34.83 36.26 1npj s MET 43 CO -0.00 -0.04 0.06 0.08 -0.01 0.00 0.00 175.02 175.11 1npj s VAL 44 N 0.55 4.73 -0.02 -6.03 1.01 -1.26 -1.50 120.40 117.87 1npj s VAL 44 Ca -0.06 -0.05 -0.28 0.00 0.00 0.00 0.00 61.98 61.59 1npj s VAL 44 Cb -0.09 -3.14 -0.03 0.00 0.00 0.00 0.00 36.38 33.13 1npj s VAL 44 CO -0.01 0.45 0.90 -0.63 0.00 0.00 0.00 175.10 175.81 1npj s ILE 45 N 0.49 4.92 -0.14 2.22 1.01 -0.09 -1.12 121.20 128.49 1npj s ILE 45 Ca 0.03 1.89 0.01 0.00 0.00 0.00 0.00 60.65 62.58 1npj s ILE 45 Cb -0.13 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 38.12 1npj s ILE 45 CO 0.01 0.18 -0.15 -1.61 0.00 0.00 0.00 174.94 173.37 1npj s GLU 46 N 0.95 2.37 -0.26 2.79 0.41 0.05 -4.36 118.70 120.66 1npj s GLU 46 Ca 0.48 -0.59 -0.21 0.00 -0.41 0.00 0.00 54.97 54.24 1npj s GLU 46 Cb -0.20 -2.11 -0.02 0.00 -1.78 0.00 0.00 34.13 30.02 1npj s GLU 46 CO 0.25 -0.18 0.64 -1.21 -0.49 0.00 0.00 175.26 174.27 1npj s GLU 47 N 1.33 4.09 0.04 1.61 2.02 -1.26 -0.28 118.70 126.25 1npj s GLU 47 Ca 0.02 0.55 -0.15 0.00 0.02 0.00 0.00 54.97 55.41 1npj s GLU 47 Cb -0.13 -3.66 0.02 0.00 0.10 0.00 0.00 34.13 30.46 1npj s GLU 47 CO -0.08 -0.44 0.33 -1.59 0.02 0.00 0.00 175.26 173.50 1npj s LYS 48 N 2.54 0.83 0.04 1.61 -2.85 -0.39 -4.99 119.74 116.53 1npj s LYS 48 Ca 0.27 -0.45 -0.27 0.00 -1.00 0.00 0.00 55.97 54.52 1npj s LYS 48 Cb -0.15 0.36 -0.05 0.00 -2.06 0.00 0.00 37.83 35.93 1npj s LYS 48 CO 0.09 -0.27 0.86 0.15 0.10 0.00 0.00 175.35 176.28 1npj s LYS 49 N -2.45 4.56 0.10 1.78 1.02 -1.26 -0.24 119.74 123.25 1npj s LYS 49 Ca -0.06 1.23 0.05 0.00 0.02 0.00 0.00 55.97 57.21 1npj s LYS 49 Cb -0.01 -3.40 -0.03 0.00 -0.52 0.00 0.00 37.83 33.87 1npj s LYS 49 CO -0.03 0.16 -0.14 0.96 -0.92 0.00 0.00 175.35 175.39 1npj s ILE 50 N 0.30 1.22 -0.21 2.17 -4.36 0.07 -4.91 121.20 115.47 1npj s ILE 50 Ca 0.44 -1.53 -0.08 0.00 -0.26 0.00 0.00 60.65 59.22 1npj s ILE 50 Cb -0.21 -1.32 -0.04 0.00 1.25 0.00 0.00 42.46 42.14 1npj s ILE 50 CO 0.25 -0.33 0.09 -0.69 0.24 0.00 0.00 174.94 174.51 1npj s VAL 51 N -1.75 4.87 -2.21 8.37 1.01 -1.26 -1.17 120.40 128.26 1npj s VAL 51 Ca 0.04 0.01 0.19 0.00 0.00 0.00 0.00 61.98 62.21 1npj s VAL 51 Cb -0.07 -3.24 0.20 0.00 0.00 0.00 0.00 36.38 33.27 1npj s VAL 51 CO 0.02 0.40 1.14 2.30 0.00 0.00 0.00 175.10 178.97 1npj n ILE 52 N 4.04 0.15 -3.94 2.22 -5.35 -0.02 -4.82 119.36 111.64 1npj n ILE 52 Ca -0.16 -0.58 -0.08 0.00 -0.27 0.00 0.00 62.75 61.66 1npj n ILE 52 Cb 0.52 1.25 -0.04 0.00 -1.74 0.00 0.00 39.64 39.64 1npj n ILE 52 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1npj s ASP 53 N -1.47 -0.16 0.51 7.28 3.84 -1.26 -0.79 116.67 124.62 1npj s ASP 53 Ca 0.24 -0.80 0.24 0.00 -0.00 0.00 0.00 52.55 52.24 1npj s ASP 53 Cb 0.16 0.65 1.38 0.00 -1.38 0.00 0.00 42.92 43.73 1npj s ASP 53 CO 0.24 -1.24 2.07 0.44 -0.00 0.00 0.00 175.17 176.68 1npj h ASP 54 N 2.14 0.00 0.98 2.11 5.19 -1.95 -2.18 116.42 122.71 1npj h ASP 54 Ca -0.23 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.15 1npj h ASP 54 Cb 1.25 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.76 1npj h ASP 54 CO 0.30 0.12 -0.12 0.00 -3.12 0.00 0.00 179.24 176.43 1npj h ALA 55 N 1.88 1.02 0.00 3.45 0.00 -2.02 -3.46 119.26 120.12 1npj h ALA 55 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1npj h ALA 55 Cb 0.30 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1npj h ALA 55 CO 0.02 0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.82 1npj n GLY 56 N 0.10 1.19 3.70 0.00 0.00 -0.82 -5.07 105.19 104.29 1npj n GLY 56 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.59 1npj n GLY 56 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1npj n THR 57 N -1.47 0.76 -4.09 2.61 -1.04 -1.26 -4.83 114.28 104.97 1npj n THR 57 Ca 0.00 -0.19 -0.29 0.00 -2.04 0.00 0.00 64.05 61.53 1npj n THR 57 Cb 0.00 -1.68 -0.07 0.00 -1.82 0.00 0.00 70.33 66.77 1npj n THR 57 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1npj s GLU 58 N -0.13 2.78 -0.03 -2.82 2.02 -1.26 -0.84 118.70 118.42 1npj s GLU 58 Ca 0.69 -0.81 -0.02 0.00 0.02 0.00 0.00 54.97 54.85 1npj s GLU 58 Cb -0.59 -2.63 0.01 0.00 0.10 0.00 0.00 34.13 31.01 1npj s GLU 58 CO 0.46 0.53 0.07 0.08 0.02 0.00 0.00 175.26 176.42 1npj s VAL 59 N -1.51 -0.01 -0.91 2.63 1.01 -0.32 -4.94 120.40 116.36 1npj s VAL 59 Ca 0.29 0.04 -0.19 0.00 0.00 0.00 0.00 61.98 62.11 1npj s VAL 59 Cb -0.11 -0.12 0.12 0.00 0.00 0.00 0.00 36.38 36.27 1npj s VAL 59 CO 0.21 0.02 1.14 -1.00 0.00 0.00 0.00 175.10 175.47 1npj s HIS 60 N 0.24 3.02 0.58 5.22 3.76 -1.26 -0.75 115.29 126.10 1npj s HIS 60 Ca -0.02 -1.25 -0.15 0.00 -0.15 0.00 0.00 55.06 53.49 1npj s HIS 60 Cb -0.03 -4.32 -0.04 0.00 1.11 0.00 0.00 32.58 29.30 1npj s HIS 60 CO -0.01 -1.54 1.04 0.00 -0.85 0.00 0.00 174.74 173.38 1npj s ALA 61 N 3.03 2.83 -0.28 -1.40 0.00 0.67 -4.85 121.76 121.75 1npj s ALA 61 Ca 0.33 0.29 0.03 0.00 0.00 0.00 0.00 51.96 52.61 1npj s ALA 61 Cb -0.06 -3.19 0.07 0.00 0.00 0.00 0.00 23.12 19.95 1npj s ALA 61 CO -0.07 -0.70 -0.04 -1.64 0.00 0.00 0.00 175.76 173.31 1npj s MET 62 N -4.20 1.82 -0.13 0.00 -1.94 -0.48 -1.26 119.30 113.11 1npj s MET 62 Ca 0.62 -1.44 0.02 0.00 -1.71 0.00 0.00 55.69 53.17 1npj s MET 62 Cb -0.14 -2.90 0.01 0.00 2.01 0.00 0.00 34.83 33.81 1npj s MET 62 CO 0.38 -0.71 -0.19 0.00 -0.01 0.00 0.00 175.02 174.48 1npj s ALA 63 N 1.11 2.04 0.03 3.03 0.00 0.61 -2.07 121.76 126.51 1npj s ALA 63 Ca -0.01 -0.96 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 1npj s ALA 63 Cb -0.19 -0.94 -0.06 0.00 0.00 0.00 0.00 23.12 21.93 1npj s ALA 63 CO -0.07 -0.06 1.42 -0.06 0.00 0.00 0.00 175.76 176.99 1npj s PHE 64 N 0.90 2.89 -1.10 0.00 0.08 -1.25 -0.77 117.98 118.73 1npj s PHE 64 Ca -0.06 0.81 0.00 0.00 0.12 0.00 0.00 56.93 57.79 1npj s PHE 64 Cb -0.15 -3.69 0.00 0.00 -0.57 0.00 0.00 43.02 38.61 1npj s PHE 64 CO -0.02 -2.53 0.00 -1.71 -0.10 0.00 0.00 175.22 170.85 1npj n ASN 65 N 5.14 -5.13 0.00 1.36 5.15 -0.27 -2.50 115.26 119.00 1npj n ASN 65 Ca 0.13 0.26 0.00 0.00 -0.60 0.00 0.00 54.58 54.37 1npj n ASN 65 Cb 0.43 -3.54 0.00 0.00 -0.53 0.00 0.00 39.78 36.14 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 -0.54 0.63 3.38 8.20 0.00 -0.94 -4.94 105.19 110.99 1npj n GLY 66 Ca -0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.66 2.01 -0.20 2.61 -4.23 -1.04 -4.95 115.64 107.17 1npj s THR 67 Ca 0.00 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.35 1npj s THR 67 Cb 0.00 -2.06 0.05 0.00 1.34 0.00 0.00 72.50 71.83 1npj s THR 67 CO 0.00 -0.43 -0.07 -0.69 -0.54 0.00 0.00 174.62 172.90 1npj s VAL 68 N -2.49 1.42 1.03 2.29 1.01 -1.26 -3.37 120.40 119.03 1npj s VAL 68 Ca 0.22 -0.98 -0.16 0.00 0.00 0.00 0.00 61.98 61.07 1npj s VAL 68 Cb -0.04 -1.61 0.21 0.00 0.00 0.00 0.00 36.38 34.94 1npj s VAL 68 CO 0.09 0.04 1.19 -2.16 0.00 0.00 0.00 175.10 174.26 1npj s PRO 69 N 1.47 0.17 0.87 2.72 0.04 -1.26 -1.33 135.00 137.68 1npj s PRO 69 Ca -0.03 -0.05 -0.11 0.00 0.04 0.00 0.00 61.00 60.85 1npj s PRO 69 Cb -0.17 -1.76 0.11 0.00 0.04 0.00 0.00 34.50 32.73 1npj s PRO 69 CO -0.07 -2.79 1.09 0.20 0.04 0.00 0.00 177.00 175.47 1npj s GLY 70 N -4.25 1.64 0.76 0.56 0.00 0.43 -4.76 107.32 101.70 1npj s GLY 70 Ca 0.69 0.07 -0.11 0.00 0.00 0.00 0.00 44.72 45.37 1npj s GLY 70 CO 0.54 0.52 1.10 2.56 0.00 0.00 0.00 173.10 177.83 1npj s PRO 71 N -4.89 2.25 -0.20 2.90 0.04 -1.26 -4.43 135.00 129.40 1npj s PRO 71 Ca 0.63 1.26 -0.23 0.00 0.04 0.00 0.00 61.00 62.70 1npj s PRO 71 Cb -0.18 -1.89 -0.02 0.00 0.04 0.00 0.00 34.50 32.45 1npj s PRO 71 CO 0.57 -1.66 0.75 -1.17 0.04 0.00 0.00 177.00 175.52 1npj s LEU 72 N -5.75 4.13 -0.17 -3.56 2.96 -1.26 -4.26 118.68 110.76 1npj s LEU 72 Ca 0.63 0.98 -0.09 0.00 -0.22 0.00 0.00 54.13 55.44 1npj s LEU 72 Cb -0.19 -3.07 -0.05 0.00 0.50 0.00 0.00 46.19 43.38 1npj s LEU 72 CO 0.53 -0.38 0.13 -0.04 -1.32 0.00 0.00 176.35 175.27 1npj s MET 73 N 2.27 3.95 -0.12 1.98 -1.94 -1.16 -4.53 119.30 119.75 1npj s MET 73 Ca 0.33 -0.20 0.03 0.00 -1.71 0.00 0.00 55.69 54.14 1npj s MET 73 Cb -0.16 -3.34 0.00 0.00 2.01 0.00 0.00 34.83 33.34 1npj s MET 73 CO 0.10 0.45 -0.22 0.08 -0.01 0.00 0.00 175.02 175.42 1npj s VAL 74 N -0.08 2.17 0.36 -6.03 1.01 -1.26 -0.25 120.40 116.32 1npj s VAL 74 Ca 0.10 -0.97 0.07 0.00 0.00 0.00 0.00 61.98 61.18 1npj s VAL 74 Cb -0.11 -1.85 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 1npj s VAL 74 CO -0.00 0.55 0.25 0.68 0.00 0.00 0.00 175.10 176.58 1npj s VAL 75 N 0.53 0.12 0.27 2.92 -7.23 -0.19 -4.98 120.40 111.83 1npj s VAL 75 Ca -0.14 -2.00 0.11 0.00 -1.81 0.00 0.00 61.98 58.14 1npj s VAL 75 Cb -0.17 -2.45 -0.05 0.00 0.56 0.00 0.00 36.38 34.28 1npj s VAL 75 CO 0.05 0.00 -0.10 -1.00 -0.31 0.00 0.00 175.10 173.74 1npj s HIS 76 N -3.36 2.50 0.22 2.82 3.76 -1.26 -0.62 115.29 119.36 1npj s HIS 76 Ca 0.36 -0.27 -0.32 0.00 -0.15 0.00 0.00 55.06 54.69 1npj s HIS 76 Cb 0.02 -1.10 -0.14 0.00 1.11 0.00 0.00 32.58 32.47 1npj s HIS 76 CO 0.25 0.66 1.41 0.94 -0.85 0.00 0.00 174.74 177.15 1npj n GLN 77 N -0.71 1.98 -1.00 1.40 7.27 0.52 -1.90 117.38 124.94 1npj n GLN 77 Ca -0.06 0.71 -0.00 0.00 0.07 0.00 0.00 57.00 57.71 1npj n GLN 77 Cb 0.59 -2.36 -0.00 0.00 2.41 0.00 0.00 30.24 30.88 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 2.28 -3.48 -4.72 1.69 10.43 0.12 -4.75 116.55 118.11 1npj n ASP 78 Ca 0.12 0.00 -0.26 0.00 2.57 0.00 0.00 54.79 57.23 1npj n ASP 78 Cb 0.31 -0.98 0.10 0.00 1.84 0.00 0.00 41.12 42.38 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 -2.00 4.42 -0.07 -2.24 -0.00 -0.80 -4.68 116.67 111.30 1npj s ASP 79 Ca 0.00 0.17 0.03 0.00 -0.00 0.00 0.00 52.55 52.75 1npj s ASP 79 Cb 0.00 -0.66 -0.02 0.00 -0.00 0.00 0.00 42.92 42.24 1npj s ASP 79 CO 0.00 -1.83 -0.17 -0.31 -0.00 0.00 0.00 175.17 172.85 1npj s TYR 80 N -3.30 2.65 -0.28 4.23 1.51 -0.20 -1.79 117.35 120.18 1npj s TYR 80 Ca 0.64 -0.48 -0.10 0.00 -1.01 0.00 0.00 57.07 56.12 1npj s TYR 80 Cb -0.08 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 40.05 1npj s TYR 80 CO 0.46 -0.06 0.15 -1.17 -1.11 0.00 0.00 175.55 173.81 1npj s LEU 81 N -0.24 3.85 -0.32 -1.29 0.20 -0.58 -0.31 118.68 120.00 1npj s LEU 81 Ca 0.00 -0.15 -0.02 0.00 0.69 0.00 0.00 54.13 54.65 1npj s LEU 81 Cb -0.13 -2.04 0.06 0.00 -0.43 0.00 0.00 46.19 43.65 1npj s LEU 81 CO 0.03 -0.07 0.03 -0.70 -0.29 0.00 0.00 176.35 175.35 1npj s GLU 82 N 1.69 2.33 -0.19 1.98 2.12 0.10 -2.12 118.70 124.61 1npj s GLU 82 Ca 0.07 -1.37 -0.07 0.00 0.36 0.00 0.00 54.97 53.95 1npj s GLU 82 Cb -0.16 -3.24 -0.04 0.00 0.26 0.00 0.00 34.13 30.95 1npj s GLU 82 CO 0.08 -0.70 0.06 -1.17 -0.54 0.00 0.00 175.26 172.99 1npj s LEU 83 N 1.22 3.73 -0.38 2.70 0.20 0.02 -1.39 118.68 124.78 1npj s LEU 83 Ca -0.03 0.03 -0.14 0.00 0.69 0.00 0.00 54.13 54.68 1npj s LEU 83 Cb -0.20 -1.95 0.01 0.00 -0.43 0.00 0.00 46.19 43.61 1npj s LEU 83 CO -0.02 0.14 0.28 -0.89 -0.29 0.00 0.00 176.35 175.57 1npj s THR 84 N 0.58 5.26 -0.20 3.68 2.01 0.22 -1.22 115.64 125.98 1npj s THR 84 Ca 0.03 -0.50 -0.06 0.00 0.31 0.00 0.00 61.69 61.47 1npj s THR 84 Cb -0.13 -3.84 -0.03 0.00 0.01 0.00 0.00 72.50 68.51 1npj s THR 84 CO 0.01 -0.20 0.03 -0.22 -0.69 0.00 0.00 174.62 173.56 1npj s LEU 85 N 1.69 3.47 -0.12 4.42 2.96 0.20 -1.62 118.68 129.68 1npj s LEU 85 Ca 0.05 -0.10 0.02 0.00 -0.22 0.00 0.00 54.13 53.88 1npj s LEU 85 Cb -0.18 -1.88 -0.01 0.00 0.50 0.00 0.00 46.19 44.62 1npj s LEU 85 CO 0.10 0.09 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.41 1npj s ILE 86 N 0.84 2.52 -0.46 6.68 1.01 -0.56 -1.51 121.20 129.72 1npj s ILE 86 Ca 0.02 -0.85 -0.02 0.00 0.00 0.00 0.00 60.65 59.80 1npj s ILE 86 Cb -0.14 -2.02 0.12 0.00 0.01 0.00 0.00 42.46 40.43 1npj s ILE 86 CO 0.02 0.54 0.25 0.21 0.00 0.00 0.00 174.94 175.96 1npj s ASN 87 N 0.43 5.18 0.58 3.58 2.47 -0.12 -0.91 114.94 126.15 1npj s ASN 87 Ca -0.13 -2.28 -0.19 0.00 0.42 0.00 0.00 52.86 50.67 1npj s ASN 87 Cb -0.17 -1.81 -0.05 0.00 -1.45 0.00 0.00 41.25 37.77 1npj s ASN 87 CO 0.06 -0.48 1.03 -2.65 -3.72 0.00 0.00 177.10 171.35 1npj n PRO 88 N 4.24 1.04 0.07 0.43 -0.02 -1.26 0.47 135.00 139.96 1npj n PRO 88 Ca 0.01 0.40 0.07 0.00 -2.02 0.00 0.00 63.50 61.96 1npj n PRO 88 Cb 0.40 -2.23 0.33 0.00 -0.02 0.00 0.00 33.50 31.99 1npj n PRO 88 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1npj n GLU 89 N -0.97 0.08 0.12 -0.52 0.28 -1.26 -1.44 120.64 116.93 1npj n GLU 89 Ca 0.13 0.43 0.13 0.00 -0.16 0.00 0.00 57.16 57.69 1npj n GLU 89 Cb 0.46 -1.69 0.43 0.00 1.43 0.00 0.00 31.44 32.07 1npj n GLU 89 CO 0.00 0.00 0.00 1.79 -0.16 0.00 0.00 177.13 178.76 1npj h THR 90 N 0.00 0.00 -4.47 3.84 1.35 -1.95 -3.44 112.91 108.24 1npj h THR 90 Ca 0.00 -0.43 -0.49 0.00 -0.55 0.00 0.00 66.41 64.94 1npj h THR 90 Cb 0.17 1.35 0.09 0.00 -1.73 0.00 0.00 68.15 68.02 1npj h THR 90 CO 0.00 0.00 0.40 0.20 -0.25 0.00 0.00 175.52 175.87 1npj s ASN 91 N -4.53 5.20 -0.00 5.36 0.01 -0.52 -5.01 114.94 115.45 1npj s ASN 91 Ca 0.09 1.11 0.04 0.00 -0.71 0.00 0.00 52.86 53.39 1npj s ASN 91 Cb 0.11 -1.87 -0.06 0.00 0.41 0.00 0.00 41.25 39.85 1npj s ASN 91 CO 0.54 -1.50 0.13 0.35 -1.51 0.00 0.00 177.10 175.11 1npj n THR 92 N -3.10 0.00 -4.24 1.60 -2.24 -1.26 -4.77 114.28 100.26 1npj n THR 92 Ca 0.07 -0.22 -0.23 0.00 -2.27 0.00 0.00 64.05 61.39 1npj n THR 92 Cb 0.57 0.65 -0.07 0.00 -2.10 0.00 0.00 70.33 69.39 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 -2.84 3.34 0.19 3.22 1.43 -1.26 -4.90 118.68 117.87 1npj s LEU 93 Ca -0.00 -0.52 -0.25 0.00 -1.03 0.00 0.00 54.13 52.32 1npj s LEU 93 Cb 0.03 -1.89 -0.08 0.00 0.03 0.00 0.00 46.19 44.28 1npj s LEU 93 CO 0.17 0.01 0.80 -0.32 0.23 0.00 0.00 176.35 177.24 1npj s MET 94 N -3.58 4.57 0.12 1.70 -2.45 -1.26 -4.18 119.30 114.22 1npj s MET 94 Ca 0.31 1.18 0.02 0.00 -1.25 0.00 0.00 55.69 55.94 1npj s MET 94 Cb -0.07 -3.19 -0.04 0.00 1.25 0.00 0.00 34.83 32.78 1npj s MET 94 CO 0.21 0.52 -0.04 -1.01 1.05 0.00 0.00 175.02 175.75 1npj s HIS 95 N -1.23 0.99 0.00 4.11 0.09 -0.68 -4.89 115.29 113.69 1npj s HIS 95 Ca 0.38 -0.96 -0.00 0.00 -0.00 0.00 0.00 55.06 54.49 1npj s HIS 95 Cb -0.22 -0.57 0.00 0.00 -0.00 0.00 0.00 32.58 31.79 1npj s HIS 95 CO 0.26 -0.18 0.00 0.27 -0.00 0.00 0.00 174.74 175.10 1npj n ASN 96 N -0.11 -0.01 -3.75 1.40 6.94 -1.26 -0.85 115.26 117.63 1npj n ASN 96 Ca -0.10 -1.01 -0.12 0.00 -0.02 0.00 0.00 54.58 53.32 1npj n ASN 96 Cb 0.62 0.02 -0.12 0.00 -2.36 0.00 0.00 39.78 37.94 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 -2.64 -0.02 -0.25 1.53 1.10 -1.26 -4.26 121.20 115.40 1npj s ILE 97 Ca 0.00 0.07 -0.02 0.00 -0.51 0.00 0.00 60.65 60.20 1npj s ILE 97 Cb -0.00 -0.42 0.03 0.00 0.15 0.00 0.00 42.46 42.22 1npj s ILE 97 CO 0.00 0.03 -0.06 -0.62 -2.11 0.00 0.00 174.94 172.18 1npj s ASP 98 N 0.75 4.38 -0.32 4.50 -1.08 0.02 -1.62 116.67 123.30 1npj s ASP 98 Ca -0.05 -0.93 -0.15 0.00 -0.52 0.00 0.00 52.55 50.90 1npj s ASP 98 Cb -0.06 -1.67 -0.02 0.00 -1.46 0.00 0.00 42.92 39.71 1npj s ASP 98 CO -0.05 -0.14 0.38 -0.36 0.52 0.00 0.00 175.17 175.51 1npj s PHE 99 N 1.31 3.22 -0.08 -5.34 0.40 0.45 -1.48 117.98 116.46 1npj s PHE 99 Ca -0.01 0.14 0.28 0.00 -0.60 0.00 0.00 56.93 56.74 1npj s PHE 99 Cb -0.17 -2.66 1.38 0.00 0.51 0.00 0.00 43.02 42.08 1npj s PHE 99 CO -0.04 -0.37 1.85 0.45 0.70 0.00 0.00 175.22 177.81 1npj h HIS 100 N 8.37 0.00 0.00 0.36 3.86 -1.34 -1.43 115.15 124.97 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 0.72 0.00 0.00 0.00 0.86 0.00 0.00 177.93 179.51 1npj h ALA 101 N 2.08 1.00 -2.30 2.45 0.00 -1.91 -3.47 119.26 117.12 1npj h ALA 101 Ca 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1npj h ALA 101 Cb 0.17 0.00 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1npj h ALA 101 CO 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 179.25 179.18 1npj s ALA 102 N -3.19 3.58 -0.20 0.00 0.00 -0.54 -4.66 121.76 116.74 1npj s ALA 102 Ca 0.08 -0.69 -0.00 0.00 0.00 0.00 0.00 51.96 51.35 1npj s ALA 102 Cb 0.07 -2.32 0.02 0.00 0.00 0.00 0.00 23.12 20.88 1npj s ALA 102 CO 0.65 -0.08 -0.14 0.99 0.00 0.00 0.00 175.76 177.18 1npj s THR 103 N -2.41 2.46 0.00 0.00 2.01 -1.26 -4.66 115.64 111.78 1npj s THR 103 Ca 0.43 -0.88 0.00 0.00 0.31 0.00 0.00 61.69 61.55 1npj s THR 103 Cb -0.10 -2.11 0.00 0.00 0.01 0.00 0.00 72.50 70.30 1npj s THR 103 CO 0.38 0.44 0.00 0.61 -0.69 0.00 0.00 174.62 175.36 1npj n GLY 104 N 4.66 2.84 4.18 4.40 0.00 -1.26 -4.94 105.19 115.07 1npj n GLY 104 Ca -0.19 -1.94 -0.32 0.00 0.00 0.00 0.00 46.02 43.56 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 0.22 -2.06 -3.69 4.61 0.00 -1.26 -0.23 120.51 118.10 1npj n ALA 105 Ca 0.00 -0.43 -0.27 0.00 0.00 0.00 0.00 53.44 52.75 1npj n ALA 105 Cb 0.00 -1.07 0.05 0.00 0.00 0.00 0.00 19.45 18.44 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 -4.47 -2.98 -0.11 0.00 4.77 -1.26 -0.52 117.00 112.43 1npj n LEU 106 Ca -0.27 -0.62 -0.01 0.00 -0.03 0.00 0.00 56.01 55.08 1npj n LEU 106 Cb 0.63 -2.82 -0.01 0.00 -2.33 0.00 0.00 43.42 38.90 1npj n LEU 106 CO 0.78 0.55 -0.01 0.61 -1.33 0.00 0.00 177.39 177.99 1npj n GLY 107 N -1.84 0.50 0.00 -0.72 0.00 0.69 -2.28 105.19 101.52 1npj n GLY 107 Ca 0.02 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.77 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 -2.24 1.28 0.36 -0.02 0.00 -0.41 -0.41 105.19 103.75 1npj n GLY 108 Ca -0.01 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.07 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 1.16 2.00 -0.02 0.00 -0.30 -1.53 103.07 104.38 1npj h GLY 109 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1npj h GLY 109 CO 0.00 0.22 0.00 0.61 0.00 0.00 0.00 176.54 177.37 1npj n GLY 110 N -1.42 -1.24 0.28 4.60 0.00 0.32 -3.36 105.19 104.36 1npj n GLY 110 Ca 0.14 -0.06 0.04 0.00 0.00 0.00 0.00 46.02 46.14 1npj n GLY 110 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1npj n LEU 111 N -1.59 1.51 -0.09 0.99 4.77 -0.61 -4.67 117.00 117.31 1npj n LEU 111 Ca 0.05 -0.94 0.10 0.00 -0.03 0.00 0.00 56.01 55.18 1npj n LEU 111 Cb 0.25 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.48 1npj n LEU 111 CO 0.20 0.30 0.56 0.35 -1.33 0.00 0.00 177.39 177.47 1npj n THR 112 N 0.26 1.84 -2.17 -5.08 -2.24 -1.00 -4.95 114.28 100.93 1npj n THR 112 Ca 0.04 -2.22 -0.43 0.00 -2.27 0.00 0.00 64.05 59.18 1npj n THR 112 Cb 0.19 -0.22 -0.02 0.00 -2.10 0.00 0.00 70.33 68.18 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 -2.80 3.38 -0.10 -0.78 2.02 -1.26 -4.13 118.70 115.04 1npj s GLU 113 Ca 0.31 1.10 0.04 0.00 0.02 0.00 0.00 54.97 56.44 1npj s GLU 113 Cb 0.27 -4.13 0.00 0.00 0.10 0.00 0.00 34.13 30.37 1npj s GLU 113 CO 0.03 -1.80 -0.23 0.96 0.02 0.00 0.00 175.26 174.23 1npj s ILE 114 N 6.37 2.01 0.69 -1.63 -5.25 -0.03 -4.98 121.20 118.38 1npj s ILE 114 Ca 0.69 -0.99 -0.09 0.00 -0.99 0.00 0.00 60.65 59.27 1npj s ILE 114 Cb -0.17 -1.74 0.03 0.00 2.95 0.00 0.00 42.46 43.52 1npj s ILE 114 CO 0.32 0.55 1.04 0.20 -1.79 0.00 0.00 174.94 175.26 1npj s ASN 115 N 0.35 5.26 0.24 4.36 0.02 -1.26 -1.69 114.94 122.22 1npj s ASN 115 Ca -0.19 0.85 -0.31 0.00 -1.02 0.00 0.00 52.86 52.19 1npj s ASN 115 Cb -0.18 -1.64 -0.13 0.00 0.02 0.00 0.00 41.25 39.32 1npj s ASN 115 CO 0.09 -1.38 1.50 -2.65 0.02 0.00 0.00 177.10 174.68 1npj n PRO 116 N -2.91 2.26 -0.28 -0.60 -0.02 -1.26 -1.11 135.00 131.07 1npj n PRO 116 Ca 0.06 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.35 1npj n PRO 116 Cb 0.58 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.54 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 2.49 0.70 3.57 -1.23 0.00 0.18 -4.69 105.19 106.21 1npj n GLY 117 Ca 0.12 0.00 -0.25 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 -0.72 1.93 0.15 1.61 2.02 -0.27 -4.87 118.70 118.55 1npj s GLU 118 Ca 0.00 -1.78 -0.04 0.00 0.02 0.00 0.00 54.97 53.17 1npj s GLU 118 Cb 0.00 -1.85 -0.03 0.00 0.10 0.00 0.00 34.13 32.35 1npj s GLU 118 CO 0.00 0.21 0.15 -1.59 0.02 0.00 0.00 175.26 174.04 1npj s LYS 119 N -3.63 1.03 0.05 1.61 -2.85 -1.26 -0.95 119.74 113.73 1npj s LYS 119 Ca 0.33 -1.35 -0.23 0.00 -1.00 0.00 0.00 55.97 53.72 1npj s LYS 119 Cb -0.01 0.29 0.05 0.00 -2.06 0.00 0.00 37.83 36.11 1npj s LYS 119 CO 0.18 -0.33 0.53 -0.08 0.10 0.00 0.00 175.35 175.74 1npj s THR 120 N -4.02 0.03 -0.16 3.79 -1.32 -0.57 -5.00 115.64 108.38 1npj s THR 120 Ca 0.22 -0.23 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 1npj s THR 120 Cb 0.06 -0.97 0.03 0.00 -1.51 0.00 0.00 72.50 70.10 1npj s THR 120 CO 0.02 -0.13 -0.14 -0.63 -2.21 0.00 0.00 174.62 171.54 1npj s ILE 121 N -2.43 1.62 -0.07 5.08 1.09 -1.26 -0.63 121.20 124.61 1npj s ILE 121 Ca -0.05 -0.74 0.02 0.00 -1.10 0.00 0.00 60.65 58.78 1npj s ILE 121 Cb -0.01 -1.56 -0.03 0.00 -1.06 0.00 0.00 42.46 39.81 1npj s ILE 121 CO -0.02 0.40 -0.12 -0.22 -0.10 0.00 0.00 174.94 174.88 1npj s LEU 122 N 1.45 2.85 -0.03 2.97 2.96 -0.35 -4.96 118.68 123.57 1npj s LEU 122 Ca 0.04 -0.17 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 1npj s LEU 122 Cb -0.14 -1.60 -0.01 0.00 0.50 0.00 0.00 46.19 44.95 1npj s LEU 122 CO -0.10 0.32 -0.16 -0.60 -1.32 0.00 0.00 176.35 174.49 1npj s ARG 123 N -0.59 1.47 0.02 1.98 3.52 -1.26 -0.80 118.95 123.29 1npj s ARG 123 Ca 0.08 -0.55 -0.08 0.00 -0.13 0.00 0.00 55.73 55.05 1npj s ARG 123 Cb -0.11 -1.34 0.00 0.00 -1.56 0.00 0.00 34.95 31.94 1npj s ARG 123 CO 0.01 0.27 0.16 -0.59 -0.81 0.00 0.00 175.30 174.34 1npj s PHE 124 N -0.11 0.07 -0.20 5.12 -0.12 -0.90 -4.99 117.98 116.85 1npj s PHE 124 Ca 0.00 -0.23 -0.22 0.00 -0.05 0.00 0.00 56.93 56.43 1npj s PHE 124 Cb -0.09 -0.05 -0.02 0.00 -0.63 0.00 0.00 43.02 42.23 1npj s PHE 124 CO 0.01 -0.35 0.70 0.21 -0.05 0.00 0.00 175.22 175.74 1npj s LYS 125 N -1.98 4.22 -1.31 1.99 2.20 -1.26 -1.53 119.74 122.07 1npj s LYS 125 Ca -0.10 0.75 -0.16 0.00 -0.36 0.00 0.00 55.97 56.10 1npj s LYS 125 Cb -0.04 -3.59 0.09 0.00 -1.51 0.00 0.00 37.83 32.78 1npj s LYS 125 CO -0.01 -0.31 1.78 0.00 -0.36 0.00 0.00 175.35 176.45 1npj n ALA 126 N 5.28 4.12 0.27 3.13 0.00 -0.74 -4.77 120.51 127.80 1npj n ALA 126 Ca 0.01 -3.97 0.16 0.00 0.00 0.00 0.00 53.44 49.65 1npj n ALA 126 Cb 0.49 -3.44 0.59 0.00 0.00 0.00 0.00 19.45 17.08 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 4.96 0.00 -3.86 0.00 1.35 -1.86 0.35 112.91 113.86 1npj h THR 127 Ca 0.44 -0.60 -0.64 0.00 -0.55 0.00 0.00 66.41 65.06 1npj h THR 127 Cb 0.81 1.60 -0.32 0.00 -1.73 0.00 0.00 68.15 68.52 1npj h THR 127 CO 1.51 0.00 -0.87 -0.54 -0.25 0.00 0.00 175.52 175.38 1npj s LYS 128 N -3.58 2.33 0.18 4.72 1.02 -1.26 -4.73 119.74 118.42 1npj s LYS 128 Ca 0.02 -0.78 -0.27 0.00 0.02 0.00 0.00 55.97 54.96 1npj s LYS 128 Cb 0.08 -1.94 -0.08 0.00 -0.52 0.00 0.00 37.83 35.37 1npj s LYS 128 CO 0.57 0.29 0.84 -1.25 -0.92 0.00 0.00 175.35 174.88 1npj s PRO 129 N 0.01 4.66 0.00 -1.68 0.04 -1.26 -4.80 135.00 131.97 1npj s PRO 129 Ca -0.06 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.25 1npj s PRO 129 Cb -0.14 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.12 1npj s PRO 129 CO 0.04 0.52 0.00 0.41 0.04 0.00 0.00 177.00 178.01 1npj n GLY 130 N 1.65 -0.27 3.90 0.56 0.00 0.32 -1.98 105.19 109.37 1npj n GLY 130 Ca -0.04 -1.72 -0.34 0.00 0.00 0.00 0.00 46.02 43.92 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 -1.55 5.43 0.01 1.61 -7.23 0.11 -0.41 120.40 118.36 1npj s VAL 131 Ca 0.00 -0.05 -0.03 0.00 -1.81 0.00 0.00 61.98 60.09 1npj s VAL 131 Cb 0.00 -3.52 -0.01 0.00 0.56 0.00 0.00 36.38 33.41 1npj s VAL 131 CO 0.00 0.38 0.05 -0.36 -0.31 0.00 0.00 175.10 174.86 1npj s PHE 132 N -1.27 0.13 0.46 2.82 0.08 -0.03 -4.51 117.98 115.66 1npj s PHE 132 Ca 0.25 -0.28 -0.16 0.00 0.12 0.00 0.00 56.93 56.86 1npj s PHE 132 Cb -0.13 -0.10 -0.08 0.00 -0.57 0.00 0.00 43.02 42.14 1npj s PHE 132 CO 0.16 -0.21 0.92 0.08 -0.10 0.00 0.00 175.22 176.07 1npj s VAL 133 N -1.22 4.56 0.01 -0.44 1.01 -1.26 -0.32 120.40 122.75 1npj s VAL 133 Ca -0.13 1.15 0.01 0.00 0.00 0.00 0.00 61.98 63.01 1npj s VAL 133 Cb -0.08 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 1npj s VAL 133 CO 0.00 -0.54 -0.05 -0.72 0.00 0.00 0.00 175.10 173.79 1npj s TYR 134 N -2.44 0.45 0.10 5.22 -0.85 -0.64 -0.95 117.35 118.24 1npj s TYR 134 Ca 0.58 -0.26 -0.25 0.00 -0.52 0.00 0.00 57.07 56.62 1npj s TYR 134 Cb -0.10 -0.28 0.08 0.00 0.38 0.00 0.00 41.96 42.04 1npj s TYR 134 CO 0.26 -0.05 0.67 -3.38 -1.52 0.00 0.00 175.55 171.53 1npj s HIS 135 N -0.67 -0.51 0.54 -3.49 -3.43 -0.55 -0.68 115.29 106.50 1npj s HIS 135 Ca -0.04 0.37 -0.19 0.00 -0.80 0.00 0.00 55.06 54.40 1npj s HIS 135 Cb -0.05 0.54 -0.06 0.00 -1.43 0.00 0.00 32.58 31.58 1npj s HIS 135 CO -0.00 -0.76 1.07 0.00 -2.00 0.00 0.00 174.74 173.05 1npj n ALA 137 N -1.37 -0.12 -2.30 0.00 0.00 -1.26 -4.54 120.51 110.92 1npj n ALA 137 Ca 0.10 -1.95 -0.43 0.00 0.00 0.00 0.00 53.44 51.17 1npj n ALA 137 Cb 0.52 -1.11 -0.02 0.00 0.00 0.00 0.00 19.45 18.83 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 -0.34 4.25 0.02 0.00 0.04 -1.26 -4.84 135.00 132.87 1npj s PRO 138 Ca 0.27 1.83 -0.39 0.00 0.04 0.00 0.00 61.00 62.76 1npj s PRO 138 Cb 0.29 -3.74 -0.19 0.00 0.04 0.00 0.00 34.50 30.91 1npj s PRO 138 CO -0.08 -0.67 1.21 -2.30 0.04 0.00 0.00 177.00 175.21 1npj n PRO 139 N 6.24 0.50 0.00 0.56 -0.02 -1.26 -1.30 135.00 139.72 1npj n PRO 139 Ca 0.14 0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.80 1npj n PRO 139 Cb 0.44 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.18 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 2.05 3.37 1.85 -1.23 0.00 -1.26 -4.80 105.19 105.17 1npj n GLY 140 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -1.56 0.56 0.17 1.61 2.81 -0.42 -4.97 117.12 115.31 1npj n MET 141 Ca 0.00 -2.12 -0.16 0.00 -1.81 0.00 0.00 57.70 53.61 1npj n MET 141 Cb 0.00 -0.27 -0.08 0.00 -0.71 0.00 0.00 33.22 32.16 1npj n MET 141 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1npj h VAL 142 N 6.01 0.12 -0.58 2.03 2.07 -1.82 -2.63 116.25 121.45 1npj h VAL 142 Ca -0.29 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.20 1npj h VAL 142 Cb 1.60 0.12 -0.03 0.00 -1.52 0.00 0.00 31.29 31.46 1npj h VAL 142 CO 0.02 0.00 0.24 1.55 0.02 0.00 0.00 177.57 179.40 1npj h PRO 143 N -0.76 0.83 -0.78 1.57 0.13 -1.92 -2.86 132.00 128.21 1npj h PRO 143 Ca -0.01 -0.12 0.07 0.00 -0.87 0.00 0.00 66.00 65.06 1npj h PRO 143 Cb 0.74 -0.15 -0.06 0.00 0.13 0.00 0.00 31.00 31.66 1npj h PRO 143 CO -0.18 0.68 0.46 2.35 -0.23 0.00 0.00 178.00 181.08 1npj h TRP 144 N 0.82 0.85 -0.19 1.56 7.01 -1.90 -0.36 115.95 123.75 1npj h TRP 144 Ca 0.20 0.03 -0.02 0.00 2.11 0.00 0.00 58.89 61.20 1npj h TRP 144 Cb 0.15 -0.27 -0.01 0.00 -2.10 0.00 0.00 29.16 26.94 1npj h TRP 144 CO 0.01 0.41 0.03 0.00 -2.79 0.00 0.00 178.44 176.11 1npj h ALA 145 N 1.39 0.25 -0.35 2.65 0.00 -1.33 -2.65 119.26 119.22 1npj h ALA 145 Ca 0.35 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1npj h ALA 145 Cb 0.21 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1npj h ALA 145 CO -0.19 -0.09 0.11 0.28 0.00 0.00 0.00 179.25 179.37 1npj h VAL 146 N 0.11 1.21 -0.00 0.00 2.07 -1.21 -2.40 116.25 116.03 1npj h VAL 146 Ca 0.06 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1npj h VAL 146 Cb 0.30 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1npj h VAL 146 CO 0.00 0.23 0.00 1.33 0.02 0.00 0.00 177.57 179.15 1npj n VAL 147 N -4.65 0.00 -0.39 2.57 0.24 -0.19 -1.43 118.33 114.47 1npj n VAL 147 Ca -0.01 -0.00 0.11 0.00 -2.04 0.00 0.00 64.34 62.39 1npj n VAL 147 Cb 0.17 -0.28 0.31 0.00 -1.47 0.00 0.00 33.84 32.57 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 -0.77 3.98 0.00 -1.34 7.64 -0.94 -4.64 113.62 117.55 1npj n SER 148 Ca 0.14 -2.07 0.00 0.00 1.01 0.00 0.00 58.87 57.95 1npj n SER 148 Cb 0.07 -0.48 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 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 1.47 0.78 2.98 0.23 0.00 -0.51 -1.38 105.19 108.76 1npj n GLY 149 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.26 3.48 -3.44 1.61 0.00 -0.88 -4.57 117.12 111.06 1npj n MET 150 Ca 0.00 -3.48 -0.11 0.00 0.00 0.00 0.00 57.70 54.11 1npj n MET 150 Cb 0.00 -3.00 -0.02 0.00 0.00 0.00 0.00 33.22 30.20 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 1.56 -0.53 0.00 6.12 2.20 -1.26 -1.43 114.94 121.61 1npj s ASN 151 Ca 0.41 0.02 0.00 0.00 -0.94 0.00 0.00 52.86 52.35 1npj s ASN 151 Cb 0.08 0.55 0.00 0.00 -2.00 0.00 0.00 41.25 39.88 1npj s ASN 151 CO -0.00 -0.88 0.00 0.61 -2.94 0.00 0.00 177.10 173.88 1npj n GLY 152 N -0.31 2.77 3.51 0.45 0.00 0.14 -0.43 105.19 111.32 1npj n GLY 152 Ca -0.15 -0.46 -0.09 0.00 0.00 0.00 0.00 46.02 45.31 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 -0.63 0.13 4.61 0.00 -1.26 -1.63 121.76 121.98 1npj s ALA 153 Ca 0.00 -0.48 0.04 0.00 0.00 0.00 0.00 51.96 51.52 1npj s ALA 153 Cb 0.00 0.89 -0.04 0.00 0.00 0.00 0.00 23.12 23.97 1npj s ALA 153 CO 0.00 -0.79 -0.09 0.96 0.00 0.00 0.00 175.76 175.84 1npj s ILE 154 N -3.92 1.04 -0.10 0.00 -4.36 0.56 -2.97 121.20 111.44 1npj s ILE 154 Ca 0.13 -1.98 0.02 0.00 -0.26 0.00 0.00 60.65 58.56 1npj s ILE 154 Cb -0.00 -1.75 0.01 0.00 1.25 0.00 0.00 42.46 41.97 1npj s ILE 154 CO 0.00 -0.75 -0.15 -0.32 0.24 0.00 0.00 174.94 173.96 1npj s MET 155 N -3.64 2.19 -0.46 0.37 -2.45 0.65 -0.85 119.30 115.11 1npj s MET 155 Ca 0.14 -0.55 -0.07 0.00 -1.25 0.00 0.00 55.69 53.96 1npj s MET 155 Cb 0.02 -1.85 0.12 0.00 1.25 0.00 0.00 34.83 34.37 1npj s MET 155 CO -0.01 -0.05 0.31 0.08 1.05 0.00 0.00 175.02 176.41 1npj s VAL 156 N 0.93 3.88 0.38 10.11 1.01 0.45 -1.03 120.40 136.13 1npj s VAL 156 Ca -0.08 -1.95 -0.24 0.00 0.00 0.00 0.00 61.98 59.70 1npj s VAL 156 Cb -0.15 -3.59 -0.10 0.00 0.00 0.00 0.00 36.38 32.55 1npj s VAL 156 CO -0.01 -0.76 1.00 -0.76 0.00 0.00 0.00 175.10 174.57 1npj s LEU 157 N 1.19 4.18 0.62 3.92 1.43 0.21 -0.52 118.68 129.72 1npj s LEU 157 Ca 0.07 1.91 -0.18 0.00 -1.03 0.00 0.00 54.13 54.91 1npj s LEU 157 Cb -0.24 -4.17 -0.02 0.00 0.03 0.00 0.00 46.19 41.78 1npj s LEU 157 CO -0.02 -0.31 1.24 -2.84 0.23 0.00 0.00 176.35 174.64 1npj s PRO 158 N -2.43 2.75 0.57 1.29 0.02 -1.26 -0.35 135.00 135.59 1npj s PRO 158 Ca 0.56 1.90 0.29 0.00 0.02 0.00 0.00 61.00 63.76 1npj s PRO 158 Cb -0.19 -1.89 1.73 0.00 0.02 0.00 0.00 34.50 34.17 1npj s PRO 158 CO 0.24 -1.40 2.21 0.00 -0.33 0.00 0.00 177.00 177.73 1npj h ARG 159 N 0.66 0.00 -0.65 5.54 3.08 -1.88 -0.58 114.38 120.54 1npj h ARG 159 Ca -0.50 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.55 1npj h ARG 159 Cb 1.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.36 1npj h ARG 159 CO 0.54 0.03 0.00 0.39 -1.07 0.00 0.00 179.97 179.86 1npj n GLU 160 N -3.80 3.92 -0.09 0.04 1.02 -1.26 -0.64 120.64 119.82 1npj n GLU 160 Ca -0.03 -2.56 0.01 0.00 -0.02 0.00 0.00 57.16 54.56 1npj n GLU 160 Cb 0.12 -2.02 -0.00 0.00 -0.02 0.00 0.00 31.44 29.52 1npj n GLU 160 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1npj n GLY 161 N 0.71 -2.05 3.83 0.62 0.00 -0.23 -4.79 105.19 103.29 1npj n GLY 161 Ca 0.23 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.49 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 4.17 0.10 0.99 1.43 -1.25 -4.32 118.68 119.79 1npj s LEU 162 Ca 0.00 1.44 0.01 0.00 -1.03 0.00 0.00 54.13 54.55 1npj s LEU 162 Cb 0.00 -3.96 -0.04 0.00 0.03 0.00 0.00 46.19 42.21 1npj s LEU 162 CO 0.00 -0.13 -0.05 -1.00 0.23 0.00 0.00 176.35 175.40 1npj s HIS 163 N -1.81 0.85 0.00 0.29 3.76 -1.26 -0.08 115.29 117.04 1npj s HIS 163 Ca 0.51 -0.96 0.00 0.00 -0.15 0.00 0.00 55.06 54.46 1npj s HIS 163 Cb -0.13 -0.51 0.00 0.00 1.11 0.00 0.00 32.58 33.05 1npj s HIS 163 CO 0.19 -0.20 0.00 -0.40 -0.85 0.00 0.00 174.74 173.47 1npj n ASP 164 N -0.03 0.00 0.29 1.40 5.68 0.13 -4.79 116.55 119.23 1npj n ASP 164 Ca -0.12 -0.86 0.18 0.00 -0.50 0.00 0.00 54.79 53.49 1npj n ASP 164 Cb 0.61 0.00 0.81 0.00 -1.14 0.00 0.00 41.12 41.40 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 -2.26 6.12 0.00 -1.89 -3.17 103.07 101.87 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 -3.13 3.59 -0.48 4.80 4.76 -1.26 -4.96 118.16 121.48 1npj n LYS 166 Ca -0.00 -2.94 0.00 0.00 -2.87 0.00 0.00 58.31 52.49 1npj n LYS 166 Cb 0.25 -1.98 0.00 0.00 -1.84 0.00 0.00 35.03 31.46 1npj n LYS 166 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1npj n GLY 167 N -0.10 0.74 3.73 0.72 0.00 -1.20 -5.05 105.19 104.03 1npj n GLY 167 Ca 0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.52 4.44 0.40 1.61 3.01 -1.26 -4.82 119.74 122.60 1npj s LYS 168 Ca 0.00 0.91 -0.27 0.00 -1.01 0.00 0.00 55.97 55.61 1npj s LYS 168 Cb 0.00 -3.41 -0.09 0.00 -1.01 0.00 0.00 37.83 33.31 1npj s LYS 168 CO 0.00 0.16 1.39 0.00 0.51 0.00 0.00 175.35 177.41 1npj s ALA 169 N 0.46 3.36 -0.24 5.17 0.00 -1.26 0.21 121.76 129.46 1npj s ALA 169 Ca 0.37 1.40 0.01 0.00 0.00 0.00 0.00 51.96 53.74 1npj s ALA 169 Cb -0.18 -3.55 0.06 0.00 0.00 0.00 0.00 23.12 19.44 1npj s ALA 169 CO 0.19 -0.98 -0.05 -0.51 0.00 0.00 0.00 175.76 174.40 1npj s LEU 170 N -2.36 2.59 -0.23 0.00 1.43 0.89 -4.77 118.68 116.22 1npj s LEU 170 Ca 0.56 -1.18 -0.03 0.00 -1.03 0.00 0.00 54.13 52.45 1npj s LEU 170 Cb -0.42 -1.19 0.01 0.00 0.03 0.00 0.00 46.19 44.62 1npj s LEU 170 CO 0.56 -0.24 -0.06 -0.89 0.23 0.00 0.00 176.35 175.95 1npj s THR 171 N 1.39 3.06 0.35 5.49 2.01 -1.26 -3.94 115.64 122.75 1npj s THR 171 Ca -0.06 -0.77 -0.12 0.00 0.31 0.00 0.00 61.69 61.05 1npj s THR 171 Cb -0.19 -2.47 -0.07 0.00 0.01 0.00 0.00 72.50 69.78 1npj s THR 171 CO -0.06 0.32 0.73 -0.72 -0.69 0.00 0.00 174.62 174.19 1npj s TYR 172 N 1.40 3.43 0.01 4.92 -0.85 -1.26 -4.89 117.35 120.10 1npj s TYR 172 Ca 0.03 1.06 -0.01 0.00 -0.52 0.00 0.00 57.07 57.64 1npj s TYR 172 Cb -0.15 -2.44 -0.27 0.00 0.38 0.00 0.00 41.96 39.48 1npj s TYR 172 CO -0.04 0.01 0.86 -0.44 -1.52 0.00 0.00 175.55 174.42 1npj h ASP 173 N 1.73 0.31 -5.17 -0.18 3.32 -0.37 -3.48 116.42 112.59 1npj h ASP 173 Ca -0.47 -0.45 -0.08 0.00 0.02 0.00 0.00 57.03 56.05 1npj h ASP 173 Cb 1.18 -0.10 -0.13 0.00 0.22 0.00 0.00 39.33 40.50 1npj h ASP 173 CO 0.65 1.38 -0.24 -1.59 -1.72 0.00 0.00 179.24 177.71 1npj s LYS 174 N -2.62 1.06 0.01 3.56 -2.85 -1.08 -5.03 119.74 112.78 1npj s LYS 174 Ca -0.08 -0.96 0.02 0.00 -1.00 0.00 0.00 55.97 53.95 1npj s LYS 174 Cb 0.07 0.40 -0.01 0.00 -2.06 0.00 0.00 37.83 36.23 1npj s LYS 174 CO 0.84 -0.39 -0.06 -1.50 0.10 0.00 0.00 175.35 174.34 1npj s ILE 175 N -3.88 0.47 0.09 3.79 -1.16 -1.26 -1.77 121.20 117.46 1npj s ILE 175 Ca 0.09 -0.49 0.06 0.00 -0.51 0.00 0.00 60.65 59.79 1npj s ILE 175 Cb 0.03 -0.44 -0.03 0.00 0.61 0.00 0.00 42.46 42.63 1npj s ILE 175 CO -0.07 -0.03 -0.15 -0.31 -2.81 0.00 0.00 174.94 171.57 1npj s TYR 176 N -0.51 1.30 -0.22 3.50 2.02 -0.49 -4.52 117.35 118.43 1npj s TYR 176 Ca -0.02 -0.48 0.02 0.00 -0.37 0.00 0.00 57.07 56.22 1npj s TYR 176 Cb -0.05 -0.72 0.04 0.00 -0.40 0.00 0.00 41.96 40.84 1npj s TYR 176 CO -0.00 0.09 -0.13 -0.47 -1.57 0.00 0.00 175.55 173.46 1npj s TYR 177 N -1.48 2.85 -0.43 2.71 5.04 0.24 -1.07 117.35 125.21 1npj s TYR 177 Ca 0.01 -1.89 -0.12 0.00 -2.44 0.00 0.00 57.07 52.63 1npj s TYR 177 Cb -0.09 -1.83 0.06 0.00 0.35 0.00 0.00 41.96 40.46 1npj s TYR 177 CO 0.03 -0.82 0.30 0.08 -1.34 0.00 0.00 175.55 173.80 1npj s VAL 178 N 1.25 4.73 -0.20 3.14 1.01 0.13 -4.23 120.40 126.23 1npj s VAL 178 Ca -0.03 -1.13 -0.17 0.00 0.00 0.00 0.00 61.98 60.66 1npj s VAL 178 Cb -0.17 -3.80 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1npj s VAL 178 CO -0.08 -0.47 0.44 -0.83 0.00 0.00 0.00 175.10 174.16 1npj s GLY 179 N 2.16 2.07 -0.19 4.51 0.00 -1.26 -1.89 107.32 112.72 1npj s GLY 179 Ca 0.03 -0.49 -0.08 0.00 0.00 0.00 0.00 44.72 44.18 1npj s GLY 179 CO 0.05 0.93 0.08 1.85 0.00 0.00 0.00 173.10 176.01 1npj s GLU 180 N 1.48 4.04 -0.09 2.90 2.12 -0.37 -1.73 118.70 127.04 1npj s GLU 180 Ca 0.21 -0.31 0.04 0.00 0.36 0.00 0.00 54.97 55.27 1npj s GLU 180 Cb -0.15 -3.27 0.00 0.00 0.26 0.00 0.00 34.13 30.97 1npj s GLU 180 CO 0.09 0.28 -0.22 -1.14 -0.54 0.00 0.00 175.26 173.73 1npj s GLN 181 N 0.36 2.79 -0.21 4.30 2.00 0.90 -4.48 119.66 125.32 1npj s GLN 181 Ca 0.04 -0.79 -0.13 0.00 -2.00 0.00 0.00 55.36 52.48 1npj s GLN 181 Cb -0.12 -2.13 -0.04 0.00 0.80 0.00 0.00 33.01 31.52 1npj s GLN 181 CO -0.01 0.15 0.29 0.16 -0.50 0.00 0.00 175.29 175.38 1npj s ASP 182 N 0.41 6.31 0.09 6.67 3.84 -1.26 -1.18 116.67 131.55 1npj s ASP 182 Ca -0.18 0.35 0.07 0.00 -0.00 0.00 0.00 52.55 52.80 1npj s ASP 182 Cb -0.18 -2.18 -0.04 0.00 -1.38 0.00 0.00 42.92 39.15 1npj s ASP 182 CO 0.08 0.00 -0.13 -0.36 -0.00 0.00 0.00 175.17 174.76 1npj s PHE 183 N 1.11 2.67 -0.48 2.11 0.08 -0.31 -4.74 117.98 118.42 1npj s PHE 183 Ca 0.14 -0.19 0.03 0.00 0.12 0.00 0.00 56.93 57.03 1npj s PHE 183 Cb -0.14 -1.43 0.14 0.00 -0.57 0.00 0.00 43.02 41.02 1npj s PHE 183 CO 0.06 0.38 0.26 0.71 -0.10 0.00 0.00 175.22 176.54 1npj s TYR 184 N -1.13 2.42 -0.22 0.36 1.51 -1.26 -0.90 117.35 118.12 1npj s TYR 184 Ca 0.19 -2.71 -0.15 0.00 -1.01 0.00 0.00 57.07 53.39 1npj s TYR 184 Cb -0.11 -2.19 -0.04 0.00 -0.11 0.00 0.00 41.96 39.51 1npj s TYR 184 CO 0.11 -0.76 0.38 0.08 -1.11 0.00 0.00 175.55 174.25 1npj s VAL 185 N 0.04 5.20 0.65 0.71 1.01 -1.26 -4.77 120.40 121.98 1npj s VAL 185 Ca 0.18 0.64 -0.18 0.00 0.00 0.00 0.00 61.98 62.62 1npj s VAL 185 Cb -0.23 -3.71 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 1npj s VAL 185 CO -0.01 0.23 1.28 -2.84 0.00 0.00 0.00 175.10 173.76 1npj s PRO 186 N 1.50 2.55 0.16 2.72 0.02 -1.26 -4.87 135.00 135.81 1npj s PRO 186 Ca 0.17 2.02 0.09 0.00 0.02 0.00 0.00 61.00 63.30 1npj s PRO 186 Cb -0.15 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 1npj s PRO 186 CO 0.08 -1.59 -0.20 1.03 -0.33 0.00 0.00 177.00 175.99 1npj s ARG 187 N -3.42 1.30 0.69 5.54 0.52 -1.26 -1.37 118.95 120.95 1npj s ARG 187 Ca 0.81 -1.38 -0.01 0.00 -0.52 0.00 0.00 55.73 54.63 1npj s ARG 187 Cb -0.36 -1.47 0.14 0.00 0.52 0.00 0.00 34.95 33.78 1npj s ARG 187 CO 0.39 0.31 0.95 -0.40 0.02 0.00 0.00 175.30 176.58 1npj n ASP 188 N 0.47 1.14 0.33 0.23 5.68 0.97 -4.86 116.55 120.52 1npj n ASP 188 Ca -0.14 -2.00 0.21 0.00 -0.50 0.00 0.00 54.79 52.36 1npj n ASP 188 Cb 0.56 -0.62 1.15 0.00 -1.14 0.00 0.00 41.12 41.07 1npj n ASP 188 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1npj h GLU 189 N 0.00 0.00 -0.03 0.11 4.39 -2.02 0.92 114.58 117.96 1npj h GLU 189 Ca -0.31 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.39 1npj h GLU 189 Cb 1.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.77 1npj h GLU 189 CO 0.32 0.00 0.00 0.09 -1.16 0.00 0.00 179.01 178.26 1npj n ASN 190 N -3.12 1.24 -0.07 1.42 3.02 -1.26 -4.89 115.26 111.59 1npj n ASN 190 Ca -0.03 -1.44 -0.01 0.00 -0.03 0.00 0.00 54.58 53.07 1npj n ASN 190 Cb 0.11 -0.01 -0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1npj n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1npj n GLY 191 N 1.13 0.47 3.83 7.41 0.00 0.32 -5.03 105.19 113.33 1npj n GLY 191 Ca 0.19 -0.81 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 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 -1.67 3.76 0.36 1.61 2.47 -1.25 -4.81 119.74 120.21 1npj s LYS 192 Ca 0.00 0.07 -0.28 0.00 -1.56 0.00 0.00 55.97 54.19 1npj s LYS 192 Cb 0.00 -3.25 -0.11 0.00 -1.46 0.00 0.00 37.83 33.01 1npj s LYS 192 CO 0.00 0.64 1.42 0.71 0.16 0.00 0.00 175.35 178.27 1npj s TYR 193 N -0.72 2.77 0.21 4.03 1.51 -1.26 -0.02 117.35 123.87 1npj s TYR 193 Ca 0.17 1.26 -0.07 0.00 -1.01 0.00 0.00 57.07 57.42 1npj s TYR 193 Cb -0.14 -3.89 -0.06 0.00 -0.11 0.00 0.00 41.96 37.76 1npj s TYR 193 CO 0.06 -2.56 0.49 0.15 -1.11 0.00 0.00 175.55 172.59 1npj s LYS 194 N -1.93 3.71 0.08 -0.62 1.02 -0.47 -4.81 119.74 116.72 1npj s LYS 194 Ca 0.51 0.11 0.07 0.00 0.02 0.00 0.00 55.97 56.68 1npj s LYS 194 Cb -0.44 -2.71 -0.04 0.00 -0.52 0.00 0.00 37.83 34.12 1npj s LYS 194 CO 0.59 0.35 -0.12 0.15 -0.92 0.00 0.00 175.35 175.39 1npj s LYS 195 N -2.89 2.11 0.06 1.68 1.02 -1.26 -4.77 119.74 115.68 1npj s LYS 195 Ca 0.45 -1.00 0.05 0.00 0.02 0.00 0.00 55.97 55.49 1npj s LYS 195 Cb -0.11 -2.28 -0.03 0.00 -0.52 0.00 0.00 37.83 34.89 1npj s LYS 195 CO 0.24 0.52 -0.15 0.71 -0.92 0.00 0.00 175.35 175.75 1npj s TYR 196 N -1.13 1.27 0.04 3.18 2.02 -1.26 -5.06 117.35 116.42 1npj s TYR 196 Ca 0.19 -0.41 -0.19 0.00 -0.37 0.00 0.00 57.07 56.29 1npj s TYR 196 Cb -0.11 -0.73 -0.15 0.00 -0.40 0.00 0.00 41.96 40.57 1npj s TYR 196 CO 0.11 0.06 1.30 0.93 -1.57 0.00 0.00 175.55 176.37 1npj h GLU 197 N 4.56 0.44 -5.96 -0.62 5.08 -2.00 -3.45 114.58 112.63 1npj h GLU 197 Ca -0.40 -0.28 -0.53 0.00 -1.00 0.00 0.00 59.36 57.15 1npj h GLU 197 Cb 1.18 0.03 -0.17 0.00 0.50 0.00 0.00 28.75 30.30 1npj h GLU 197 CO 0.42 0.88 -0.77 0.00 -1.00 0.00 0.00 179.01 178.54 1npj s ALA 198 N -4.04 2.17 0.27 3.43 0.00 -1.26 -5.05 121.76 117.29 1npj s ALA 198 Ca -0.14 -1.60 -0.04 0.00 0.00 0.00 0.00 51.96 50.19 1npj s ALA 198 Cb 0.05 -0.19 0.35 0.00 0.00 0.00 0.00 23.12 23.34 1npj s ALA 198 CO 0.79 0.22 1.90 -1.00 0.00 0.00 0.00 175.76 177.67 1npj h PRO 199 N 2.94 1.10 -0.52 0.00 0.13 -1.95 -2.65 132.00 131.06 1npj h PRO 199 Ca -0.41 -0.12 -0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1npj h PRO 199 Cb 1.22 -0.22 -0.03 0.00 0.13 0.00 0.00 31.00 32.10 1npj h PRO 199 CO 0.54 0.80 0.31 0.78 -0.23 0.00 0.00 178.00 180.20 1npj h GLY 200 N 1.14 0.74 1.21 1.56 0.00 -2.00 -2.47 103.07 103.26 1npj h GLY 200 Ca 0.28 -0.30 0.09 0.00 0.00 0.00 0.00 47.33 47.40 1npj h GLY 200 CO -0.05 0.29 0.32 -0.55 0.00 0.00 0.00 176.54 176.55 1npj h ASP 201 N 0.71 0.22 0.50 0.19 3.45 -1.89 -1.77 116.42 117.83 1npj h ASP 201 Ca 0.19 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.65 1npj h ASP 201 Cb -0.02 -0.04 0.00 0.00 -0.56 0.00 0.00 39.33 38.70 1npj h ASP 201 CO -0.04 0.14 -0.27 0.00 -1.57 0.00 0.00 179.24 177.50 1npj n ALA 202 N -2.55 3.06 0.05 3.45 0.00 -0.93 -4.54 120.51 119.05 1npj n ALA 202 Ca 0.07 -0.30 -0.15 0.00 0.00 0.00 0.00 53.44 53.06 1npj n ALA 202 Cb 0.36 -1.23 -0.09 0.00 0.00 0.00 0.00 19.45 18.49 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 0.38 -1.51 -0.26 0.00 5.03 -1.34 -0.42 116.97 118.85 1npj h TYR 203 Ca 0.00 0.05 0.02 0.00 2.58 0.00 0.00 58.73 61.38 1npj h TYR 203 Cb 0.47 0.66 -0.02 0.00 1.55 0.00 0.00 36.73 39.39 1npj h TYR 203 CO 0.00 -0.56 0.12 1.49 -1.32 0.00 0.00 178.16 177.89 1npj h GLU 204 N -0.64 0.25 -0.68 1.82 4.81 -1.80 -0.34 114.58 118.01 1npj h GLU 204 Ca 0.02 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1npj h GLU 204 Cb 0.71 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 30.00 1npj h GLU 204 CO -0.36 0.17 0.32 -0.44 -0.73 0.00 0.00 179.01 177.96 1npj h ASP 205 N 0.26 0.87 -0.31 1.04 3.45 -1.82 -2.56 116.42 117.36 1npj h ASP 205 Ca 0.11 -0.10 -0.11 0.00 0.43 0.00 0.00 57.03 57.36 1npj h ASP 205 Cb 0.04 -0.22 -0.01 0.00 -0.56 0.00 0.00 39.33 38.58 1npj h ASP 205 CO -0.08 0.75 -0.22 0.74 -1.57 0.00 0.00 179.24 178.86 1npj h THR 206 N 0.96 1.30 -0.82 0.35 2.02 -0.64 -2.90 112.91 113.18 1npj h THR 206 Ca 0.23 -1.36 0.03 0.00 0.77 0.00 0.00 66.41 66.08 1npj h THR 206 Cb 0.11 1.50 -0.05 0.00 -1.74 0.00 0.00 68.15 67.98 1npj h THR 206 CO -0.03 0.44 0.54 0.58 0.37 0.00 0.00 175.52 177.42 1npj h VAL 207 N 0.45 1.15 -0.85 3.16 2.07 -0.83 0.10 116.25 121.50 1npj h VAL 207 Ca 0.06 -0.36 -0.03 0.00 0.82 0.00 0.00 66.70 67.19 1npj h VAL 207 Cb 0.77 0.02 -0.04 0.00 -1.52 0.00 0.00 31.29 30.53 1npj h VAL 207 CO 0.06 0.19 0.42 0.50 0.02 0.00 0.00 177.57 178.76 1npj h LYS 208 N 1.04 1.22 -0.33 1.57 3.64 -1.33 -1.11 116.57 121.27 1npj h LYS 208 Ca 0.32 -0.17 -0.17 0.00 -1.27 0.00 0.00 60.65 59.36 1npj h LYS 208 Cb -0.01 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 31.58 1npj h LYS 208 CO -0.09 0.93 -0.46 0.28 -2.27 0.00 0.00 179.45 177.84 1npj h VAL 209 N 1.21 1.27 -0.86 2.00 2.07 -1.07 -2.99 116.25 117.88 1npj h VAL 209 Ca 0.29 -1.64 0.07 0.00 0.82 0.00 0.00 66.70 66.25 1npj h VAL 209 Cb 0.10 1.50 -0.07 0.00 -1.52 0.00 0.00 31.29 31.30 1npj h VAL 209 CO -0.04 0.54 0.53 0.24 0.02 0.00 0.00 177.57 178.86 1npj h MET 210 N 0.71 0.91 0.00 1.57 2.86 -0.39 -1.43 114.93 119.16 1npj h MET 210 Ca 0.04 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1npj h MET 210 Cb 1.06 -0.21 0.00 0.00 0.06 0.00 0.00 31.60 32.51 1npj h MET 210 CO 0.11 0.60 0.00 0.00 1.06 0.00 0.00 176.91 178.68 1npj h ARG 211 N 0.94 0.00 0.00 1.72 3.08 -1.06 0.36 114.38 119.42 1npj h ARG 211 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 1npj h ARG 211 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 1npj h ARG 211 CO -0.20 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 178.95 1npj n THR 212 N -2.84 0.23 -2.31 2.04 -2.24 -0.54 -4.87 114.28 103.76 1npj n THR 212 Ca -0.02 0.04 -0.15 0.00 -2.27 0.00 0.00 64.05 61.66 1npj n THR 212 Cb 0.12 -0.61 -0.01 0.00 -2.10 0.00 0.00 70.33 67.72 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 -1.54 -1.34 -3.83 3.22 4.77 0.12 -4.93 117.00 113.46 1npj n LEU 213 Ca 0.06 0.16 -0.30 0.00 -0.03 0.00 0.00 56.01 55.90 1npj n LEU 213 Cb 0.31 -2.35 -0.15 0.00 -2.33 0.00 0.00 43.42 38.90 1npj n LEU 213 CO 0.24 -0.23 -0.32 -0.89 -1.33 0.00 0.00 177.39 174.87 1npj s THR 214 N -2.68 1.43 0.60 -5.08 2.01 -1.26 -5.11 115.64 105.56 1npj s THR 214 Ca 0.00 -1.88 -0.19 0.00 0.31 0.00 0.00 61.69 59.93 1npj s THR 214 Cb 0.00 -2.06 -0.03 0.00 0.01 0.00 0.00 72.50 70.42 1npj s THR 214 CO 0.00 -0.68 1.25 -2.16 -0.69 0.00 0.00 174.62 172.35 1npj s PRO 215 N 1.20 2.87 0.17 4.92 0.04 -1.26 -4.92 135.00 138.02 1npj s PRO 215 Ca 0.11 1.95 0.16 0.00 0.04 0.00 0.00 61.00 63.27 1npj s PRO 215 Cb -0.19 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.36 1npj s PRO 215 CO -0.16 -1.32 1.13 1.79 0.04 0.00 0.00 177.00 178.48 1npj h THR 216 N 0.87 0.67 -3.82 1.26 1.35 -1.38 -3.47 112.91 108.39 1npj h THR 216 Ca -0.51 -2.08 -0.19 0.00 -0.55 0.00 0.00 66.41 63.08 1npj h THR 216 Cb 1.31 2.21 -0.24 0.00 -1.73 0.00 0.00 68.15 69.70 1npj h THR 216 CO 0.55 0.38 -0.68 -1.00 -0.25 0.00 0.00 175.52 174.52 1npj s HIS 217 N -2.95 0.13 -0.17 4.73 3.76 -1.15 -4.84 115.29 114.79 1npj s HIS 217 Ca 0.00 -0.26 -0.04 0.00 -0.15 0.00 0.00 55.06 54.61 1npj s HIS 217 Cb 0.08 -0.10 0.06 0.00 1.11 0.00 0.00 32.58 33.73 1npj s HIS 217 CO 0.78 -0.13 0.07 0.08 -0.85 0.00 0.00 174.74 174.70 1npj s VAL 218 N -0.86 0.07 0.13 -0.90 1.01 -0.29 -1.16 120.40 118.41 1npj s VAL 218 Ca -0.09 -0.25 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1npj s VAL 218 Cb -0.06 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.60 1npj s VAL 218 CO -0.00 -0.25 -0.07 0.68 0.00 0.00 0.00 175.10 175.46 1npj s VAL 219 N 2.07 0.89 -0.11 2.92 -7.23 -0.32 0.02 120.40 118.63 1npj s VAL 219 Ca 0.01 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.14 1npj s VAL 219 Cb -0.16 -1.85 -0.04 0.00 0.56 0.00 0.00 36.38 34.90 1npj s VAL 219 CO -0.09 -0.74 0.05 -0.36 -0.31 0.00 0.00 175.10 173.66 1npj s PHE 220 N -3.50 3.30 -1.44 2.82 0.08 -1.26 -0.07 117.98 117.91 1npj s PHE 220 Ca 0.16 0.26 -0.09 0.00 0.12 0.00 0.00 56.93 57.39 1npj s PHE 220 Cb 0.04 -1.88 0.05 0.00 -0.57 0.00 0.00 43.02 40.66 1npj s PHE 220 CO -0.01 0.49 0.92 -1.71 -0.10 0.00 0.00 175.22 174.82 1npj n ASN 221 N 2.34 -3.82 0.00 1.36 4.05 -0.70 -3.16 115.26 115.32 1npj n ASN 221 Ca -0.19 -0.76 0.00 0.00 0.45 0.00 0.00 54.58 54.08 1npj n ASN 221 Cb 0.54 -4.10 0.00 0.00 1.23 0.00 0.00 39.78 37.45 1npj n ASN 221 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1npj n GLY 222 N -1.68 1.88 3.56 8.20 0.00 -0.44 -4.79 105.19 111.91 1npj n GLY 222 Ca -0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.32 -1.92 0.26 4.61 0.00 -1.19 -4.60 121.76 115.59 1npj s ALA 223 Ca 0.00 1.41 -0.31 0.00 0.00 0.00 0.00 51.96 53.06 1npj s ALA 223 Cb 0.00 -0.28 -0.13 0.00 0.00 0.00 0.00 23.12 22.71 1npj s ALA 223 CO 0.00 -0.47 1.45 0.28 0.00 0.00 0.00 175.76 177.02 1npj n VAL 224 N 0.27 0.99 -0.93 0.00 0.31 0.03 -1.68 118.33 117.33 1npj n VAL 224 Ca -0.08 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.00 1npj n VAL 224 Cb 0.59 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.92 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 2.13 0.22 0.38 2.92 0.00 -1.26 -4.80 105.19 104.78 1npj n GLY 225 Ca 0.11 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.32 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 2.42 -1.32 4.61 0.00 -1.53 -2.42 119.26 121.01 1npj h ALA 226 Ca 0.00 -0.01 -0.67 0.00 0.00 0.00 0.00 54.91 54.22 1npj h ALA 226 Cb 0.50 0.01 -0.35 0.00 0.00 0.00 0.00 17.79 17.95 1npj h ALA 226 CO 0.00 -0.58 0.08 1.28 0.00 0.00 0.00 179.25 180.03 1npj n LEU 227 N -4.40 5.97 -4.30 0.00 4.77 -1.26 -4.76 117.00 113.02 1npj n LEU 227 Ca 0.11 -5.08 -0.17 0.00 -0.03 0.00 0.00 56.01 50.84 1npj n LEU 227 Cb 0.60 -0.74 -0.09 0.00 -2.33 0.00 0.00 43.42 40.85 1npj n LEU 227 CO 0.36 2.04 -0.21 0.42 -1.33 0.00 0.00 177.39 178.67 1npj s THR 228 N -5.27 0.26 0.00 -5.08 -4.23 -0.91 -1.50 115.64 98.91 1npj s THR 228 Ca 0.49 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 1npj s THR 228 Cb 0.41 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.72 1npj s THR 228 CO -0.28 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.41 1npj n GLY 229 N -0.50 3.19 0.00 3.99 0.00 -1.26 -1.46 105.19 109.15 1npj n GLY 229 Ca 0.02 -0.21 0.08 0.00 0.00 0.00 0.00 46.02 45.91 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 4.50 0.00 -0.80 1.61 5.68 -1.26 -1.80 116.55 124.48 1npj n ASP 230 Ca 0.00 0.12 0.07 0.00 -0.50 0.00 0.00 54.79 54.48 1npj n ASP 230 Cb 0.00 -0.32 0.21 0.00 -1.14 0.00 0.00 41.12 39.87 1npj n ASP 230 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1npj n LYS 231 N -1.32 2.96 -2.15 0.11 5.02 -0.53 -5.00 118.16 117.24 1npj n LYS 231 Ca 0.07 -2.43 -0.37 0.00 -2.02 0.00 0.00 58.31 53.57 1npj n LYS 231 Cb 0.15 -1.55 0.01 0.00 -0.02 0.00 0.00 35.03 33.62 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 -1.81 2.84 0.76 7.82 0.00 -0.74 -3.84 121.76 126.78 1npj s ALA 232 Ca 0.33 0.99 -0.11 0.00 0.00 0.00 0.00 51.96 53.17 1npj s ALA 232 Cb 0.22 -3.42 0.05 0.00 0.00 0.00 0.00 23.12 19.97 1npj s ALA 232 CO 0.13 -0.86 1.08 -1.64 0.00 0.00 0.00 175.76 174.47 1npj s MET 233 N -2.92 2.42 0.08 0.00 -1.94 -0.46 -4.84 119.30 111.64 1npj s MET 233 Ca 0.68 0.84 0.03 0.00 -1.71 0.00 0.00 55.69 55.53 1npj s MET 233 Cb -0.30 -1.94 -0.03 0.00 2.01 0.00 0.00 34.83 34.57 1npj s MET 233 CO 0.35 -1.44 -0.09 0.95 -0.01 0.00 0.00 175.02 174.78 1npj s THR 234 N -3.07 0.79 0.16 2.05 -4.23 -1.26 -0.86 115.64 109.22 1npj s THR 234 Ca 0.60 -1.51 -0.06 0.00 -1.18 0.00 0.00 61.69 59.54 1npj s THR 234 Cb -0.15 -1.18 0.02 0.00 1.34 0.00 0.00 72.50 72.53 1npj s THR 234 CO 0.55 -0.54 0.32 0.00 -0.54 0.00 0.00 174.62 174.41 1npj n ALA 235 N 0.76 -0.72 -2.45 3.99 0.00 -0.79 -4.93 120.51 116.37 1npj n ALA 235 Ca -0.18 -0.51 -0.08 0.00 0.00 0.00 0.00 53.44 52.67 1npj n ALA 235 Cb 0.57 0.41 -0.08 0.00 0.00 0.00 0.00 19.45 20.35 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 -1.44 -0.02 0.23 0.00 0.00 -1.26 -2.18 121.76 117.08 1npj s ALA 236 Ca 0.06 -0.76 -0.32 0.00 0.00 0.00 0.00 51.96 50.95 1npj s ALA 236 Cb -0.02 0.41 -0.13 0.00 0.00 0.00 0.00 23.12 23.38 1npj s ALA 236 CO 0.05 -0.46 1.58 0.28 0.00 0.00 0.00 175.76 177.21 1npj n VAL 237 N 0.06 0.50 0.00 0.00 0.31 -0.35 -1.18 118.33 117.67 1npj n VAL 237 Ca -0.15 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1npj n VAL 237 Cb 0.62 -1.74 0.00 0.00 -0.91 0.00 0.00 33.84 31.81 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 2.91 2.04 3.74 2.92 0.00 0.15 -4.98 105.19 111.97 1npj n GLY 238 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1npj n GLY 238 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1npj s GLU 239 N -0.53 4.71 -0.25 1.61 2.12 -0.32 -4.76 118.70 121.28 1npj s GLU 239 Ca 0.00 1.56 -0.13 0.00 0.36 0.00 0.00 54.97 56.76 1npj s GLU 239 Cb 0.00 -3.31 -0.04 0.00 0.26 0.00 0.00 34.13 31.04 1npj s GLU 239 CO 0.00 0.27 0.29 0.15 -0.54 0.00 0.00 175.26 175.43 1npj s LYS 240 N -0.57 4.04 -0.03 4.30 1.02 -1.26 -1.88 119.74 125.36 1npj s LYS 240 Ca 0.46 -0.08 0.06 0.00 0.02 0.00 0.00 55.97 56.43 1npj s LYS 240 Cb -0.26 -3.61 -0.01 0.00 -0.52 0.00 0.00 37.83 33.43 1npj s LYS 240 CO 0.33 -0.13 -0.21 0.08 -0.92 0.00 0.00 175.35 174.49 1npj s VAL 241 N 1.62 1.73 -0.18 3.17 1.01 -0.15 0.47 120.40 128.08 1npj s VAL 241 Ca 0.12 -0.91 -0.05 0.00 0.00 0.00 0.00 61.98 61.15 1npj s VAL 241 Cb -0.15 -1.46 -0.03 0.00 0.00 0.00 0.00 36.38 34.75 1npj s VAL 241 CO 0.09 0.49 -0.01 -0.22 0.00 0.00 0.00 175.10 175.44 1npj s LEU 242 N -0.28 3.30 -0.34 3.92 2.96 -0.73 -1.26 118.68 126.25 1npj s LEU 242 Ca 0.02 -0.15 -0.04 0.00 -0.22 0.00 0.00 54.13 53.74 1npj s LEU 242 Cb -0.11 -1.82 0.06 0.00 0.50 0.00 0.00 46.19 44.82 1npj s LEU 242 CO 0.01 0.11 0.09 -0.63 -1.32 0.00 0.00 176.35 174.61 1npj s ILE 243 N 0.70 3.38 -0.06 6.68 -1.09 0.33 -1.40 121.20 129.73 1npj s ILE 243 Ca -0.01 -1.43 -0.20 0.00 -2.23 0.00 0.00 60.65 56.78 1npj s ILE 243 Cb -0.14 -3.01 -0.04 0.00 -1.58 0.00 0.00 42.46 37.68 1npj s ILE 243 CO 0.02 -0.26 0.57 -0.69 -1.23 0.00 0.00 174.94 173.35 1npj s VAL 244 N 1.29 5.06 -0.06 2.92 1.01 -0.24 -1.66 120.40 128.73 1npj s VAL 244 Ca -0.01 1.17 0.03 0.00 0.00 0.00 0.00 61.98 63.17 1npj s VAL 244 Cb -0.20 -3.91 0.01 0.00 0.00 0.00 0.00 36.38 32.27 1npj s VAL 244 CO -0.00 0.34 -0.13 -2.28 0.00 0.00 0.00 175.10 173.03 1npj s HIS 245 N 0.36 1.43 0.13 5.22 2.46 -0.17 0.23 115.29 124.95 1npj s HIS 245 Ca 0.31 -0.49 0.05 0.00 0.47 0.00 0.00 55.06 55.40 1npj s HIS 245 Cb -0.17 -1.03 -0.04 0.00 -0.13 0.00 0.00 32.58 31.21 1npj s HIS 245 CO 0.15 -0.23 -0.12 -1.54 -2.47 0.00 0.00 174.74 170.53 1npj s SER 246 N 0.49 1.81 -0.27 9.88 1.04 -0.79 -0.39 113.70 125.46 1npj s SER 246 Ca -0.11 -0.89 -0.00 0.00 0.48 0.00 0.00 55.95 55.43 1npj s SER 246 Cb -0.14 -0.03 0.16 0.00 0.10 0.00 0.00 66.02 66.11 1npj s SER 246 CO 0.03 -0.24 0.46 -1.58 0.98 0.00 0.00 173.24 172.89 1npj s GLN 247 N -3.09 0.44 0.08 4.02 -0.44 -0.91 -1.24 119.66 118.51 1npj s GLN 247 Ca 0.11 0.55 0.27 0.00 -2.50 0.00 0.00 55.36 53.79 1npj s GLN 247 Cb -0.02 -0.11 1.04 0.00 -1.64 0.00 0.00 33.01 32.28 1npj s GLN 247 CO 0.02 -0.77 1.83 0.00 0.50 0.00 0.00 175.29 176.86 1npj n ALA 248 N 5.38 2.23 0.00 1.58 0.00 -1.26 -0.01 120.51 128.43 1npj n ALA 248 Ca -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1npj n ALA 248 Cb 0.51 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1npj n ALA 248 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1npj n ASN 249 N -1.78 2.05 -3.90 0.00 5.15 -1.26 -3.00 115.26 112.51 1npj n ASN 249 Ca 0.06 0.00 -0.11 0.00 -0.60 0.00 0.00 54.58 53.93 1npj n ASN 249 Cb 0.35 0.34 -0.11 0.00 -0.53 0.00 0.00 39.78 39.84 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 -1.01 0.38 0.80 1.20 3.52 -1.26 -4.65 118.95 117.92 1npj s ARG 250 Ca 0.00 -0.37 -0.14 0.00 -0.13 0.00 0.00 55.73 55.09 1npj s ARG 250 Cb 0.00 0.15 0.07 0.00 -1.56 0.00 0.00 34.95 33.61 1npj s ARG 250 CO 0.00 -0.08 1.14 -0.25 -0.81 0.00 0.00 175.30 175.30 1npj n ASP 251 N 1.74 0.88 -3.78 -2.12 10.43 -1.26 -3.66 116.55 118.77 1npj n ASP 251 Ca -0.21 0.60 -0.10 0.00 2.57 0.00 0.00 54.79 57.65 1npj n ASP 251 Cb 0.56 -1.48 -0.07 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 -2.06 0.12 -0.44 -3.53 -1.32 -0.30 -4.83 115.64 103.27 1npj s THR 252 Ca 0.73 -0.95 0.03 0.00 -1.21 0.00 0.00 61.69 60.29 1npj s THR 252 Cb -0.30 -1.23 0.16 0.00 -1.51 0.00 0.00 72.50 69.62 1npj s THR 252 CO 0.51 -0.53 0.32 0.00 -2.21 0.00 0.00 174.62 172.71 1npj s ARG 253 N -3.65 1.05 0.47 7.08 1.70 -1.26 -1.17 118.95 123.17 1npj s ARG 253 Ca 0.03 -2.08 -0.25 0.00 -0.47 0.00 0.00 55.73 52.96 1npj s ARG 253 Cb 0.03 -1.72 -0.08 0.00 -0.57 0.00 0.00 34.95 32.61 1npj s ARG 253 CO -0.10 -1.32 1.43 -2.14 -1.08 0.00 0.00 175.30 172.09 1npj s PRO 254 N 0.12 3.56 -0.12 3.89 0.02 -1.12 0.04 135.00 141.40 1npj s PRO 254 Ca 0.27 2.41 -0.07 0.00 0.02 0.00 0.00 61.00 63.63 1npj s PRO 254 Cb -0.06 -2.57 0.04 0.00 0.02 0.00 0.00 34.50 31.93 1npj s PRO 254 CO -0.13 -0.92 0.28 -1.58 -0.33 0.00 0.00 177.00 174.33 1npj s HIS 255 N -1.21 -0.37 -0.44 6.54 2.46 0.48 -1.79 115.29 120.95 1npj s HIS 255 Ca 0.63 0.86 -0.15 0.00 0.47 0.00 0.00 55.06 56.87 1npj s HIS 255 Cb -0.44 0.10 0.05 0.00 -0.13 0.00 0.00 32.58 32.16 1npj s HIS 255 CO 0.55 -0.22 0.36 -1.17 -2.47 0.00 0.00 174.74 171.79 1npj s LEU 256 N 0.93 5.35 -0.33 8.88 2.96 -1.26 -1.21 118.68 134.00 1npj s LEU 256 Ca -0.06 -1.10 -0.29 0.00 -0.22 0.00 0.00 54.13 52.46 1npj s LEU 256 Cb -0.07 -2.19 -0.01 0.00 0.50 0.00 0.00 46.19 44.42 1npj s LEU 256 CO -0.06 -0.56 1.68 -0.63 -1.32 0.00 0.00 176.35 175.46 1npj s ILE 257 N 1.70 3.60 0.00 6.68 1.01 0.36 -1.31 121.20 133.24 1npj s ILE 257 Ca 0.05 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.33 1npj s ILE 257 Cb -0.22 -3.77 0.00 0.00 0.01 0.00 0.00 42.46 38.48 1npj s ILE 257 CO 0.09 -0.46 0.00 0.61 0.00 0.00 0.00 174.94 175.17 1npj n GLY 258 N 5.22 1.11 0.00 6.18 0.00 -1.26 -3.73 105.19 112.70 1npj n GLY 258 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.23 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 -1.12 5.55 2.62 -0.02 0.00 -0.43 -5.00 105.19 106.79 1npj n GLY 259 Ca 0.00 -1.50 -0.09 0.00 0.00 0.00 0.00 46.02 44.43 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 -1.55 -3.76 1.61 -0.00 -1.26 -4.73 115.22 105.53 1npj n HIS 260 Ca 0.00 -1.58 -0.37 0.00 -0.00 0.00 0.00 57.72 55.77 1npj n HIS 260 Cb 0.00 0.53 -0.11 0.00 -0.00 0.00 0.00 29.99 30.41 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 -2.57 1.98 0.24 -1.41 0.00 -0.30 -4.76 107.32 100.50 1npj s GLY 261 Ca 0.17 -2.49 -0.07 0.00 0.00 0.00 0.00 44.72 42.33 1npj s GLY 261 CO 0.13 1.02 1.92 -0.55 0.00 0.00 0.00 173.10 175.61 1npj h ASP 262 N 8.09 1.08 -3.46 1.64 3.32 -1.50 -0.01 116.42 125.59 1npj h ASP 262 Ca -0.14 -0.03 -0.33 0.00 0.02 0.00 0.00 57.03 56.55 1npj h ASP 262 Cb 1.05 -0.27 -0.35 0.00 0.22 0.00 0.00 39.33 39.98 1npj h ASP 262 CO 0.71 0.78 -0.74 -0.31 -1.72 0.00 0.00 179.24 177.96 1npj s TYR 263 N -6.12 0.14 -0.13 4.55 1.51 -0.91 -2.11 117.35 114.29 1npj s TYR 263 Ca -0.13 0.11 -0.01 0.00 -1.01 0.00 0.00 57.07 56.03 1npj s TYR 263 Cb 0.17 -0.36 0.04 0.00 -0.11 0.00 0.00 41.96 41.70 1npj s TYR 263 CO 0.81 -0.13 -0.03 0.08 -1.11 0.00 0.00 175.55 175.16 1npj s VAL 264 N 1.33 0.83 -1.20 0.71 1.01 -0.06 -0.10 120.40 122.92 1npj s VAL 264 Ca -0.06 -0.34 -0.15 0.00 0.00 0.00 0.00 61.98 61.43 1npj s VAL 264 Cb -0.13 -1.00 0.15 0.00 0.00 0.00 0.00 36.38 35.40 1npj s VAL 264 CO -0.03 0.18 1.46 0.26 0.00 0.00 0.00 175.10 176.98 1npj s TRP 265 N 1.77 3.33 0.29 5.22 0.51 0.27 -0.95 118.94 129.38 1npj s TRP 265 Ca 0.03 -1.97 0.02 0.00 -2.12 0.00 0.00 56.10 52.06 1npj s TRP 265 Cb -0.14 -4.40 0.60 0.00 -0.81 0.00 0.00 33.47 28.72 1npj s TRP 265 CO -0.07 -1.48 1.82 0.00 -0.51 0.00 0.00 176.95 176.70 1npj h ALA 266 N 7.39 1.55 -0.00 0.98 0.00 -1.89 0.23 119.26 127.53 1npj h ALA 266 Ca 0.33 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1npj h ALA 266 Cb 0.89 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1npj h ALA 266 CO 1.27 0.16 -0.01 0.25 0.00 0.00 0.00 179.25 180.92 1npj n THR 267 N -4.66 0.00 -0.96 0.00 -2.24 -1.26 -4.48 114.28 100.69 1npj n THR 267 Ca 0.20 -0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 1npj n THR 267 Cb 0.41 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.16 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 1.39 0.91 3.51 3.38 0.00 0.80 -4.74 105.19 110.44 1npj n GLY 268 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.09 3.69 0.51 1.61 -0.14 -1.26 0.05 119.74 124.11 1npj s LYS 269 Ca 0.00 -0.48 0.34 0.00 -1.36 0.00 0.00 55.97 54.47 1npj s LYS 269 Cb 0.00 -3.57 1.65 0.00 -1.68 0.00 0.00 37.83 34.23 1npj s LYS 269 CO 0.00 -0.26 2.03 0.74 -0.76 0.00 0.00 175.35 177.09 1npj h PHE 270 N 8.34 0.00 -0.00 3.18 0.05 -1.76 -1.92 116.94 124.84 1npj h PHE 270 Ca -0.35 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.44 1npj h PHE 270 Cb 1.17 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.12 1npj h PHE 270 CO 0.70 0.00 -0.18 0.09 -0.18 0.00 0.00 178.31 178.74 1npj n ASN 271 N -2.82 0.52 -4.51 2.17 3.02 -1.26 -4.62 115.26 107.76 1npj n ASN 271 Ca -0.01 -0.48 -0.42 0.00 -0.03 0.00 0.00 54.58 53.65 1npj n ASN 271 Cb 0.17 -0.04 -0.10 0.00 -0.61 0.00 0.00 39.78 39.21 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 -2.60 5.19 0.26 3.41 2.01 -0.72 -5.04 115.64 118.15 1npj s THR 272 Ca 0.24 -0.22 -0.27 0.00 0.31 0.00 0.00 61.69 61.75 1npj s THR 272 Cb 0.19 -3.87 -0.15 0.00 0.01 0.00 0.00 72.50 68.68 1npj s THR 272 CO 0.52 -0.19 0.73 -2.65 -0.69 0.00 0.00 174.62 172.34 1npj n PRO 273 N 5.34 0.64 -2.65 4.92 -0.02 -1.26 -4.86 135.00 137.11 1npj n PRO 273 Ca -0.10 0.22 -0.32 0.00 -2.02 0.00 0.00 63.50 61.28 1npj n PRO 273 Cb 0.49 -1.41 -0.05 0.00 -0.02 0.00 0.00 33.50 32.50 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 -1.29 4.07 0.74 0.52 0.04 -1.26 -4.93 135.00 132.90 1npj s PRO 274 Ca 0.61 1.00 -0.11 0.00 0.04 0.00 0.00 61.00 62.54 1npj s PRO 274 Cb -0.80 -2.18 0.04 0.00 0.04 0.00 0.00 34.50 31.60 1npj s PRO 274 CO 0.58 -0.13 1.08 -0.51 0.04 0.00 0.00 177.00 178.06 1npj s ASP 275 N -2.63 5.01 0.16 6.66 1.01 -0.13 -4.75 116.67 122.01 1npj s ASP 275 Ca 0.60 1.40 0.04 0.00 0.71 0.00 0.00 52.55 55.30 1npj s ASP 275 Cb -0.10 -2.21 -0.05 0.00 1.01 0.00 0.00 42.92 41.58 1npj s ASP 275 CO 0.22 -1.65 -0.08 0.68 0.21 0.00 0.00 175.17 174.55 1npj s VAL 276 N -3.14 1.11 -1.56 -1.27 -7.23 -1.26 -0.88 120.40 106.16 1npj s VAL 276 Ca 0.59 -2.05 -0.15 0.00 -1.81 0.00 0.00 61.98 58.56 1npj s VAL 276 Cb -0.14 -1.93 0.11 0.00 0.56 0.00 0.00 36.38 34.99 1npj s VAL 276 CO 0.54 -0.68 0.83 0.47 -0.31 0.00 0.00 175.10 175.95 1npj n ASP 277 N -0.22 -4.11 -4.75 4.85 10.43 -0.90 -4.92 116.55 116.93 1npj n ASP 277 Ca -0.09 -0.80 -0.40 0.00 2.57 0.00 0.00 54.79 56.06 1npj n ASP 277 Cb 0.61 -3.32 -0.04 0.00 1.84 0.00 0.00 41.12 40.21 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 -6.63 4.61 -0.20 -1.24 -1.52 -0.03 -4.83 119.66 109.82 1npj s GLN 278 Ca 0.65 1.81 -0.19 0.00 -1.95 0.00 0.00 55.36 55.68 1npj s GLN 278 Cb -0.34 -3.21 -0.19 0.00 -0.22 0.00 0.00 33.01 29.05 1npj s GLN 278 CO 0.81 0.15 0.18 -0.85 -0.25 0.00 0.00 175.29 175.33 1npj n GLU 279 N 1.50 0.59 -3.69 2.91 0.28 -1.26 -1.15 120.64 119.82 1npj n GLU 279 Ca 0.00 0.50 -0.17 0.00 -0.16 0.00 0.00 57.16 57.34 1npj n GLU 279 Cb 0.45 -1.72 -0.16 0.00 1.43 0.00 0.00 31.44 31.44 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 -2.40 -0.18 0.53 3.84 2.01 -1.26 -4.33 115.64 113.84 1npj s THR 280 Ca -0.29 0.33 0.09 0.00 0.31 0.00 0.00 61.69 62.12 1npj s THR 280 Cb 0.07 -0.24 0.06 0.00 0.01 0.00 0.00 72.50 72.39 1npj s THR 280 CO 0.61 0.14 0.66 -1.66 -0.69 0.00 0.00 174.62 173.67 1npj s TRP 281 N 1.98 1.81 -0.05 4.92 -2.14 -0.74 -4.96 118.94 119.76 1npj s TRP 281 Ca 0.00 -0.67 0.01 0.00 2.66 0.00 0.00 56.10 58.11 1npj s TRP 281 Cb -0.12 -2.19 0.02 0.00 -3.10 0.00 0.00 33.47 28.08 1npj s TRP 281 CO -0.05 -0.83 -0.06 0.12 -2.66 0.00 0.00 176.95 173.48 1npj s PHE 282 N -2.61 0.84 -0.19 1.66 5.36 -1.26 -2.77 117.98 119.01 1npj s PHE 282 Ca 0.55 -0.25 0.01 0.00 -0.96 0.00 0.00 56.93 56.28 1npj s PHE 282 Cb -0.06 -0.71 0.04 0.00 -0.34 0.00 0.00 43.02 41.95 1npj s PHE 282 CO 0.34 -0.20 -0.10 0.42 -1.46 0.00 0.00 175.22 174.23 1npj s ILE 283 N 0.85 1.56 0.55 3.12 1.01 -0.32 -4.70 121.20 123.27 1npj s ILE 283 Ca -0.12 -0.94 -0.17 0.00 0.00 0.00 0.00 60.65 59.42 1npj s ILE 283 Cb -0.15 -1.65 -0.06 0.00 0.01 0.00 0.00 42.46 40.62 1npj s ILE 283 CO 0.01 0.18 1.05 -2.16 0.00 0.00 0.00 174.94 174.01 1npj s PRO 284 N 1.43 3.53 0.28 2.79 0.04 -1.26 -1.15 135.00 140.66 1npj s PRO 284 Ca -0.01 1.25 -0.29 0.00 0.04 0.00 0.00 61.00 61.99 1npj s PRO 284 Cb -0.16 -2.06 -0.14 0.00 0.04 0.00 0.00 34.50 32.18 1npj s PRO 284 CO -0.08 -0.64 1.20 0.41 0.04 0.00 0.00 177.00 177.93 1npj n GLY 285 N -0.75 0.26 1.06 0.56 0.00 -1.24 -2.31 105.19 102.77 1npj n GLY 285 Ca 0.09 0.39 0.00 0.00 0.00 0.00 0.00 46.02 46.50 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 1.42 0.68 3.33 -0.02 0.00 0.98 -4.78 105.19 106.81 1npj n GLY 286 Ca 0.09 -0.52 -0.09 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.06 0.14 4.61 0.00 -0.98 -4.79 121.76 118.68 1npj s ALA 287 Ca 0.00 -0.83 0.10 0.00 0.00 0.00 0.00 51.96 51.23 1npj s ALA 287 Cb 0.00 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.91 1npj s ALA 287 CO 0.00 -0.64 -0.25 0.00 0.00 0.00 0.00 175.76 174.87 1npj s ALA 288 N -3.95 2.27 0.28 0.00 0.00 -1.26 -2.15 121.76 116.94 1npj s ALA 288 Ca 0.16 -1.45 0.03 0.00 0.00 0.00 0.00 51.96 50.69 1npj s ALA 288 Cb 0.03 -0.34 -0.04 0.00 0.00 0.00 0.00 23.12 22.78 1npj s ALA 288 CO -0.01 0.47 0.16 0.20 0.00 0.00 0.00 175.76 176.58 1npj s GLY 289 N -2.15 1.91 -0.11 0.00 0.00 0.48 -3.29 107.32 104.16 1npj s GLY 289 Ca 0.14 -1.80 -0.12 0.00 0.00 0.00 0.00 44.72 42.94 1npj s GLY 289 CO 0.06 -1.53 0.33 0.00 0.00 0.00 0.00 173.10 171.97 1npj s ALA 290 N -3.74 -0.82 -0.02 3.20 0.00 -1.07 -1.00 121.76 118.31 1npj s ALA 290 Ca 0.37 0.83 0.05 0.00 0.00 0.00 0.00 51.96 53.22 1npj s ALA 290 Cb 0.05 -0.44 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 1npj s ALA 290 CO 0.17 -0.18 -0.18 0.00 0.00 0.00 0.00 175.76 175.58 1npj s ALA 291 N -0.09 1.50 -0.16 0.00 0.00 -0.66 -0.56 121.76 121.79 1npj s ALA 291 Ca -0.02 -0.76 -0.01 0.00 0.00 0.00 0.00 51.96 51.17 1npj s ALA 291 Cb -0.03 -0.41 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 1npj s ALA 291 CO 0.01 0.35 -0.11 0.12 0.00 0.00 0.00 175.76 176.13 1npj s PHE 292 N -0.32 2.86 0.00 0.00 2.19 0.86 -0.51 117.98 123.06 1npj s PHE 292 Ca 0.05 -0.81 0.00 0.00 0.33 0.00 0.00 56.93 56.49 1npj s PHE 292 Cb -0.08 -1.93 -0.00 0.00 -1.31 0.00 0.00 43.02 39.70 1npj s PHE 292 CO -0.00 -0.36 -0.01 -0.47 1.83 0.00 0.00 175.22 176.21 1npj s TYR 293 N 0.77 0.07 -0.33 10.12 5.04 -0.39 -1.30 117.35 131.34 1npj s TYR 293 Ca -0.04 -0.04 -0.09 0.00 -2.44 0.00 0.00 57.07 54.46 1npj s TYR 293 Cb -0.15 -0.05 0.01 0.00 0.35 0.00 0.00 41.96 42.12 1npj s TYR 293 CO 0.01 -0.01 0.14 0.99 -1.34 0.00 0.00 175.55 175.35 1npj s THR 294 N -0.08 4.35 0.39 4.34 2.01 -1.26 -0.98 115.64 124.41 1npj s THR 294 Ca -0.00 -0.68 -0.27 0.00 0.31 0.00 0.00 61.69 61.04 1npj s THR 294 Cb -0.01 -3.31 -0.09 0.00 0.01 0.00 0.00 72.50 69.10 1npj s THR 294 CO -0.00 -0.04 1.33 -0.36 -0.69 0.00 0.00 174.62 174.86 1npj s PHE 295 N 1.55 2.84 0.00 4.92 0.40 -0.79 -4.86 117.98 122.03 1npj s PHE 295 Ca 0.03 1.38 0.00 0.00 -0.60 0.00 0.00 56.93 57.74 1npj s PHE 295 Cb -0.18 -3.72 0.00 0.00 0.51 0.00 0.00 43.02 39.63 1npj s PHE 295 CO 0.05 -2.16 0.00 1.04 0.70 0.00 0.00 175.22 174.85 1npj n GLN 296 N 0.31 4.14 -4.33 0.44 6.02 -1.26 0.30 117.38 122.98 1npj n GLN 296 Ca 0.03 0.00 -0.18 0.00 -0.01 0.00 0.00 57.00 56.83 1npj n GLN 296 Cb 0.43 -0.46 -0.14 0.00 1.02 0.00 0.00 30.24 31.09 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 -0.85 0.77 0.75 -1.09 -1.52 -1.26 -4.62 119.66 111.84 1npj s GLN 297 Ca 0.00 -0.50 -0.08 0.00 -1.95 0.00 0.00 55.36 52.83 1npj s GLN 297 Cb 0.00 -0.73 0.09 0.00 -0.22 0.00 0.00 33.01 32.15 1npj s GLN 297 CO 0.00 0.19 1.07 -1.25 -0.25 0.00 0.00 175.29 175.05 1npj s PRO 298 N -0.63 1.88 0.00 2.91 0.04 -1.26 -4.78 135.00 133.16 1npj s PRO 298 Ca 0.01 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 60.69 1npj s PRO 298 Cb -0.05 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1npj s PRO 298 CO 0.00 -1.47 0.00 0.41 0.04 0.00 0.00 177.00 175.99 1npj n GLY 299 N -3.06 -0.19 3.74 0.56 0.00 0.12 -4.92 105.19 101.44 1npj n GLY 299 Ca 0.10 -2.26 -0.37 0.00 0.00 0.00 0.00 46.02 43.48 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 -0.13 5.20 0.16 -0.61 1.10 -1.26 -0.60 121.20 125.05 1npj s ILE 300 Ca 0.00 0.83 0.11 0.00 -0.51 0.00 0.00 60.65 61.08 1npj s ILE 300 Cb 0.00 -3.76 -0.04 0.00 0.15 0.00 0.00 42.46 38.81 1npj s ILE 300 CO 0.00 0.38 -0.25 -0.31 -2.11 0.00 0.00 174.94 172.65 1npj s TYR 301 N 0.36 2.26 0.06 3.50 1.51 0.05 -4.96 117.35 120.12 1npj s TYR 301 Ca 0.23 -0.38 0.05 0.00 -1.01 0.00 0.00 57.07 55.97 1npj s TYR 301 Cb -0.15 -1.17 -0.04 0.00 -0.11 0.00 0.00 41.96 40.50 1npj s TYR 301 CO 0.09 0.41 -0.07 0.00 -1.11 0.00 0.00 175.55 174.87 1npj s ALA 302 N -1.41 3.02 -0.17 3.71 0.00 -1.24 -0.47 121.76 125.20 1npj s ALA 302 Ca 0.17 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1npj s ALA 302 Cb -0.09 -1.03 0.03 0.00 0.00 0.00 0.00 23.12 22.04 1npj s ALA 302 CO 0.08 0.64 -0.11 -0.47 0.00 0.00 0.00 175.76 175.90 1npj s TYR 303 N -1.14 2.14 0.21 0.00 5.04 0.14 -0.49 117.35 123.25 1npj s TYR 303 Ca 0.20 -1.30 0.01 0.00 -2.44 0.00 0.00 57.07 53.54 1npj s TYR 303 Cb -0.11 -1.54 -0.05 0.00 0.35 0.00 0.00 41.96 40.61 1npj s TYR 303 CO 0.12 -0.68 0.06 0.14 -1.34 0.00 0.00 175.55 173.86 1npj s VAL 304 N 1.49 0.50 -0.26 3.14 -7.23 -0.35 -0.19 120.40 117.51 1npj s VAL 304 Ca 0.02 -1.99 -0.22 0.00 -1.81 0.00 0.00 61.98 57.98 1npj s VAL 304 Cb -0.14 -2.40 -0.01 0.00 0.56 0.00 0.00 36.38 34.38 1npj s VAL 304 CO -0.09 -0.20 0.72 0.21 -0.31 0.00 0.00 175.10 175.43 1npj s ASN 305 N -3.23 6.68 0.00 4.85 3.84 -1.09 -0.39 114.94 125.60 1npj s ASN 305 Ca 0.32 0.81 0.00 0.00 0.21 0.00 0.00 52.86 54.21 1npj s ASN 305 Cb 0.07 -2.38 0.00 0.00 -0.55 0.00 0.00 41.25 38.39 1npj s ASN 305 CO 0.09 -0.45 0.62 1.57 -2.79 0.00 0.00 177.10 176.15 1npj n HIS 306 N 5.87 0.00 -3.24 0.43 -0.00 0.11 -3.85 115.22 114.53 1npj n HIS 306 Ca 0.02 -0.20 -0.44 0.00 -0.00 0.00 0.00 57.72 57.10 1npj n HIS 306 Cb 0.48 -0.15 -0.07 0.00 -0.00 0.00 0.00 29.99 30.25 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 0.39 6.21 0.61 0.26 3.84 -1.26 -4.92 114.94 120.07 1npj s ASN 307 Ca 0.00 -0.92 0.35 0.00 0.21 0.00 0.00 52.86 52.50 1npj s ASN 307 Cb 0.00 -2.25 1.99 0.00 -0.55 0.00 0.00 41.25 40.43 1npj s ASN 307 CO 0.00 -0.76 2.27 -0.07 -2.79 0.00 0.00 177.10 175.75 1npj h LEU 308 N 9.36 0.00 -0.17 3.21 3.38 -1.99 -0.90 115.31 128.19 1npj h LEU 308 Ca -0.27 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.64 1npj h LEU 308 Cb 1.10 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.85 1npj h LEU 308 CO 0.90 0.01 -0.10 0.40 0.09 0.00 0.00 178.44 179.75 1npj h ILE 309 N 0.00 1.32 -0.76 1.22 5.03 -1.91 0.21 117.51 122.61 1npj h ILE 309 Ca -0.00 -1.17 -0.03 0.00 -0.12 0.00 0.00 64.86 63.54 1npj h ILE 309 Cb 0.06 1.71 -0.03 0.00 -3.03 0.00 0.00 36.82 35.53 1npj h ILE 309 CO 0.00 0.35 0.34 -0.33 -0.68 0.00 0.00 178.15 177.83 1npj h GLU 310 N 0.05 1.10 0.07 2.37 5.08 -1.52 0.18 114.58 121.91 1npj h GLU 310 Ca 0.04 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1npj h GLU 310 Cb 0.59 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1npj h GLU 310 CO 0.03 0.87 -0.03 0.00 -1.00 0.00 0.00 179.01 178.87 1npj h ALA 311 N 1.28 -0.09 0.00 3.43 0.00 -1.15 -1.49 119.26 121.24 1npj h ALA 311 Ca 0.26 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1npj h ALA 311 Cb 0.15 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1npj h ALA 311 CO -0.03 -0.37 -1.57 1.19 0.00 0.00 0.00 179.25 178.48 1npj n PHE 312 N -4.96 0.00 -0.11 0.00 3.01 0.05 -2.22 117.46 113.23 1npj n PHE 312 Ca -0.08 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.22 1npj n PHE 312 Cb 0.21 -0.29 -0.10 0.00 -0.01 0.00 0.00 39.48 39.29 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 -1.94 0.55 0.05 -1.08 -0.58 0.55 -4.68 120.64 113.52 1npj n GLU 313 Ca -0.01 0.13 0.12 0.00 -0.42 0.00 0.00 57.16 56.98 1npj n GLU 313 Cb 0.46 -1.44 0.09 0.00 -0.57 0.00 0.00 31.44 29.98 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 -3.17 0.68 0.00 -4.62 4.32 -0.70 -5.00 117.00 108.51 1npj n LEU 314 Ca -0.39 0.15 0.00 0.00 -0.02 0.00 0.00 56.01 55.75 1npj n LEU 314 Cb 0.91 -0.14 0.00 0.00 -1.62 0.00 0.00 43.42 42.58 1npj n LEU 314 CO 0.22 -0.04 0.00 0.61 -1.22 0.00 0.00 177.39 176.96 1npj n GLY 315 N 1.33 0.90 2.73 -0.72 0.00 -0.81 -1.14 105.19 107.48 1npj n GLY 315 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.69 5.78 -3.52 4.61 0.00 0.10 -4.25 120.51 122.54 1npj n ALA 316 Ca 0.00 -4.08 -0.13 0.00 0.00 0.00 0.00 53.44 49.23 1npj n ALA 316 Cb 0.00 -3.17 -0.13 0.00 0.00 0.00 0.00 19.45 16.15 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 1.27 -0.47 0.29 0.00 0.00 -1.24 -2.68 121.76 118.94 1npj s ALA 317 Ca 0.46 0.78 0.05 0.00 0.00 0.00 0.00 51.96 53.26 1npj s ALA 317 Cb 0.13 -0.49 -0.06 0.00 0.00 0.00 0.00 23.12 22.70 1npj s ALA 317 CO -0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 175.76 175.54 1npj s ALA 318 N 0.87 2.29 0.16 0.00 0.00 0.74 -4.50 121.76 121.31 1npj s ALA 318 Ca -0.06 -1.93 0.08 0.00 0.00 0.00 0.00 51.96 50.05 1npj s ALA 318 Cb -0.08 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 1npj s ALA 318 CO -0.05 -0.16 -0.18 -1.01 0.00 0.00 0.00 175.76 174.36 1npj s HIS 319 N -3.13 1.76 -0.04 0.00 3.76 -0.56 0.23 115.29 117.30 1npj s HIS 319 Ca 0.31 -0.48 0.05 0.00 -0.15 0.00 0.00 55.06 54.79 1npj s HIS 319 Cb 0.05 -0.88 -0.01 0.00 1.11 0.00 0.00 32.58 32.85 1npj s HIS 319 CO 0.12 0.30 -0.19 -0.06 -0.85 0.00 0.00 174.74 174.06 1npj s PHE 320 N -2.04 1.87 -0.22 1.40 0.08 0.38 -1.35 117.98 118.10 1npj s PHE 320 Ca 0.14 -0.50 -0.06 0.00 0.12 0.00 0.00 56.93 56.64 1npj s PHE 320 Cb -0.06 -1.24 -0.02 0.00 -0.57 0.00 0.00 43.02 41.13 1npj s PHE 320 CO 0.06 -0.14 0.02 0.15 -0.10 0.00 0.00 175.22 175.20 1npj s LYS 321 N -0.13 3.57 -0.13 0.44 1.02 -0.04 -0.77 119.74 123.70 1npj s LYS 321 Ca -0.01 -0.53 0.03 0.00 0.02 0.00 0.00 55.97 55.48 1npj s LYS 321 Cb -0.11 -3.15 0.01 0.00 -0.52 0.00 0.00 37.83 34.06 1npj s LYS 321 CO 0.02 -0.11 -0.22 0.08 -0.92 0.00 0.00 175.35 174.19 1npj s VAL 322 N 1.34 2.04 0.45 3.17 1.01 0.23 -1.88 120.40 126.76 1npj s VAL 322 Ca 0.04 -0.97 -0.01 0.00 0.00 0.00 0.00 61.98 61.04 1npj s VAL 322 Cb -0.15 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.42 1npj s VAL 322 CO 0.01 0.55 0.69 0.42 0.00 0.00 0.00 175.10 176.77 1npj s THR 323 N 0.76 4.34 0.00 3.92 -4.23 -0.93 0.16 115.64 119.66 1npj s THR 323 Ca -0.09 -0.31 0.00 0.00 -1.18 0.00 0.00 61.69 60.11 1npj s THR 323 Cb -0.16 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.06 1npj s THR 323 CO -0.00 -0.48 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 1npj n GLY 324 N -2.11 1.42 3.78 3.99 0.00 -1.26 -1.21 105.19 109.80 1npj n GLY 324 Ca 0.00 -2.13 -0.39 0.00 0.00 0.00 0.00 46.02 43.50 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 -1.26 4.49 0.35 1.61 2.02 -1.26 -4.62 118.70 120.03 1npj s GLU 325 Ca 0.00 1.07 -0.27 0.00 0.02 0.00 0.00 54.97 55.79 1npj s GLU 325 Cb 0.00 -3.27 -0.09 0.00 0.10 0.00 0.00 34.13 30.87 1npj s GLU 325 CO 0.00 0.54 1.10 -0.46 0.02 0.00 0.00 175.26 176.46 1npj s TRP 326 N -0.97 3.35 -0.43 1.61 -0.11 -1.26 -4.38 118.94 116.76 1npj s TRP 326 Ca 0.35 1.65 -0.07 0.00 1.22 0.00 0.00 56.10 59.24 1npj s TRP 326 Cb -0.22 -3.25 0.10 0.00 -1.50 0.00 0.00 33.47 28.59 1npj s TRP 326 CO 0.24 -0.75 0.26 1.21 -4.62 0.00 0.00 176.95 173.29 1npj s ASN 327 N -1.18 5.52 0.24 5.86 3.84 -1.26 -4.95 114.94 123.01 1npj s ASN 327 Ca 0.52 -1.76 0.24 0.00 0.21 0.00 0.00 52.86 52.07 1npj s ASN 327 Cb -0.28 -1.94 0.93 0.00 -0.55 0.00 0.00 41.25 39.41 1npj s ASN 327 CO 0.36 -0.58 1.73 0.47 -2.79 0.00 0.00 177.10 176.29 1npj n ASP 328 N 4.81 0.68 -0.04 -4.21 9.92 -1.25 -2.30 116.55 124.16 1npj n ASP 328 Ca -0.07 0.64 -0.14 0.00 -0.53 0.00 0.00 54.79 54.68 1npj n ASP 328 Cb 0.42 -0.79 -0.09 0.00 -0.64 0.00 0.00 41.12 40.02 1npj n ASP 328 CO 0.00 0.00 0.00 -0.78 0.13 0.00 0.00 177.20 176.55 1npj h ASP 329 N 0.00 0.30 -0.35 -2.24 -0.00 -2.02 -3.27 116.42 108.85 1npj h ASP 329 Ca 0.00 -0.56 -0.11 0.00 -0.00 0.00 0.00 57.03 56.36 1npj h ASP 329 Cb 0.46 -0.09 -0.02 0.00 -0.00 0.00 0.00 39.33 39.69 1npj h ASP 329 CO 0.00 0.81 -0.15 -0.07 -0.00 0.00 0.00 179.24 179.83 1npj h LEU 330 N -0.19 0.82 -7.00 2.28 3.38 -1.93 -3.45 115.31 109.22 1npj h LEU 330 Ca 0.00 -0.27 -0.02 0.00 0.09 0.00 0.00 57.88 57.69 1npj h LEU 330 Cb 0.76 -0.22 -0.22 0.00 0.09 0.00 0.00 40.66 41.07 1npj h LEU 330 CO 0.04 0.97 0.18 -0.32 0.09 0.00 0.00 178.44 179.41 1npj s MET 331 N -4.73 0.77 -0.14 1.13 0.00 -0.97 -5.14 119.30 110.22 1npj s MET 331 Ca -0.10 0.94 -0.21 0.00 0.00 0.00 0.00 55.69 56.32 1npj s MET 331 Cb 0.13 0.36 0.05 0.00 0.00 0.00 0.00 34.83 35.38 1npj s MET 331 CO 0.83 -0.10 0.55 -0.08 0.00 0.00 0.00 175.02 176.22 1npj s THR 332 N 0.44 0.01 -0.74 10.11 -1.32 -1.26 -3.96 115.64 118.93 1npj s THR 332 Ca -0.00 -0.08 -0.22 0.00 -1.21 0.00 0.00 61.69 60.17 1npj s THR 332 Cb -0.05 -0.81 0.08 0.00 -1.51 0.00 0.00 72.50 70.21 1npj s THR 332 CO -0.02 -0.05 1.05 -0.55 -2.21 0.00 0.00 174.62 172.85 1npj s SER 333 N -0.35 6.27 0.22 8.08 0.15 -1.26 -4.86 113.70 121.94 1npj s SER 333 Ca -0.05 -1.16 -0.09 0.00 0.70 0.00 0.00 55.95 55.34 1npj s SER 333 Cb -0.03 -2.44 0.18 0.00 -1.71 0.00 0.00 66.02 62.02 1npj s SER 333 CO 0.04 -1.42 1.88 0.58 1.20 0.00 0.00 173.24 175.52 1npj h VAL 334 N 6.00 1.21 -3.17 4.45 2.07 -2.02 -3.39 116.25 121.41 1npj h VAL 334 Ca -0.18 -0.41 -0.44 0.00 0.82 0.00 0.00 66.70 66.50 1npj h VAL 334 Cb 1.06 0.04 -0.40 0.00 -1.52 0.00 0.00 31.29 30.47 1npj h VAL 334 CO 1.19 0.21 -0.75 -0.22 0.02 0.00 0.00 177.57 178.02 1npj s LEU 335 N -10.10 0.39 0.71 2.57 2.96 -1.26 -5.14 118.68 108.81 1npj s LEU 335 Ca -0.13 -0.38 -0.14 0.00 -0.22 0.00 0.00 54.13 53.26 1npj s LEU 335 Cb 0.16 -0.27 0.03 0.00 0.50 0.00 0.00 46.19 46.61 1npj s LEU 335 CO 0.79 -0.30 1.14 0.00 -1.32 0.00 0.00 176.35 176.66 1npj s ALA 336 N 2.10 2.27 -0.11 5.97 0.00 -1.26 -4.85 121.76 125.88 1npj s ALA 336 Ca 0.03 0.64 -0.39 0.00 0.00 0.00 0.00 51.96 52.23 1npj s ALA 336 Cb -0.15 -3.37 -0.17 0.00 0.00 0.00 0.00 23.12 19.43 1npj s ALA 336 CO -0.07 -1.61 1.47 -2.30 0.00 0.00 0.00 175.76 173.26 1npj n PRO 337 N -2.72 0.88 -3.43 0.00 -0.02 -1.26 -4.92 135.00 123.53 1npj n PRO 337 Ca 0.11 0.32 -0.12 0.00 -2.02 0.00 0.00 63.50 61.79 1npj n PRO 337 Cb 0.51 -1.94 -0.02 0.00 -0.02 0.00 0.00 33.50 32.03 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 1.76 -0.56 0.00 2.55 1.04 -1.26 -5.29 113.70 111.93 1npj s SER 338 Ca 0.92 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 57.35 1npj s SER 338 Cb -1.09 0.60 0.00 0.00 0.10 0.00 0.00 66.02 65.62 1npj s SER 338 CO 0.58 -0.97 0.32 0.61 0.98 0.00 0.00 173.24 174.76