#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k7j s GLN 3 N 0.00 3.47 -0.14 -1.46 -0.21 -0.36 -4.91 119.66 116.06 1k7j s GLN 3 Ca 0.00 0.87 -0.03 0.00 0.02 0.00 0.00 55.36 56.22 1k7j s GLN 3 Cb 0.00 -2.06 0.05 0.00 1.00 0.00 0.00 33.01 31.99 1k7j s GLN 3 CO 0.00 -0.67 0.04 0.12 -2.12 0.00 0.00 175.29 172.66 1k7j s PHE 4 N -3.00 0.67 -0.14 0.91 2.19 -1.26 -1.38 117.98 115.98 1k7j s PHE 4 Ca 0.57 -0.45 -0.04 0.00 0.33 0.00 0.00 56.93 57.34 1k7j s PHE 4 Cb -0.12 -0.85 -0.03 0.00 -1.31 0.00 0.00 43.02 40.71 1k7j s PHE 4 CO 0.49 -0.47 -0.01 -0.06 1.83 0.00 0.00 175.22 177.00 1k7j s PHE 5 N 1.97 3.11 -0.47 10.12 0.08 -0.63 -4.99 117.98 127.16 1k7j s PHE 5 Ca 0.02 -0.06 -0.17 0.00 0.12 0.00 0.00 56.93 56.84 1k7j s PHE 5 Cb -0.15 -1.92 0.06 0.00 -0.57 0.00 0.00 43.02 40.44 1k7j s PHE 5 CO -0.07 0.17 0.45 0.71 -0.10 0.00 0.00 175.22 176.38 1k7j s TYR 6 N -0.07 3.19 -0.12 0.36 2.02 -1.26 -0.08 117.35 121.38 1k7j s TYR 6 Ca 0.03 -0.74 0.00 0.00 -0.37 0.00 0.00 57.07 56.00 1k7j s TYR 6 Cb -0.13 -3.18 -0.01 0.00 -0.40 0.00 0.00 41.96 38.24 1k7j s TYR 6 CO 0.02 -0.83 -0.14 0.42 -1.57 0.00 0.00 175.55 173.45 1k7j s ILE 7 N 1.95 2.94 0.09 2.71 1.01 -0.88 -4.99 121.20 124.03 1k7j s ILE 7 Ca 0.08 -0.70 -0.31 0.00 0.00 0.00 0.00 60.65 59.71 1k7j s ILE 7 Cb -0.22 -2.22 -0.10 0.00 0.01 0.00 0.00 42.46 39.93 1k7j s ILE 7 CO 0.09 0.53 1.88 1.41 0.00 0.00 0.00 174.94 178.85 1k7j n HIS 8 N 3.48 2.57 0.21 3.97 8.25 -1.26 -4.50 115.22 127.94 1k7j n HIS 8 Ca -0.18 -0.20 0.07 0.00 -0.26 0.00 0.00 57.72 57.14 1k7j n HIS 8 Cb 0.53 -2.75 0.43 0.00 1.12 0.00 0.00 29.99 29.32 1k7j n HIS 8 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1k7j h PRO 9 N 9.15 0.00 0.05 -0.41 0.13 -1.90 -2.35 132.00 136.67 1k7j h PRO 9 Ca -0.48 0.00 -0.32 0.00 -0.87 0.00 0.00 66.00 64.34 1k7j h PRO 9 Cb 1.23 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.32 1k7j h PRO 9 CO 0.94 0.31 -1.81 -0.40 -0.23 0.00 0.00 178.00 176.82 1k7j n ASP 10 N -3.68 1.33 -3.31 1.44 5.68 -1.26 -4.17 116.55 112.58 1k7j n ASP 10 Ca -0.01 0.34 -0.25 0.00 -0.50 0.00 0.00 54.79 54.37 1k7j n ASP 10 Cb 0.42 -0.36 -0.09 0.00 -1.14 0.00 0.00 41.12 39.96 1k7j n ASP 10 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1k7j n ASN 11 N -3.20 -0.38 -4.70 -1.12 5.15 -1.23 -4.90 115.26 104.87 1k7j n ASN 11 Ca -0.22 -2.49 -0.44 0.00 -0.60 0.00 0.00 54.58 50.83 1k7j n ASN 11 Cb 1.05 -0.51 -0.03 0.00 -0.53 0.00 0.00 39.78 39.77 1k7j n ASN 11 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 1k7j n PRO 12 N 2.40 2.42 -2.06 1.20 -0.04 -0.88 -4.56 135.00 133.48 1k7j n PRO 12 Ca 0.27 0.87 -0.42 0.00 -0.04 0.00 0.00 63.50 64.17 1k7j n PRO 12 Cb 0.50 -2.64 -0.03 0.00 -0.04 0.00 0.00 33.50 31.29 1k7j n PRO 12 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1k7j s GLN 13 N 0.42 4.19 0.38 0.54 1.11 -1.26 -4.89 119.66 120.15 1k7j s GLN 13 Ca 0.72 2.13 0.08 0.00 0.01 0.00 0.00 55.36 58.30 1k7j s GLN 13 Cb -0.59 -3.93 0.81 0.00 -1.01 0.00 0.00 33.01 28.30 1k7j s GLN 13 CO 0.41 -0.82 1.97 0.37 0.01 0.00 0.00 175.29 177.23 1k7j h GLN 14 N 9.28 0.64 -0.67 2.91 5.75 -1.99 -2.04 115.11 128.98 1k7j h GLN 14 Ca -0.38 -0.04 0.03 0.00 -0.15 0.00 0.00 58.65 58.11 1k7j h GLN 14 Cb 1.17 -0.14 -0.04 0.00 1.07 0.00 0.00 27.48 29.53 1k7j h GLN 14 CO 0.95 0.42 0.43 -0.09 -2.65 0.00 0.00 178.83 177.89 1k7j h ARG 15 N 0.66 0.81 -0.01 1.69 2.43 -1.99 1.00 114.38 118.97 1k7j h ARG 15 Ca 0.29 -0.05 -0.21 0.00 -0.81 0.00 0.00 59.98 59.20 1k7j h ARG 15 Cb 0.29 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1k7j h ARG 15 CO -0.09 0.54 -0.88 -0.07 -1.51 0.00 0.00 179.97 177.95 1k7j h LEU 16 N 0.84 0.43 -0.38 3.80 3.38 -1.83 -1.97 115.31 119.58 1k7j h LEU 16 Ca 0.27 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1k7j h LEU 16 Cb -0.00 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1k7j h LEU 16 CO -0.10 1.12 0.17 0.40 0.09 0.00 0.00 178.44 180.13 1k7j h ILE 17 N 0.20 1.18 -0.58 1.22 1.08 -1.06 -0.60 117.51 118.95 1k7j h ILE 17 Ca -0.06 -0.53 -0.02 0.00 -0.39 0.00 0.00 64.86 63.87 1k7j h ILE 17 Cb 1.50 0.83 -0.03 0.00 -3.07 0.00 0.00 36.82 36.05 1k7j h ILE 17 CO 0.15 0.19 0.30 0.78 -0.69 0.00 0.00 178.15 178.88 1k7j h ASN 18 N 0.47 0.73 -0.68 1.72 2.35 -0.75 -0.81 115.58 118.61 1k7j h ASN 18 Ca 0.13 -0.11 -0.04 0.00 -0.55 0.00 0.00 56.30 55.73 1k7j h ASN 18 Cb 0.15 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.30 1k7j h ASN 18 CO -0.01 0.64 0.29 1.56 -1.65 0.00 0.00 177.43 178.26 1k7j h GLN 19 N 0.78 1.03 -0.46 0.81 4.20 -1.13 -0.71 115.11 119.62 1k7j h GLN 19 Ca 0.20 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.72 1k7j h GLN 19 Cb 0.08 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 1k7j h GLN 19 CO -0.03 0.82 0.17 0.00 -0.67 0.00 0.00 178.83 179.13 1k7j h ALA 20 N 1.31 0.60 -0.38 3.87 0.00 -0.61 -2.12 119.26 121.94 1k7j h ALA 20 Ca 0.24 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.93 1k7j h ALA 20 Cb 0.17 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1k7j h ALA 20 CO -0.02 0.23 -0.02 0.28 0.00 0.00 0.00 179.25 179.71 1k7j h VAL 21 N 0.61 1.22 -0.34 0.00 2.07 -0.71 -1.75 116.25 117.35 1k7j h VAL 21 Ca 0.15 -0.89 -0.08 0.00 0.82 0.00 0.00 66.70 66.70 1k7j h VAL 21 Cb 0.22 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1k7j h VAL 21 CO -0.01 0.31 -0.12 -0.08 0.02 0.00 0.00 177.57 177.68 1k7j h GLU 22 N 0.57 0.59 -0.56 1.57 4.57 -0.78 0.90 114.58 121.45 1k7j h GLU 22 Ca 0.12 -0.18 -0.06 0.00 -1.18 0.00 0.00 59.36 58.05 1k7j h GLU 22 Cb 0.39 -0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.90 1k7j h GLU 22 CO 0.02 0.71 0.10 0.82 -1.18 0.00 0.00 179.01 179.48 1k7j h ILE 23 N 0.55 1.25 -0.44 2.32 2.04 -0.76 -1.96 117.51 120.51 1k7j h ILE 23 Ca 0.10 -0.95 -0.03 0.00 1.00 0.00 0.00 64.86 64.98 1k7j h ILE 23 Cb 0.53 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 1k7j h ILE 23 CO 0.03 0.35 0.15 0.58 0.00 0.00 0.00 178.15 179.26 1k7j h VAL 24 N 0.82 1.22 0.00 1.67 2.07 -0.72 -0.89 116.25 120.42 1k7j h VAL 24 Ca 0.17 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.97 1k7j h VAL 24 Cb 0.39 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1k7j h VAL 24 CO 0.01 0.25 -0.09 0.03 0.02 0.00 0.00 177.57 177.79 1k7j h ARG 25 N 0.58 0.00 -0.10 1.57 3.08 -0.60 -1.02 114.38 117.88 1k7j h ARG 25 Ca 0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.19 1k7j h ARG 25 Cb 0.24 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.29 1k7j h ARG 25 CO -0.01 0.09 0.00 1.63 -1.07 0.00 0.00 179.97 180.61 1k7j n LYS 26 N -4.19 1.36 -0.35 0.04 5.02 -0.76 -4.88 118.16 114.41 1k7j n LYS 26 Ca -0.03 -0.54 0.00 0.00 -2.02 0.00 0.00 58.31 55.72 1k7j n LYS 26 Cb 0.17 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 33.89 1k7j n LYS 26 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k7j n GLY 27 N 0.91 0.79 3.89 0.72 0.00 -0.39 -5.08 105.19 106.04 1k7j n GLY 27 Ca 0.13 -0.28 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 1k7j n GLY 27 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1k7j s GLY 28 N -2.26 1.59 -0.18 -0.02 0.00 -0.37 -4.64 107.32 101.45 1k7j s GLY 28 Ca 0.00 -0.31 -0.05 0.00 0.00 0.00 0.00 44.72 44.36 1k7j s GLY 28 CO 0.00 -0.07 -0.00 0.14 0.00 0.00 0.00 173.10 173.17 1k7j s VAL 29 N -3.02 4.08 0.24 1.40 1.01 -1.26 -4.54 120.40 118.30 1k7j s VAL 29 Ca 0.52 -0.28 0.08 0.00 0.00 0.00 0.00 61.98 62.31 1k7j s VAL 29 Cb -0.11 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.40 1k7j s VAL 29 CO 0.50 0.46 -0.13 0.27 0.00 0.00 0.00 175.10 176.19 1k7j s ILE 30 N 0.65 1.86 -0.15 2.22 -4.36 -0.23 -0.67 121.20 120.52 1k7j s ILE 30 Ca -0.00 -2.23 -0.00 0.00 -0.26 0.00 0.00 60.65 58.16 1k7j s ILE 30 Cb -0.14 -2.20 -0.01 0.00 1.25 0.00 0.00 42.46 41.37 1k7j s ILE 30 CO 0.02 -0.48 -0.14 -0.69 0.24 0.00 0.00 174.94 173.89 1k7j s VAL 31 N -2.89 2.85 0.04 8.37 1.01 0.15 -0.50 120.40 129.43 1k7j s VAL 31 Ca 0.26 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1k7j s VAL 31 Cb -0.00 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 34.14 1k7j s VAL 31 CO 0.10 0.51 -0.04 -0.72 0.00 0.00 0.00 175.10 174.95 1k7j s TYR 32 N 0.68 0.47 0.35 5.22 1.13 -0.17 -0.82 117.35 124.22 1k7j s TYR 32 Ca -0.07 -0.75 -0.25 0.00 -1.41 0.00 0.00 57.07 54.59 1k7j s TYR 32 Cb -0.16 -0.32 -0.10 0.00 -1.10 0.00 0.00 41.96 40.28 1k7j s TYR 32 CO 0.02 -0.23 0.96 -1.25 -2.51 0.00 0.00 175.55 172.53 1k7j s PRO 33 N -2.57 4.46 0.37 -3.49 0.04 -1.26 -0.66 135.00 131.90 1k7j s PRO 33 Ca -0.04 1.31 0.04 0.00 0.04 0.00 0.00 61.00 62.35 1k7j s PRO 33 Cb -0.02 -2.65 -0.03 0.00 0.04 0.00 0.00 34.50 31.84 1k7j s PRO 33 CO -0.04 0.17 0.15 0.95 0.04 0.00 0.00 177.00 178.27 1k7j s THR 34 N -1.73 0.48 0.23 1.26 -4.23 -0.80 -4.02 115.64 106.83 1k7j s THR 34 Ca 0.53 -2.00 0.33 0.00 -1.18 0.00 0.00 61.69 59.38 1k7j s THR 34 Cb -0.17 -2.42 0.36 0.00 1.34 0.00 0.00 72.50 71.61 1k7j s THR 34 CO 0.22 0.00 2.03 -2.24 -0.54 0.00 0.00 174.62 174.09 1k7j h ASP 35 N 1.93 0.00 -2.20 3.99 2.03 -1.94 -3.29 116.42 116.95 1k7j h ASP 35 Ca -0.34 0.00 -0.59 0.00 -0.73 0.00 0.00 57.03 55.37 1k7j h ASP 35 Cb 1.26 0.00 -0.42 0.00 -0.83 0.00 0.00 39.33 39.34 1k7j h ASP 35 CO 0.53 0.05 -0.67 -1.20 -1.03 0.00 0.00 179.24 176.92 1k7j n SER 36 N -3.21 3.59 0.00 4.15 7.64 -1.26 -4.82 113.62 119.71 1k7j n SER 36 Ca -0.00 -3.44 0.00 0.00 1.01 0.00 0.00 58.87 56.43 1k7j n SER 36 Cb 0.28 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 62.85 1k7j n SER 36 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1k7j n GLY 37 N 0.53 -1.23 3.84 0.23 0.00 -1.24 -4.48 105.19 102.84 1k7j n GLY 37 Ca 0.29 -1.61 -0.32 0.00 0.00 0.00 0.00 46.02 44.39 1k7j n GLY 37 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k7j s TYR 38 N -1.65 3.37 0.08 1.61 2.02 -1.07 -1.90 117.35 119.80 1k7j s TYR 38 Ca 0.00 1.40 -0.02 0.00 -0.37 0.00 0.00 57.07 58.08 1k7j s TYR 38 Cb 0.00 -2.82 -0.04 0.00 -0.40 0.00 0.00 41.96 38.70 1k7j s TYR 38 CO 0.00 -0.81 0.01 0.00 -1.57 0.00 0.00 175.55 173.18 1k7j s ALA 39 N -2.91 0.55 -0.03 3.71 0.00 0.16 -0.98 121.76 122.26 1k7j s ALA 39 Ca 0.58 -1.24 -0.03 0.00 0.00 0.00 0.00 51.96 51.26 1k7j s ALA 39 Cb -0.12 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.41 1k7j s ALA 39 CO 0.46 -0.41 0.16 -0.51 0.00 0.00 0.00 175.76 175.46 1k7j s LEU 40 N -2.95 4.31 0.04 0.00 1.43 -0.04 -0.99 118.68 120.47 1k7j s LEU 40 Ca 0.12 0.35 -0.13 0.00 -1.03 0.00 0.00 54.13 53.44 1k7j s LEU 40 Cb 0.08 -2.44 0.02 0.00 0.03 0.00 0.00 46.19 43.87 1k7j s LEU 40 CO -0.07 0.30 0.28 -0.83 0.23 0.00 0.00 176.35 176.26 1k7j s GLY 41 N -1.70 -0.09 0.27 -3.19 0.00 0.35 -2.45 107.32 100.51 1k7j s GLY 41 Ca 0.24 -0.02 -0.20 0.00 0.00 0.00 0.00 44.72 44.73 1k7j s GLY 41 CO 0.15 -0.23 0.82 0.00 0.00 0.00 0.00 173.10 173.84 1k7j s LYS 43 N -3.15 3.99 0.57 0.00 -2.85 -1.26 -0.82 119.74 116.22 1k7j s LYS 43 Ca 0.14 1.30 0.35 0.00 -1.00 0.00 0.00 55.97 56.76 1k7j s LYS 43 Cb -0.04 -2.18 1.64 0.00 -2.06 0.00 0.00 37.83 35.18 1k7j s LYS 43 CO 0.07 -0.26 2.09 -0.84 0.10 0.00 0.00 175.35 176.51 1k7j h ILE 44 N 1.76 0.09 0.00 3.79 3.07 -1.92 -3.06 117.51 121.23 1k7j h ILE 44 Ca -0.49 -0.42 0.00 0.00 1.55 0.00 0.00 64.86 65.50 1k7j h ILE 44 Cb 1.21 1.38 0.00 0.00 -0.27 0.00 0.00 36.82 39.13 1k7j h ILE 44 CO 0.60 0.02 -0.18 -0.62 -1.05 0.00 0.00 178.15 176.92 1k7j n GLU 45 N -3.16 0.11 -3.39 0.16 4.71 -1.26 -4.80 120.64 113.01 1k7j n GLU 45 Ca -0.01 0.07 -0.43 0.00 -0.01 0.00 0.00 57.16 56.78 1k7j n GLU 45 Cb 0.24 -1.61 -0.09 0.00 -1.01 0.00 0.00 31.44 28.98 1k7j n GLU 45 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1k7j s ASP 46 N -3.58 6.15 0.21 1.62 -1.08 -1.16 -4.95 116.67 113.87 1k7j s ASP 46 Ca 0.11 -0.88 -0.04 0.00 -0.52 0.00 0.00 52.55 51.22 1k7j s ASP 46 Cb 0.16 -2.19 0.16 0.00 -1.46 0.00 0.00 42.92 39.60 1k7j s ASP 46 CO 0.61 -0.54 1.60 0.50 0.52 0.00 0.00 175.17 177.86 1k7j h LYS 47 N 8.69 0.74 -0.74 4.34 3.64 -1.89 -3.13 116.57 128.23 1k7j h LYS 47 Ca -0.27 -0.33 -0.05 0.00 -1.27 0.00 0.00 60.65 58.73 1k7j h LYS 47 Cb 1.11 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.88 1k7j h LYS 47 CO 0.78 0.94 0.28 -0.91 -2.27 0.00 0.00 179.45 178.28 1k7j h ASN 48 N 0.63 1.03 0.00 4.20 2.35 -1.96 -1.40 115.58 120.43 1k7j h ASN 48 Ca 0.08 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1k7j h ASN 48 Cb 0.81 -0.27 0.00 0.00 0.05 0.00 0.00 38.32 38.91 1k7j h ASN 48 CO 0.07 0.93 0.00 0.00 -1.65 0.00 0.00 177.43 176.78 1k7j n ALA 49 N -2.42 1.85 0.00 -0.83 0.00 -1.18 -1.82 120.51 116.11 1k7j n ALA 49 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1k7j n ALA 49 Cb 0.19 -1.02 0.00 0.00 0.00 0.00 0.00 19.45 18.62 1k7j n ALA 49 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1k7j n GLU 51 N 0.86 0.00 -0.30 0.00 4.07 -0.53 -1.52 120.64 123.23 1k7j n GLU 51 Ca 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.06 1k7j n GLU 51 Cb 0.17 0.00 0.07 0.00 -0.06 0.00 0.00 31.44 31.62 1k7j n GLU 51 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1k7j h ARG 52 N 0.00 1.12 -0.43 5.31 3.08 -1.63 -2.30 114.38 119.52 1k7j h ARG 52 Ca 0.00 -0.11 -0.08 0.00 0.07 0.00 0.00 59.98 59.86 1k7j h ARG 52 Cb 0.00 -0.23 -0.01 0.00 0.08 0.00 0.00 29.97 29.80 1k7j h ARG 52 CO 0.00 0.79 -0.06 0.82 -1.07 0.00 0.00 179.97 180.46 1k7j h ILE 53 N 1.13 1.27 -0.64 2.04 2.04 -1.56 -2.27 117.51 119.51 1k7j h ILE 53 Ca 0.29 -1.13 0.11 0.00 1.00 0.00 0.00 64.86 65.13 1k7j h ILE 53 Cb -0.03 1.13 -0.08 0.00 -0.74 0.00 0.00 36.82 37.10 1k7j h ILE 53 CO -0.05 0.38 0.23 0.00 0.00 0.00 0.00 178.15 178.71 1k7j h ARG 55 N 0.40 0.92 -0.46 0.00 3.08 -1.31 0.45 114.38 117.46 1k7j h ARG 55 Ca 0.33 -0.39 -0.13 0.00 0.07 0.00 0.00 59.98 59.86 1k7j h ARG 55 Cb 0.44 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1k7j h ARG 55 CO -0.34 1.05 -0.20 0.82 -1.07 0.00 0.00 179.97 180.23 1k7j h ILE 56 N 0.75 1.27 0.00 2.04 2.04 -0.80 -2.95 117.51 119.87 1k7j h ILE 56 Ca 0.10 -1.36 -0.00 0.00 1.00 0.00 0.00 64.86 64.60 1k7j h ILE 56 Cb 0.76 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 1k7j h ILE 56 CO 0.06 0.47 -0.02 -0.09 0.00 0.00 0.00 178.15 178.56 1k7j h ARG 57 N 0.80 0.00 -6.04 2.37 9.65 -0.48 -3.47 114.38 117.21 1k7j h ARG 57 Ca 0.11 0.00 -0.42 0.00 -1.10 0.00 0.00 59.98 58.56 1k7j h ARG 57 Cb 0.77 0.00 0.06 0.00 -1.39 0.00 0.00 29.97 29.42 1k7j h ARG 57 CO 0.06 0.02 -0.74 1.04 2.80 0.00 0.00 179.97 183.15 1k7j n GLN 58 N -3.11 -6.48 -1.44 0.20 6.02 0.15 -4.76 117.38 107.96 1k7j n GLN 58 Ca 0.03 0.71 -0.56 0.00 -0.01 0.00 0.00 57.00 57.17 1k7j n GLN 58 Cb 0.50 -5.64 -0.09 0.00 1.02 0.00 0.00 30.24 26.03 1k7j n GLN 58 CO 0.00 0.00 0.00 -0.11 -1.01 0.00 0.00 177.06 175.94 1k7j n LEU 59 N -4.69 1.64 0.00 1.08 7.94 -0.88 -4.92 117.00 117.17 1k7j n LEU 59 Ca -0.05 0.67 -0.29 0.00 -1.11 0.00 0.00 56.01 55.23 1k7j n LEU 59 Cb 0.57 -1.09 0.25 0.00 0.53 0.00 0.00 43.42 43.69 1k7j n LEU 59 CO 0.69 -0.70 0.48 -2.65 -1.11 0.00 0.00 177.39 174.11 1k7j n PRO 60 N 7.20 -3.69 -2.24 1.96 -0.02 -1.26 -4.93 135.00 132.03 1k7j n PRO 60 Ca 0.43 -1.56 -0.41 0.00 -2.02 0.00 0.00 63.50 59.94 1k7j n PRO 60 Cb 0.10 -1.65 -0.03 0.00 -0.02 0.00 0.00 33.50 31.90 1k7j n PRO 60 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1k7j s ASP 61 N -3.84 6.92 0.00 2.55 1.01 -1.26 -2.75 116.67 119.30 1k7j s ASP 61 Ca 0.66 2.38 0.00 0.00 0.71 0.00 0.00 52.55 56.30 1k7j s ASP 61 Cb -0.08 -2.61 0.00 0.00 1.01 0.00 0.00 42.92 41.24 1k7j s ASP 61 CO 0.52 -0.51 0.00 0.61 0.21 0.00 0.00 175.17 176.01 1k7j n GLY 62 N 2.30 0.17 3.71 0.21 0.00 -1.26 -4.94 105.19 105.39 1k7j n GLY 62 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1k7j n GLY 62 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1k7j s HIS 63 N -1.44 3.69 0.52 1.61 5.04 -1.11 -5.02 115.29 118.57 1k7j s HIS 63 Ca 0.00 1.71 -0.18 0.00 -1.54 0.00 0.00 55.06 55.04 1k7j s HIS 63 Cb 0.00 -3.12 -0.07 0.00 0.04 0.00 0.00 32.58 29.43 1k7j s HIS 63 CO 0.00 -0.02 1.02 -0.80 -2.34 0.00 0.00 174.74 172.60 1k7j s ASN 64 N 0.76 6.30 0.91 9.88 0.01 -1.26 -4.88 114.94 126.67 1k7j s ASN 64 Ca 0.51 1.80 -0.12 0.00 -0.71 0.00 0.00 52.86 54.34 1k7j s ASN 64 Cb -0.22 -2.54 0.19 0.00 0.41 0.00 0.00 41.25 39.09 1k7j s ASN 64 CO 0.29 -0.81 1.25 -0.36 -1.51 0.00 0.00 177.10 175.96 1k7j s PHE 65 N -2.26 1.46 -0.01 2.20 0.08 -1.26 -4.80 117.98 113.40 1k7j s PHE 65 Ca 0.64 0.12 0.03 0.00 0.12 0.00 0.00 56.93 57.84 1k7j s PHE 65 Cb -0.14 -3.87 -0.01 0.00 -0.57 0.00 0.00 43.02 38.43 1k7j s PHE 65 CO 0.26 -2.48 -0.11 0.99 -0.10 0.00 0.00 175.22 173.78 1k7j s THR 66 N -3.72 0.83 0.00 0.64 2.01 -0.44 -0.62 115.64 114.34 1k7j s THR 66 Ca 0.73 -0.45 0.00 0.00 0.31 0.00 0.00 61.69 62.28 1k7j s THR 66 Cb -0.04 -0.70 0.00 0.00 0.01 0.00 0.00 72.50 71.77 1k7j s THR 66 CO 0.51 0.24 0.00 0.18 -0.69 0.00 0.00 174.62 174.86 1k7j n LEU 67 N 2.85 0.00 0.00 4.42 4.77 0.12 -0.01 117.00 129.15 1k7j n LEU 67 Ca -0.14 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1k7j n LEU 67 Cb 0.56 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 1k7j n LEU 67 CO 0.25 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.31 1k7j h ARG 70 N 0.00 0.59 0.00 0.00 9.65 -1.91 -3.36 114.38 119.35 1k7j h ARG 70 Ca 0.00 -0.08 -0.01 0.00 -1.10 0.00 0.00 59.98 58.79 1k7j h ARG 70 Cb 0.00 -0.11 0.01 0.00 -1.39 0.00 0.00 29.97 28.47 1k7j h ARG 70 CO 0.00 0.49 0.21 -0.40 2.80 0.00 0.00 179.97 183.08 1k7j n ASP 71 N -4.70 -1.62 -0.13 -3.80 5.68 -1.26 -4.84 116.55 105.88 1k7j n ASP 71 Ca 0.00 -2.11 0.00 0.00 -0.50 0.00 0.00 54.79 52.19 1k7j n ASP 71 Cb 0.10 2.69 0.28 0.00 -1.14 0.00 0.00 41.12 43.05 1k7j n ASP 71 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1k7j h LEU 72 N 0.00 0.72 -0.15 -2.12 5.85 -1.98 -1.14 115.31 116.49 1k7j h LEU 72 Ca -0.24 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.44 1k7j h LEU 72 Cb 0.88 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 1k7j h LEU 72 CO 0.30 0.59 0.09 -1.28 -0.34 0.00 0.00 178.44 177.80 1k7j h SER 73 N 0.82 0.14 -0.63 1.25 0.87 -1.98 0.11 113.55 114.14 1k7j h SER 73 Ca 0.21 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.69 1k7j h SER 73 Cb 0.03 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 1k7j h SER 73 CO -0.03 0.11 0.07 -0.08 -0.53 0.00 0.00 176.83 176.36 1k7j h GLU 74 N 0.18 1.08 -0.86 2.24 4.81 -1.88 -2.41 114.58 117.74 1k7j h GLU 74 Ca 0.06 -0.30 0.03 0.00 -0.13 0.00 0.00 59.36 59.02 1k7j h GLU 74 Cb -0.00 -0.12 -0.05 0.00 0.63 0.00 0.00 28.75 29.21 1k7j h GLU 74 CO -0.03 1.01 0.56 1.25 -0.73 0.00 0.00 179.01 181.06 1k7j h LEU 75 N 1.00 0.92 0.00 1.64 6.46 -0.77 -0.81 115.31 123.75 1k7j h LEU 75 Ca 0.19 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 57.95 1k7j h LEU 75 Cb 0.48 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 1k7j h LEU 75 CO 0.02 0.64 0.00 -1.20 -0.62 0.00 0.00 178.44 177.27 1k7j n SER 76 N -4.54 0.00 -0.01 1.25 7.64 0.36 -1.81 113.62 116.50 1k7j n SER 76 Ca 0.11 0.35 -0.13 0.00 1.01 0.00 0.00 58.87 60.20 1k7j n SER 76 Cb 0.09 -0.43 -0.14 0.00 -1.01 0.00 0.00 64.21 62.72 1k7j n SER 76 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1k7j n THR 77 N -1.43 1.68 1.08 0.44 -1.04 -0.35 -4.29 114.28 110.37 1k7j n THR 77 Ca 0.06 -0.74 0.12 0.00 -2.04 0.00 0.00 64.05 61.44 1k7j n THR 77 Cb 0.19 -1.31 0.12 0.00 -1.82 0.00 0.00 70.33 67.51 1k7j n THR 77 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1k7j n TYR 78 N -3.21 0.00 -4.00 -1.42 4.02 -0.99 -4.76 117.16 106.80 1k7j n TYR 78 Ca -0.23 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.59 1k7j n TYR 78 Cb 1.05 -0.03 -0.09 0.00 -0.02 0.00 0.00 39.34 40.24 1k7j n TYR 78 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 1k7j s SER 79 N -2.46 0.34 -0.34 7.72 1.04 -0.75 -1.54 113.70 117.70 1k7j s SER 79 Ca 0.21 -0.83 -0.25 0.00 0.48 0.00 0.00 55.95 55.56 1k7j s SER 79 Cb 0.19 0.24 0.01 0.00 0.10 0.00 0.00 66.02 66.55 1k7j s SER 79 CO 0.55 -0.62 0.87 -0.36 0.98 0.00 0.00 173.24 174.66 1k7j s PHE 80 N -3.66 3.14 -0.23 5.02 0.08 -0.23 -4.61 117.98 117.49 1k7j s PHE 80 Ca 0.04 0.79 -0.02 0.00 0.12 0.00 0.00 56.93 57.87 1k7j s PHE 80 Cb 0.05 -3.45 0.02 0.00 -0.57 0.00 0.00 43.02 39.07 1k7j s PHE 80 CO -0.09 -0.71 -0.09 0.08 -0.10 0.00 0.00 175.22 174.31 1k7j s VAL 81 N 3.24 2.82 0.41 -0.44 1.01 -1.26 -4.57 120.40 121.61 1k7j s VAL 81 Ca 0.36 -0.86 0.07 0.00 0.00 0.00 0.00 61.98 61.54 1k7j s VAL 81 Cb -0.13 -2.35 0.07 0.00 0.00 0.00 0.00 36.38 33.97 1k7j s VAL 81 CO 0.16 0.33 0.56 -0.90 0.00 0.00 0.00 175.10 175.25 1k7j n ASP 82 N 4.69 1.46 -0.08 3.32 5.68 -1.26 -4.85 116.55 125.51 1k7j n ASP 82 Ca -0.18 -2.07 -0.07 0.00 -0.50 0.00 0.00 54.79 51.98 1k7j n ASP 82 Cb 0.49 -0.30 -0.01 0.00 -1.14 0.00 0.00 41.12 40.16 1k7j n ASP 82 CO 0.00 0.00 0.00 -1.13 -1.33 0.00 0.00 177.20 174.74 1k7j h ASN 83 N 0.06 -0.34 -0.12 -1.12 -1.24 -1.99 0.15 115.58 110.98 1k7j h ASN 83 Ca -0.19 0.10 0.03 0.00 0.71 0.00 0.00 56.30 56.94 1k7j h ASN 83 Cb 0.87 0.21 -0.03 0.00 0.73 0.00 0.00 38.32 40.10 1k7j h ASN 83 CO 0.27 -0.12 -0.04 0.58 -1.29 0.00 0.00 177.43 176.82 1k7j h VAL 84 N -0.03 0.85 -0.49 2.57 2.07 -1.98 -1.62 116.25 117.61 1k7j h VAL 84 Ca 0.15 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.63 1k7j h VAL 84 Cb 0.25 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 1k7j h VAL 84 CO -0.32 0.00 0.17 0.00 0.02 0.00 0.00 177.57 177.44 1k7j h ALA 85 N 1.10 0.64 0.03 1.67 0.00 -1.82 -2.62 119.26 118.25 1k7j h ALA 85 Ca 0.06 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.81 1k7j h ALA 85 Cb 0.12 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1k7j h ALA 85 CO -0.14 0.27 -0.06 0.35 0.00 0.00 0.00 179.25 179.67 1k7j h PHE 86 N 0.65 -0.16 -0.94 0.00 3.57 -0.73 -2.92 116.94 116.41 1k7j h PHE 86 Ca 0.16 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.67 1k7j h PHE 86 Cb 0.23 0.07 -0.05 0.00 2.79 0.00 0.00 35.95 38.99 1k7j h PHE 86 CO 0.01 -0.10 0.63 0.00 -2.23 0.00 0.00 178.31 176.62 1k7j h ARG 87 N -0.13 1.24 -0.42 1.11 3.08 -1.28 0.14 114.38 118.13 1k7j h ARG 87 Ca 0.01 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1k7j h ARG 87 Cb 0.14 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 29.91 1k7j h ARG 87 CO -0.04 0.82 0.00 1.28 -1.07 0.00 0.00 179.97 180.96 1k7j n LEU 88 N -4.43 0.42 0.00 3.04 4.77 -0.99 -3.54 117.00 116.27 1k7j n LEU 88 Ca 0.11 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1k7j n LEU 88 Cb 0.01 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.89 1k7j n LEU 88 CO 0.37 0.11 0.00 2.29 -1.33 0.00 0.00 177.39 178.82 1k7j n LYS 90 N 0.25 0.00 -0.26 3.23 2.85 0.04 -2.92 118.16 121.35 1k7j n LYS 90 Ca 0.00 0.00 0.10 0.00 -1.05 0.00 0.00 58.31 57.36 1k7j n LYS 90 Cb 0.11 0.00 0.24 0.00 -0.65 0.00 0.00 35.03 34.73 1k7j n LYS 90 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1k7j n ASN 91 N 0.00 3.50 -2.75 -5.58 3.02 -1.23 -4.47 115.26 107.75 1k7j n ASN 91 Ca 0.00 -1.97 -0.05 0.00 -0.03 0.00 0.00 54.58 52.53 1k7j n ASN 91 Cb 0.00 -0.34 0.04 0.00 -0.61 0.00 0.00 39.78 38.87 1k7j n ASN 91 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1k7j n ASN 92 N 1.33 1.50 -3.88 6.41 3.02 -1.15 -5.07 115.26 117.42 1k7j n ASN 92 Ca 0.19 -2.38 -0.11 0.00 -0.03 0.00 0.00 54.58 52.26 1k7j n ASN 92 Cb 0.56 -0.50 -0.10 0.00 -0.61 0.00 0.00 39.78 39.13 1k7j n ASN 92 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1k7j s THR 93 N -3.44 0.09 0.59 3.41 -4.23 -1.26 -4.78 115.64 106.01 1k7j s THR 93 Ca 0.27 -0.74 0.03 0.00 -1.18 0.00 0.00 61.69 60.07 1k7j s THR 93 Cb 0.39 -0.47 0.07 0.00 1.34 0.00 0.00 72.50 73.83 1k7j s THR 93 CO 0.00 -0.41 0.82 -2.16 -0.54 0.00 0.00 174.62 172.33 1k7j s PRO 94 N -1.51 2.28 0.09 3.99 0.04 -1.26 -5.03 135.00 133.61 1k7j s PRO 94 Ca -0.14 -1.08 0.00 0.00 0.04 0.00 0.00 61.00 59.82 1k7j s PRO 94 Cb -0.07 -2.50 0.00 0.00 0.04 0.00 0.00 34.50 31.97 1k7j s PRO 94 CO 0.01 -0.90 0.00 0.41 0.04 0.00 0.00 177.00 176.56 1k7j n GLY 95 N -2.41 -2.40 4.37 0.56 0.00 0.21 -4.74 105.19 100.79 1k7j n GLY 95 Ca 0.11 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 44.72 1k7j n GLY 95 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1k7j n ASN 96 N -2.60 0.00 -4.12 1.61 3.02 -1.26 -4.94 115.26 106.97 1k7j n ASN 96 Ca -0.01 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.40 1k7j n ASN 96 Cb 0.11 -1.26 -0.11 0.00 -0.61 0.00 0.00 39.78 37.91 1k7j n ASN 96 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1k7j s TYR 97 N -1.54 0.87 -0.10 3.10 2.02 -1.26 -0.85 117.35 119.59 1k7j s TYR 97 Ca 0.00 -0.60 0.01 0.00 -0.37 0.00 0.00 57.07 56.11 1k7j s TYR 97 Cb 0.00 -0.50 0.02 0.00 -0.40 0.00 0.00 41.96 41.08 1k7j s TYR 97 CO 0.00 -0.06 -0.12 0.99 -1.57 0.00 0.00 175.55 174.79 1k7j s THR 98 N -1.99 1.28 -0.20 -0.71 2.01 -0.40 -4.38 115.64 111.25 1k7j s THR 98 Ca -0.02 -0.51 -0.04 0.00 0.31 0.00 0.00 61.69 61.43 1k7j s THR 98 Cb -0.06 -1.20 -0.02 0.00 0.01 0.00 0.00 72.50 71.24 1k7j s THR 98 CO -0.00 0.40 -0.03 -0.36 -0.69 0.00 0.00 174.62 173.94 1k7j s PHE 99 N 1.08 2.99 -0.21 4.92 0.08 -1.26 -1.20 117.98 124.38 1k7j s PHE 99 Ca -0.06 -0.60 -0.24 0.00 0.12 0.00 0.00 56.93 56.16 1k7j s PHE 99 Cb -0.15 -2.06 -0.01 0.00 -0.57 0.00 0.00 43.02 40.23 1k7j s PHE 99 CO -0.02 -0.31 0.77 0.42 -0.10 0.00 0.00 175.22 175.98 1k7j s ILE 100 N 1.03 4.90 0.18 0.64 -1.09 0.24 -4.35 121.20 122.75 1k7j s ILE 100 Ca 0.01 1.47 -0.02 0.00 -2.23 0.00 0.00 60.65 59.88 1k7j s ILE 100 Cb -0.15 -4.07 -0.04 0.00 -1.58 0.00 0.00 42.46 36.63 1k7j s ILE 100 CO 0.01 -0.00 0.15 -0.76 -1.23 0.00 0.00 174.94 173.11 1k7j s LEU 101 N 2.43 1.23 0.11 2.97 1.43 -0.91 -1.65 118.68 124.29 1k7j s LEU 101 Ca 0.34 -1.28 -0.30 0.00 -1.03 0.00 0.00 54.13 51.86 1k7j s LEU 101 Cb -0.16 0.51 -0.06 0.00 0.03 0.00 0.00 46.19 46.52 1k7j s LEU 101 CO 0.09 -0.84 0.99 -0.54 0.23 0.00 0.00 176.35 176.28 1k7j s LYS 102 N -4.11 4.67 0.36 1.70 1.02 -1.26 -1.00 119.74 121.11 1k7j s LYS 102 Ca 0.33 1.49 -0.21 0.00 0.02 0.00 0.00 55.97 57.60 1k7j s LYS 102 Cb 0.06 -3.37 -0.10 0.00 -0.52 0.00 0.00 37.83 33.90 1k7j s LYS 102 CO 0.09 0.16 0.89 0.20 -0.92 0.00 0.00 175.35 175.77 1k7j s GLY 103 N 0.09 2.52 0.72 -3.33 0.00 -0.95 -1.07 107.32 105.31 1k7j s GLY 103 Ca 0.48 0.36 -0.06 0.00 0.00 0.00 0.00 44.72 45.49 1k7j s GLY 103 CO 0.30 0.68 0.98 -1.30 0.00 0.00 0.00 173.10 173.76 1k7j n THR 104 N -0.13 0.00 0.46 0.90 -2.24 -0.59 -4.78 114.28 107.90 1k7j n THR 104 Ca 0.04 -1.12 0.06 0.00 -2.27 0.00 0.00 64.05 60.76 1k7j n THR 104 Cb 0.52 -1.24 0.26 0.00 -2.10 0.00 0.00 70.33 67.78 1k7j n THR 104 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1k7j n LYS 105 N -2.95 0.07 0.26 -0.78 4.76 -1.26 -1.49 118.16 116.77 1k7j n LYS 105 Ca 0.14 0.25 0.14 0.00 -2.87 0.00 0.00 58.31 55.97 1k7j n LYS 105 Cb 0.50 -1.50 0.62 0.00 -1.84 0.00 0.00 35.03 32.81 1k7j n LYS 105 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1k7j h GLU 106 N 0.00 0.00 -5.32 1.97 4.39 -1.88 -3.43 114.58 110.31 1k7j h GLU 106 Ca 0.00 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.10 1k7j h GLU 106 Cb 0.16 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.68 1k7j h GLU 106 CO 0.00 0.11 -0.36 0.08 -1.16 0.00 0.00 179.01 177.68 1k7j s VAL 107 N -3.75 5.30 0.29 3.13 1.01 -0.55 -5.05 120.40 120.77 1k7j s VAL 107 Ca 0.00 0.45 -0.30 0.00 0.00 0.00 0.00 61.98 62.13 1k7j s VAL 107 Cb 0.10 -3.61 -0.12 0.00 0.00 0.00 0.00 36.38 32.75 1k7j s VAL 107 CO 0.58 0.33 1.42 -2.65 0.00 0.00 0.00 175.10 174.79 1k7j n PRO 108 N 4.09 2.26 -0.32 2.72 -0.02 -1.26 -4.86 135.00 137.61 1k7j n PRO 108 Ca -0.12 0.80 0.13 0.00 -2.02 0.00 0.00 63.50 62.29 1k7j n PRO 108 Cb 0.52 -2.47 0.31 0.00 -0.02 0.00 0.00 33.50 31.84 1k7j n PRO 108 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1k7j h ARG 109 N 3.76 0.54 -0.00 -0.52 2.43 -1.94 -0.91 114.38 117.74 1k7j h ARG 109 Ca -0.46 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1k7j h ARG 109 Cb 1.26 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.69 1k7j h ARG 109 CO 0.72 0.36 0.08 0.07 -1.51 0.00 0.00 179.97 179.68 1k7j h ARG 110 N 0.55 0.00 -0.00 0.20 0.11 -2.01 -1.26 114.38 111.98 1k7j h ARG 110 Ca 0.56 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.64 1k7j h ARG 110 Cb 0.98 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.06 1k7j h ARG 110 CO -0.45 0.00 -0.52 1.28 0.10 0.00 0.00 179.97 180.37 1k7j n LEU 111 N -3.05 0.58 -4.86 0.08 4.77 -0.35 -4.90 117.00 109.28 1k7j n LEU 111 Ca -0.03 -0.06 -0.35 0.00 -0.03 0.00 0.00 56.01 55.54 1k7j n LEU 111 Cb 0.14 -0.22 -0.06 0.00 -2.33 0.00 0.00 43.42 40.96 1k7j n LEU 111 CO 0.19 0.14 0.15 -0.76 -1.33 0.00 0.00 177.39 175.78 1k7j s LEU 112 N -2.97 4.35 0.09 2.23 1.43 -0.48 -4.46 118.68 118.87 1k7j s LEU 112 Ca 0.12 0.93 -0.33 0.00 -1.03 0.00 0.00 54.13 53.81 1k7j s LEU 112 Cb 0.17 -3.10 -0.12 0.00 0.03 0.00 0.00 46.19 43.17 1k7j s LEU 112 CO 0.70 0.15 1.74 1.67 0.23 0.00 0.00 176.35 180.84 1k7j n GLN 113 N 0.89 2.38 -0.36 1.70 0.00 -0.02 -4.81 117.38 117.16 1k7j n GLN 113 Ca -0.07 0.86 0.06 0.00 -0.00 0.00 0.00 57.00 57.86 1k7j n GLN 113 Cb 0.52 -2.69 0.14 0.00 0.00 0.00 0.00 30.24 28.21 1k7j n GLN 113 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 1k7j n GLU 114 N 4.94 -0.09 -0.08 3.69 0.28 -1.26 0.07 120.64 128.20 1k7j n GLU 114 Ca 0.19 1.55 -0.23 0.00 -0.16 0.00 0.00 57.16 58.52 1k7j n GLU 114 Cb 0.32 -2.32 -0.12 0.00 1.43 0.00 0.00 31.44 30.74 1k7j n GLU 114 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1k7j n LYS 115 N -5.62 0.64 0.04 3.44 4.81 -1.26 -4.52 118.16 115.68 1k7j n LYS 115 Ca 0.16 0.41 0.12 0.00 -0.87 0.00 0.00 58.31 58.13 1k7j n LYS 115 Cb 0.50 -1.69 0.21 0.00 0.02 0.00 0.00 35.03 34.08 1k7j n LYS 115 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1k7j n ARG 116 N -4.03 0.19 -2.51 1.64 1.74 -1.20 -4.96 116.66 107.54 1k7j n ARG 116 Ca -0.36 0.05 -0.20 0.00 -0.77 0.00 0.00 57.85 56.57 1k7j n ARG 116 Cb 0.85 -1.62 0.00 0.00 -1.02 0.00 0.00 32.46 30.67 1k7j n ARG 116 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1k7j n LYS 117 N -1.90 -2.29 -3.15 5.56 4.76 0.11 -4.92 118.16 116.34 1k7j n LYS 117 Ca 0.04 0.95 -0.18 0.00 -2.87 0.00 0.00 58.31 56.25 1k7j n LYS 117 Cb 0.40 -5.61 0.00 0.00 -1.84 0.00 0.00 35.03 27.99 1k7j n LYS 117 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1k7j s THR 118 N -3.04 2.85 -0.11 -0.18 -4.23 -1.26 -2.23 115.64 107.45 1k7j s THR 118 Ca 0.06 -1.08 -0.30 0.00 -1.18 0.00 0.00 61.69 59.19 1k7j s THR 118 Cb -0.03 -2.94 0.09 0.00 1.34 0.00 0.00 72.50 70.96 1k7j s THR 118 CO 0.08 0.00 0.78 -0.51 -0.54 0.00 0.00 174.62 174.42 1k7j s ILE 119 N -2.40 0.00 0.00 2.99 2.07 -0.17 -0.84 121.20 122.84 1k7j s ILE 119 Ca 0.54 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.78 1k7j s ILE 119 Cb -0.08 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.51 1k7j s ILE 119 CO 0.32 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.96 1k7j n GLY 120 N 1.09 -0.73 0.00 1.50 0.00 0.20 -2.14 105.19 105.11 1k7j n GLY 120 Ca -0.16 -1.71 0.00 0.00 0.00 0.00 0.00 46.02 44.15 1k7j n GLY 120 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1k7j n ARG 122 N -0.77 0.00 -3.68 1.61 0.63 -0.54 0.10 116.66 114.00 1k7j n ARG 122 Ca 0.00 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.54 1k7j n ARG 122 Cb 0.00 0.00 -0.12 0.00 0.45 0.00 0.00 32.46 32.79 1k7j n ARG 122 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1k7j s VAL 123 N 0.00 4.17 0.51 5.15 1.01 -1.26 -0.11 120.40 129.87 1k7j s VAL 123 Ca 0.00 -0.92 -0.18 0.00 0.00 0.00 0.00 61.98 60.87 1k7j s VAL 123 Cb 0.00 -3.31 -0.08 0.00 0.00 0.00 0.00 36.38 33.00 1k7j s VAL 123 CO 0.00 -0.15 1.01 -2.16 0.00 0.00 0.00 175.10 173.80 1k7j s PRO 124 N 1.49 3.80 -0.00 2.72 0.04 -1.26 0.65 135.00 142.44 1k7j s PRO 124 Ca 0.01 1.17 0.15 0.00 0.04 0.00 0.00 61.00 62.36 1k7j s PRO 124 Cb -0.19 -2.11 -0.18 0.00 0.04 0.00 0.00 34.50 32.07 1k7j s PRO 124 CO 0.05 -0.41 0.59 -1.13 0.04 0.00 0.00 177.00 176.14 1k7j n SER 125 N -1.34 0.85 -4.81 6.66 3.41 -1.26 -4.45 113.62 112.68 1k7j n SER 125 Ca 0.08 -0.70 -0.34 0.00 -0.26 0.00 0.00 58.87 57.65 1k7j n SER 125 Cb 0.53 1.13 -0.07 0.00 -0.26 0.00 0.00 64.21 65.55 1k7j n SER 125 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1k7j s ASN 126 N -2.69 7.07 0.24 4.04 4.22 -1.26 -4.94 114.94 121.61 1k7j s ASN 126 Ca 0.04 1.70 -0.05 0.00 -2.14 0.00 0.00 52.86 52.40 1k7j s ASN 126 Cb 0.11 -2.54 0.41 0.00 1.28 0.00 0.00 41.25 40.51 1k7j s ASN 126 CO 0.63 -0.23 1.74 -0.65 -2.04 0.00 0.00 177.10 176.56 1k7j h PRO 127 N 2.44 0.47 -0.12 3.55 0.11 -1.91 -1.72 132.00 134.82 1k7j h PRO 127 Ca -0.48 -0.03 -0.01 0.00 0.11 0.00 0.00 66.00 65.59 1k7j h PRO 127 Cb 1.18 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 1k7j h PRO 127 CO 0.63 0.31 0.05 0.82 -0.21 0.00 0.00 178.00 179.60 1k7j h ILE 128 N 0.48 1.15 -0.59 4.15 2.04 -1.88 0.54 117.51 123.40 1k7j h ILE 128 Ca 0.39 -0.45 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1k7j h ILE 128 Cb 0.53 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.82 1k7j h ILE 128 CO -0.36 0.14 0.24 0.00 0.00 0.00 0.00 178.15 178.17 1k7j h ALA 129 N 0.89 0.77 -0.83 1.87 0.00 -1.66 -0.87 119.26 119.43 1k7j h ALA 129 Ca 0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1k7j h ALA 129 Cb 0.17 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 1k7j h ALA 129 CO -0.00 0.38 0.38 1.96 0.00 0.00 0.00 179.25 181.96 1k7j h GLN 130 N 0.82 1.21 -0.59 0.00 1.08 -1.18 -1.63 115.11 114.82 1k7j h GLN 130 Ca 0.20 -0.19 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1k7j h GLN 130 Cb 0.20 -0.21 -0.02 0.00 -0.05 0.00 0.00 27.48 27.39 1k7j h GLN 130 CO -0.02 0.95 0.12 0.00 -0.95 0.00 0.00 178.83 178.93 1k7j h ALA 131 N 1.22 0.79 -0.44 3.87 0.00 -0.46 -0.35 119.26 123.89 1k7j h ALA 131 Ca 0.28 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1k7j h ALA 131 Cb 0.15 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 1k7j h ALA 131 CO -0.03 0.51 0.25 -0.07 0.00 0.00 0.00 179.25 179.91 1k7j h LEU 132 N 0.87 0.54 -0.56 0.00 3.38 -0.83 -1.59 115.31 117.12 1k7j h LEU 132 Ca 0.18 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1k7j h LEU 132 Cb 0.38 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 1k7j h LEU 132 CO 0.01 0.45 0.03 -0.07 0.09 0.00 0.00 178.44 178.95 1k7j h LEU 133 N 0.57 0.95 -0.74 1.67 3.38 -1.08 0.15 115.31 120.21 1k7j h LEU 133 Ca 0.15 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.84 1k7j h LEU 133 Cb 0.03 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 1k7j h LEU 133 CO -0.03 1.00 0.49 -0.08 0.09 0.00 0.00 178.44 179.91 1k7j h GLU 134 N 0.86 0.97 -0.19 1.13 4.81 -0.85 -0.47 114.58 120.84 1k7j h GLU 134 Ca 0.16 -0.06 -0.17 0.00 -0.13 0.00 0.00 59.36 59.16 1k7j h GLU 134 Cb 0.50 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1k7j h GLU 134 CO 0.02 0.64 -0.59 0.00 -0.73 0.00 0.00 179.01 178.36 1k7j h ALA 135 N 1.27 0.62 -0.46 2.92 0.00 -1.06 -3.23 119.26 119.32 1k7j h ALA 135 Ca 0.27 -0.53 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 1k7j h ALA 135 Cb -0.11 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1k7j h ALA 135 CO -0.06 0.70 -0.17 1.25 0.00 0.00 0.00 179.25 180.96 1k7j h LEU 136 N 0.46 0.95 0.00 0.00 5.85 -0.62 -3.47 115.31 118.48 1k7j h LEU 136 Ca 0.00 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1k7j h LEU 136 Cb 1.15 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.92 1k7j h LEU 136 CO 0.11 1.12 0.00 0.61 -0.34 0.00 0.00 178.44 179.94 1k7j n GLY 137 N -0.13 1.06 3.69 3.75 0.00 -0.22 -5.00 105.19 108.34 1k7j n GLY 137 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.92 1k7j n GLY 137 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1k7j s GLU 138 N -0.55 1.85 0.00 1.61 -1.05 -1.26 -5.08 118.70 114.22 1k7j s GLU 138 Ca 0.00 -1.33 0.00 0.00 -0.15 0.00 0.00 54.97 53.49 1k7j s GLU 138 Cb 0.00 0.54 0.00 0.00 -0.44 0.00 0.00 34.13 34.23 1k7j s GLU 138 CO 0.00 -0.81 0.00 -2.30 0.95 0.00 0.00 175.26 173.10 1k7j n PRO 139 N -0.47 2.64 -4.65 -4.83 -0.02 -1.26 -4.89 135.00 121.52 1k7j n PRO 139 Ca -0.03 0.00 -0.28 0.00 -2.02 0.00 0.00 63.50 61.17 1k7j n PRO 139 Cb 0.61 0.00 -0.17 0.00 -0.02 0.00 0.00 33.50 33.92 1k7j n PRO 139 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1k7j s LEU 141 N 0.00 1.76 0.34 2.45 2.96 -0.00 -4.53 118.68 121.66 1k7j s LEU 141 Ca 0.00 -0.40 -0.02 0.00 -0.22 0.00 0.00 54.13 53.49 1k7j s LEU 141 Cb 0.00 -1.05 -0.00 0.00 0.50 0.00 0.00 46.19 45.64 1k7j s LEU 141 CO 0.00 0.05 0.46 -0.44 -1.32 0.00 0.00 176.35 175.09 1k7j s SER 142 N 0.75 0.94 0.03 3.68 0.01 0.99 -1.17 113.70 118.92 1k7j s SER 142 Ca -0.12 -1.49 -0.27 0.00 1.31 0.00 0.00 55.95 55.38 1k7j s SER 142 Cb -0.16 0.65 0.07 0.00 0.21 0.00 0.00 66.02 66.79 1k7j s SER 142 CO 0.02 -1.27 0.62 0.42 0.41 0.00 0.00 173.24 173.44 1k7j s THR 143 N -3.12 0.01 0.58 1.44 -4.23 -1.03 -1.32 115.64 107.97 1k7j s THR 143 Ca 0.31 -0.05 -0.18 0.00 -1.18 0.00 0.00 61.69 60.59 1k7j s THR 143 Cb -0.00 -0.99 -0.04 0.00 1.34 0.00 0.00 72.50 72.81 1k7j s THR 143 CO 0.20 -0.03 1.10 -0.44 -0.54 0.00 0.00 174.62 174.92 1k7j s SER 144 N -1.82 5.62 -0.05 3.99 0.01 -1.26 -0.86 113.70 119.33 1k7j s SER 144 Ca -0.06 2.03 -0.10 0.00 1.31 0.00 0.00 55.95 59.14 1k7j s SER 144 Cb -0.00 -2.56 -0.05 0.00 0.21 0.00 0.00 66.02 63.62 1k7j s SER 144 CO 0.01 -1.28 0.27 -0.22 0.41 0.00 0.00 173.24 172.42 1k7j s LEU 145 N -4.19 4.42 0.19 2.44 2.96 -0.15 -4.66 118.68 119.68 1k7j s LEU 145 Ca 0.69 0.67 0.05 0.00 -0.22 0.00 0.00 54.13 55.31 1k7j s LEU 145 Cb -0.21 -2.39 -0.04 0.00 0.50 0.00 0.00 46.19 44.06 1k7j s LEU 145 CO 0.32 0.34 0.21 -0.76 -1.32 0.00 0.00 176.35 175.14 1k7j s LEU 147 N -1.21 3.99 0.07 -0.68 2.01 -1.26 -0.08 118.68 121.52 1k7j s LEU 147 Ca 0.21 -0.06 -0.36 0.00 0.01 0.00 0.00 54.13 53.93 1k7j s LEU 147 Cb -0.14 -2.57 -0.15 0.00 0.01 0.00 0.00 46.19 43.34 1k7j s LEU 147 CO 0.10 0.03 1.54 -2.65 1.01 0.00 0.00 176.35 176.37 1k7j n PRO 148 N -0.68 1.69 -0.80 1.29 -0.02 -1.26 -1.53 135.00 133.68 1k7j n PRO 148 Ca -0.08 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1k7j n PRO 148 Cb 0.55 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1k7j n PRO 148 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1k7j n GLY 149 N 3.26 0.09 3.84 -1.23 0.00 -1.26 -4.96 105.19 104.92 1k7j n GLY 149 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.88 1k7j n GLY 149 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1k7j s SER 150 N -2.06 6.84 0.00 1.61 0.15 -0.59 -4.95 113.70 114.70 1k7j s SER 150 Ca 0.00 1.32 0.26 0.00 0.70 0.00 0.00 55.95 58.23 1k7j s SER 150 Cb 0.00 -2.39 0.70 0.00 -1.71 0.00 0.00 66.02 62.63 1k7j s SER 150 CO 0.00 -0.15 1.55 -0.62 1.20 0.00 0.00 173.24 175.21 1k7j n GLU 151 N -0.12 1.78 -4.24 5.44 1.02 -1.26 -4.80 120.64 118.45 1k7j n GLU 151 Ca 0.02 -1.23 -0.26 0.00 -0.02 0.00 0.00 57.16 55.67 1k7j n GLU 151 Cb 0.53 -1.47 -0.08 0.00 -0.02 0.00 0.00 31.44 30.39 1k7j n GLU 151 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1k7j s PHE 152 N -2.07 2.76 0.20 -0.32 0.08 -1.26 -4.56 117.98 112.81 1k7j s PHE 152 Ca 0.33 -0.18 0.01 0.00 0.12 0.00 0.00 56.93 57.21 1k7j s PHE 152 Cb 0.20 -1.32 -0.04 0.00 -0.57 0.00 0.00 43.02 41.30 1k7j s PHE 152 CO 0.35 0.53 0.37 0.95 -0.10 0.00 0.00 175.22 177.32 1k7j s THR 153 N -1.83 5.24 0.30 0.64 -4.23 -0.08 -4.01 115.64 111.68 1k7j s THR 153 Ca 0.27 -0.53 -0.29 0.00 -1.18 0.00 0.00 61.69 59.96 1k7j s THR 153 Cb -0.09 -3.76 -0.10 0.00 1.34 0.00 0.00 72.50 69.90 1k7j s THR 153 CO 0.18 -0.19 1.19 -1.61 -0.54 0.00 0.00 174.62 173.65 1k7j s GLU 154 N -3.43 4.51 0.00 3.99 2.02 0.88 -4.57 118.70 122.10 1k7j s GLU 154 Ca 0.37 1.99 0.00 0.00 0.02 0.00 0.00 54.97 57.35 1k7j s GLU 154 Cb -0.11 -3.14 0.00 0.00 0.10 0.00 0.00 34.13 30.99 1k7j s GLU 154 CO 0.29 0.03 0.00 -1.13 0.02 0.00 0.00 175.26 174.48 1k7j n SER 155 N 1.03 0.23 -4.42 -0.19 3.41 -1.26 -2.60 113.62 109.83 1k7j n SER 155 Ca -0.01 -0.20 -0.42 0.00 -0.26 0.00 0.00 58.87 57.99 1k7j n SER 155 Cb 0.43 0.45 -0.11 0.00 -0.26 0.00 0.00 64.21 64.73 1k7j n SER 155 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1k7j s ASP 156 N -0.50 5.92 0.52 4.04 -1.08 -1.26 -1.93 116.67 122.38 1k7j s ASP 156 Ca 0.00 -0.93 0.17 0.00 -0.52 0.00 0.00 52.55 51.28 1k7j s ASP 156 Cb 0.00 -2.09 1.27 0.00 -1.46 0.00 0.00 42.92 40.64 1k7j s ASP 156 CO 0.00 -0.41 2.11 1.55 0.52 0.00 0.00 175.17 178.94 1k7j h PRO 157 N 8.53 0.03 -0.07 4.34 0.13 -1.95 -0.59 132.00 142.42 1k7j h PRO 157 Ca -0.26 -0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.65 1k7j h PRO 157 Cb 1.11 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.24 1k7j h PRO 157 CO 0.70 0.02 -0.82 0.93 -0.23 0.00 0.00 178.00 178.60 1k7j h GLU 158 N 0.03 0.52 -0.53 0.86 4.39 -1.95 -1.46 114.58 116.44 1k7j h GLU 158 Ca 0.06 -0.46 -0.11 0.00 0.34 0.00 0.00 59.36 59.19 1k7j h GLU 158 Cb 0.21 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.95 1k7j h GLU 158 CO -0.00 1.10 -0.10 1.49 -1.16 0.00 0.00 179.01 180.34 1k7j h GLU 159 N 0.33 0.98 -0.69 2.33 4.22 -1.77 -1.69 114.58 118.28 1k7j h GLU 159 Ca -0.06 -0.35 -0.03 0.00 0.08 0.00 0.00 59.36 59.00 1k7j h GLU 159 Cb 1.43 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.58 1k7j h GLU 159 CO 0.15 1.02 0.31 0.82 -2.18 0.00 0.00 179.01 179.12 1k7j h ILE 160 N 0.87 1.24 -0.46 2.32 2.04 -1.03 -1.41 117.51 121.08 1k7j h ILE 160 Ca 0.14 -0.71 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 1k7j h ILE 160 Cb 0.65 0.42 -0.02 0.00 -0.74 0.00 0.00 36.82 37.12 1k7j h ILE 160 CO 0.04 0.29 0.23 0.50 0.00 0.00 0.00 178.15 179.22 1k7j h LYS 161 N 0.98 0.66 -0.69 2.37 3.64 -0.98 0.17 116.57 122.71 1k7j h LYS 161 Ca 0.23 -0.09 -0.02 0.00 -1.27 0.00 0.00 60.65 59.50 1k7j h LYS 161 Cb 0.16 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 1k7j h LYS 161 CO -0.02 0.55 0.34 -0.44 -2.27 0.00 0.00 179.45 177.60 1k7j h ASP 162 N 0.61 0.88 0.38 4.20 3.32 -0.94 -1.85 116.42 123.01 1k7j h ASP 162 Ca 0.16 -0.09 -0.32 0.00 0.02 0.00 0.00 57.03 56.80 1k7j h ASP 162 Cb 0.10 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 39.43 1k7j h ASP 162 CO -0.02 0.74 -1.53 -0.09 -1.72 0.00 0.00 179.24 176.61 1k7j h ARG 163 N 0.97 0.34 0.00 3.56 2.43 -0.92 -3.42 114.38 117.34 1k7j h ARG 163 Ca 0.24 -0.58 0.00 0.00 -0.81 0.00 0.00 59.98 58.83 1k7j h ARG 163 Cb 0.09 0.22 0.00 0.00 -0.42 0.00 0.00 29.97 29.86 1k7j h ARG 163 CO -0.03 1.24 0.00 1.28 -1.51 0.00 0.00 179.97 180.95 1k7j n LEU 164 N -3.54 1.67 0.23 3.80 4.77 0.55 -4.74 117.00 119.73 1k7j n LEU 164 Ca -0.17 -1.67 0.16 0.00 -0.03 0.00 0.00 56.01 54.30 1k7j n LEU 164 Cb 1.06 0.00 0.83 0.00 -2.33 0.00 0.00 43.42 42.98 1k7j n LEU 164 CO 0.53 0.42 0.97 1.05 -1.33 0.00 0.00 177.39 179.03 1k7j h GLU 165 N 0.00 0.00 -0.00 3.23 4.11 -1.48 0.90 114.58 121.34 1k7j h GLU 165 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1k7j h GLU 165 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1k7j h GLU 165 CO 0.00 0.00 -0.59 1.63 0.07 0.00 0.00 179.01 180.12 1k7j n LYS 166 N -2.59 0.44 -0.00 1.06 5.02 -1.26 -0.23 118.16 120.60 1k7j n LYS 166 Ca -0.02 -0.32 0.03 0.00 -2.02 0.00 0.00 58.31 55.98 1k7j n LYS 166 Cb 0.06 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.54 1k7j n LYS 166 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1k7j n GLN 167 N -1.00 4.33 -4.45 1.97 1.13 0.25 -4.95 117.38 114.66 1k7j n GLN 167 Ca 0.07 -0.01 -0.22 0.00 -1.94 0.00 0.00 57.00 54.91 1k7j n GLN 167 Cb 0.36 -0.85 -0.10 0.00 0.11 0.00 0.00 30.24 29.76 1k7j n GLN 167 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1k7j s VAL 168 N -1.72 1.78 -0.13 5.09 -7.23 -0.83 -5.00 120.40 112.37 1k7j s VAL 168 Ca 0.02 -2.15 0.19 0.00 -1.81 0.00 0.00 61.98 58.23 1k7j s VAL 168 Cb 0.05 -2.46 -0.17 0.00 0.56 0.00 0.00 36.38 34.35 1k7j s VAL 168 CO 0.28 -0.30 0.67 0.47 -0.31 0.00 0.00 175.10 175.91 1k7j n ASP 169 N -0.61 0.56 -3.71 4.85 8.00 0.15 -3.68 116.55 122.12 1k7j n ASP 169 Ca -0.05 0.24 -0.13 0.00 0.71 0.00 0.00 54.79 55.55 1k7j n ASP 169 Cb 0.63 0.68 -0.09 0.00 -0.02 0.00 0.00 41.12 42.32 1k7j n ASP 169 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1k7j s LEU 170 N -5.43 0.21 -0.12 0.64 2.96 -1.15 -1.22 118.68 114.58 1k7j s LEU 170 Ca -0.05 0.90 0.00 0.00 -0.22 0.00 0.00 54.13 54.77 1k7j s LEU 170 Cb 0.09 1.62 0.02 0.00 0.50 0.00 0.00 46.19 48.43 1k7j s LEU 170 CO 0.83 -0.19 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.93 1k7j s ILE 171 N 0.13 1.23 -0.34 6.68 1.01 -0.48 -0.68 121.20 128.76 1k7j s ILE 171 Ca -0.01 -0.44 -0.14 0.00 0.00 0.00 0.00 60.65 60.07 1k7j s ILE 171 Cb -0.03 -1.19 -0.02 0.00 0.01 0.00 0.00 42.46 41.23 1k7j s ILE 171 CO 0.01 0.40 0.30 -0.63 0.00 0.00 0.00 174.94 175.02 1k7j s ILE 172 N 1.45 5.23 -0.42 2.92 1.01 0.00 -1.61 121.20 129.78 1k7j s ILE 172 Ca 0.01 -0.05 -0.29 0.00 0.00 0.00 0.00 60.65 60.32 1k7j s ILE 172 Cb -0.13 -3.76 0.02 0.00 0.01 0.00 0.00 42.46 38.61 1k7j s ILE 172 CO -0.07 -0.03 1.14 -2.28 0.00 0.00 0.00 174.94 173.70 1k7j s HIS 173 N 1.87 2.88 -0.18 3.97 5.65 0.88 -4.33 115.29 126.03 1k7j s HIS 173 Ca 0.09 0.86 0.13 0.00 0.25 0.00 0.00 55.06 56.39 1k7j s HIS 173 Cb -0.17 -4.19 0.41 0.00 -1.18 0.00 0.00 32.58 27.45 1k7j s HIS 173 CO 0.11 -1.19 1.21 0.41 -0.65 0.00 0.00 174.74 174.63 1k7j n GLY 174 N 4.55 4.66 0.12 1.59 0.00 -1.26 -2.07 105.19 112.79 1k7j n GLY 174 Ca 0.12 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1k7j n GLY 174 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k7j n GLY 175 N -0.97 -3.82 3.53 -0.02 0.00 -1.26 -4.68 105.19 97.97 1k7j n GLY 175 Ca 0.17 -2.04 -0.41 0.00 0.00 0.00 0.00 46.02 43.75 1k7j n GLY 175 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k7j s TYR 176 N -0.86 3.20 0.34 1.61 1.51 -1.26 -4.44 117.35 117.45 1k7j s TYR 176 Ca 0.00 -0.07 0.03 0.00 -1.01 0.00 0.00 57.07 56.02 1k7j s TYR 176 Cb 0.00 -2.71 0.06 0.00 -0.11 0.00 0.00 41.96 39.20 1k7j s TYR 176 CO 0.00 -0.47 0.47 1.28 -1.11 0.00 0.00 175.55 175.72 1k7j n LEU 177 N 5.42 0.00 -4.90 -1.29 4.77 -0.81 -5.05 117.00 115.15 1k7j n LEU 177 Ca -0.09 -1.29 -0.29 0.00 -0.03 0.00 0.00 56.01 54.32 1k7j n LEU 177 Cb 0.49 -0.27 0.03 0.00 -2.33 0.00 0.00 43.42 41.33 1k7j n LEU 177 CO 0.41 -0.67 0.63 -0.83 -1.33 0.00 0.00 177.39 175.60 1k7j s GLY 178 N -3.58 1.61 0.00 -0.72 0.00 -1.26 -4.80 107.32 98.56 1k7j s GLY 178 Ca 0.34 -0.44 0.16 0.00 0.00 0.00 0.00 44.72 44.79 1k7j s GLY 178 CO 0.22 -0.15 1.23 0.61 0.00 0.00 0.00 173.10 175.01 1k7j n GLN 179 N -2.71 2.15 -3.04 2.90 0.00 -1.26 -3.87 117.38 111.54 1k7j n GLN 179 Ca 0.05 -1.96 -0.40 0.00 0.00 0.00 0.00 57.00 54.69 1k7j n GLN 179 Cb 0.56 -1.37 -0.05 0.00 0.00 0.00 0.00 30.24 29.39 1k7j n GLN 179 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.06 177.27 1k7j s LYS 180 N -1.18 4.32 1.01 2.61 2.20 -1.26 -0.90 119.74 126.54 1k7j s LYS 180 Ca 0.28 0.80 -0.16 0.00 -0.36 0.00 0.00 55.97 56.53 1k7j s LYS 180 Cb 0.16 -3.52 0.21 0.00 -1.51 0.00 0.00 37.83 33.17 1k7j s LYS 180 CO 0.23 -0.14 1.26 -1.25 -0.36 0.00 0.00 175.35 175.09 1k7j s PRO 181 N 1.52 0.30 0.75 4.03 0.04 -1.26 -4.41 135.00 135.96 1k7j s PRO 181 Ca 0.34 -0.28 -0.12 0.00 0.04 0.00 0.00 61.00 60.98 1k7j s PRO 181 Cb -0.17 -1.79 0.05 0.00 0.04 0.00 0.00 34.50 32.63 1k7j s PRO 181 CO 0.14 -2.67 1.11 0.95 0.04 0.00 0.00 177.00 176.57 1k7j s THR 182 N -3.65 3.08 -0.06 1.26 -4.23 -1.26 -0.94 115.64 109.84 1k7j s THR 182 Ca 0.72 0.40 -0.25 0.00 -1.18 0.00 0.00 61.69 61.39 1k7j s THR 182 Cb -0.06 -2.85 -0.03 0.00 1.34 0.00 0.00 72.50 70.90 1k7j s THR 182 CO 0.53 -0.41 0.78 -0.89 -0.54 0.00 0.00 174.62 174.09 1k7j s THR 183 N -2.65 4.99 -0.24 3.99 2.01 -0.03 -3.96 115.64 119.74 1k7j s THR 183 Ca 0.64 1.61 -0.09 0.00 0.31 0.00 0.00 61.69 64.16 1k7j s THR 183 Cb -0.20 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.16 1k7j s THR 183 CO 0.51 0.21 0.11 -0.69 -0.69 0.00 0.00 174.62 174.07 1k7j s VAL 184 N 0.98 4.76 -0.13 3.82 1.01 0.11 -1.27 120.40 129.68 1k7j s VAL 184 Ca 0.41 -0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.39 1k7j s VAL 184 Cb -0.18 -3.22 0.01 0.00 0.00 0.00 0.00 36.38 32.98 1k7j s VAL 184 CO 0.20 0.34 -0.22 -0.63 0.00 0.00 0.00 175.10 174.79 1k7j s ILE 185 N 1.38 2.13 -0.25 2.22 -1.09 -0.34 -0.23 121.20 125.02 1k7j s ILE 185 Ca 0.06 -0.97 -0.20 0.00 -2.23 0.00 0.00 60.65 57.31 1k7j s ILE 185 Cb -0.15 -1.84 -0.02 0.00 -1.58 0.00 0.00 42.46 38.87 1k7j s ILE 185 CO 0.05 0.55 0.61 -0.62 -1.23 0.00 0.00 174.94 174.30 1k7j s ASP 186 N 0.71 6.57 0.00 3.58 -1.08 0.25 -0.59 116.67 126.11 1k7j s ASP 186 Ca -0.09 0.70 0.19 0.00 -0.52 0.00 0.00 52.55 52.82 1k7j s ASP 186 Cb -0.16 -2.33 0.35 0.00 -1.46 0.00 0.00 42.92 39.32 1k7j s ASP 186 CO 0.01 -0.34 1.29 0.18 0.52 0.00 0.00 175.17 176.82 1k7j n LEU 187 N 5.59 3.14 -4.77 -1.34 4.77 -0.66 -1.46 117.00 122.27 1k7j n LEU 187 Ca -0.01 -1.51 -0.31 0.00 -0.03 0.00 0.00 56.01 54.15 1k7j n LEU 187 Cb 0.49 -0.21 0.08 0.00 -2.33 0.00 0.00 43.42 41.46 1k7j n LEU 187 CO 0.43 0.68 0.71 0.42 -1.33 0.00 0.00 177.39 178.29 1k7j s THR 188 N -1.31 3.35 -2.05 -5.08 -4.23 -1.24 -3.19 115.64 101.89 1k7j s THR 188 Ca 0.32 0.46 0.00 0.00 -1.18 0.00 0.00 61.69 61.29 1k7j s THR 188 Cb 0.19 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 71.06 1k7j s THR 188 CO 0.26 -0.55 0.00 0.47 -0.54 0.00 0.00 174.62 174.26 1k7j n ASP 189 N -3.36 -5.31 -2.43 3.99 8.00 -1.26 -2.31 116.55 113.88 1k7j n ASP 189 Ca 0.09 0.41 -0.09 0.00 0.71 0.00 0.00 54.79 55.91 1k7j n ASP 189 Cb 0.53 -4.67 -0.01 0.00 -0.02 0.00 0.00 41.12 36.96 1k7j n ASP 189 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1k7j n ASP 190 N -1.38 -3.13 -3.78 -2.24 8.00 -1.19 -4.89 116.55 107.93 1k7j n ASP 190 Ca -0.21 0.27 -0.29 0.00 0.71 0.00 0.00 54.79 55.27 1k7j n ASP 190 Cb 0.66 -2.70 -0.13 0.00 -0.02 0.00 0.00 41.12 38.92 1k7j n ASP 190 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1k7j s THR 191 N -2.44 1.82 0.15 -3.53 2.01 -0.98 -5.08 115.64 107.60 1k7j s THR 191 Ca 0.00 -2.92 -0.33 0.00 0.31 0.00 0.00 61.69 58.76 1k7j s THR 191 Cb 0.00 -2.26 -0.12 0.00 0.01 0.00 0.00 72.50 70.13 1k7j s THR 191 CO 0.00 -0.89 1.70 -2.65 -0.69 0.00 0.00 174.62 172.09 1k7j n PRO 192 N 3.26 2.49 -4.56 4.92 -0.02 -1.26 -4.65 135.00 135.19 1k7j n PRO 192 Ca 0.09 0.90 -0.23 0.00 -2.02 0.00 0.00 63.50 62.24 1k7j n PRO 192 Cb 0.34 -2.73 -0.16 0.00 -0.02 0.00 0.00 33.50 30.93 1k7j n PRO 192 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1k7j s VAL 193 N 1.60 1.07 -0.44 -1.45 1.01 -0.53 -4.95 120.40 116.71 1k7j s VAL 193 Ca 0.79 -0.48 -0.27 0.00 0.00 0.00 0.00 61.98 62.02 1k7j s VAL 193 Cb -0.58 -0.96 0.03 0.00 0.00 0.00 0.00 36.38 34.87 1k7j s VAL 193 CO 0.37 0.33 1.04 -0.69 0.00 0.00 0.00 175.10 176.14 1k7j s VAL 194 N 0.40 4.38 -0.01 2.92 1.01 -1.26 -0.59 120.40 127.24 1k7j s VAL 194 Ca -0.09 1.14 -0.02 0.00 0.00 0.00 0.00 61.98 63.02 1k7j s VAL 194 Cb -0.13 -4.49 -0.27 0.00 0.00 0.00 0.00 36.38 31.49 1k7j s VAL 194 CO 0.02 -0.83 0.79 0.58 0.00 0.00 0.00 175.10 175.66 1k7j h VAL 195 N 6.07 1.07 -2.62 2.92 2.07 -0.98 -3.47 116.25 121.31 1k7j h VAL 195 Ca -0.23 -2.74 -0.11 0.00 0.82 0.00 0.00 66.70 64.44 1k7j h VAL 195 Cb 1.07 2.70 -0.26 0.00 -1.52 0.00 0.00 31.29 33.27 1k7j h VAL 195 CO 1.07 0.79 -0.27 -0.60 0.02 0.00 0.00 177.57 178.58 1k7j s ARG 196 N -2.61 0.43 -0.32 1.57 3.52 -1.06 -4.93 118.95 115.54 1k7j s ARG 196 Ca -0.10 0.78 -0.19 0.00 -0.13 0.00 0.00 55.73 56.10 1k7j s ARG 196 Cb 0.07 0.03 -0.01 0.00 -1.56 0.00 0.00 34.95 33.48 1k7j s ARG 196 CO 0.84 -0.14 0.55 -2.00 -0.81 0.00 0.00 175.30 173.74 1k7j s GLU 197 N 1.23 3.78 0.00 5.12 2.12 -1.26 -0.71 118.70 128.97 1k7j s GLU 197 Ca -0.08 0.05 0.00 0.00 0.36 0.00 0.00 54.97 55.30 1k7j s GLU 197 Cb -0.07 -3.76 0.00 0.00 0.26 0.00 0.00 34.13 30.56 1k7j s GLU 197 CO -0.11 -0.58 0.00 0.41 -0.54 0.00 0.00 175.26 174.44 1k7j n GLY 198 N 4.63 5.42 0.19 -1.50 0.00 -1.25 -4.88 105.19 107.80 1k7j n GLY 198 Ca -0.03 -1.28 -0.06 0.00 0.00 0.00 0.00 46.02 44.65 1k7j n GLY 198 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1k7j h VAL 199 N 0.00 1.02 -3.88 1.61 2.07 -1.25 -3.43 116.25 112.40 1k7j h VAL 199 Ca 0.00 -0.18 -0.52 0.00 0.82 0.00 0.00 66.70 66.83 1k7j h VAL 199 Cb 0.00 0.47 0.06 0.00 -1.52 0.00 0.00 31.29 30.29 1k7j h VAL 199 CO 0.00 0.09 0.59 -0.83 0.02 0.00 0.00 177.57 177.44 1k7j s GLY 200 N -2.70 3.00 0.18 2.17 0.00 -1.06 -4.94 107.32 103.97 1k7j s GLY 200 Ca -0.13 1.15 -0.31 0.00 0.00 0.00 0.00 44.72 45.43 1k7j s GLY 200 CO 0.73 1.77 1.54 -0.35 0.00 0.00 0.00 173.10 176.79 1k7j s ASP 201 N -0.65 6.60 0.32 1.64 2.15 -1.26 -4.71 116.67 120.75 1k7j s ASP 201 Ca 0.49 2.63 0.21 0.00 0.43 0.00 0.00 52.55 56.32 1k7j s ASP 201 Cb -0.37 -2.60 0.17 0.00 -0.30 0.00 0.00 42.92 39.82 1k7j s ASP 201 CO 0.49 -0.80 1.37 -0.37 -0.17 0.00 0.00 175.17 175.68 1k7j h VAL 202 N 3.92 0.16 -0.91 1.11 -1.51 -1.93 -3.39 116.25 113.70 1k7j h VAL 202 Ca -0.43 -1.24 0.20 0.00 -1.23 0.00 0.00 66.70 63.99 1k7j h VAL 202 Cb 1.21 1.92 -0.11 0.00 -2.13 0.00 0.00 31.29 32.17 1k7j h VAL 202 CO 0.88 0.09 0.46 0.11 -1.23 0.00 0.00 177.57 177.88 1k7j h LYS 203 N 0.00 0.52 0.00 5.19 1.57 -1.91 -0.76 116.57 121.18 1k7j h LYS 203 Ca -0.01 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1k7j h LYS 203 Cb 1.10 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1k7j h LYS 203 CO 0.01 0.34 0.00 -1.35 -0.57 0.00 0.00 179.45 177.89 1k7j h PRO 204 N 0.53 0.00 -0.01 3.15 0.11 -2.01 -1.17 132.00 132.61 1k7j h PRO 204 Ca 0.55 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.66 1k7j h PRO 204 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1k7j h PRO 204 CO -0.46 0.00 -0.27 1.19 -0.21 0.00 0.00 178.00 178.25 1k7j n PHE 205 N -2.45 0.00 -0.96 0.65 3.72 -0.33 -5.07 117.46 113.02 1k7j n PHE 205 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1k7j n PHE 205 Cb 0.07 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.61 1k7j n PHE 205 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99