#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gnj h LYS 4 N 0.00 0.08 -4.49 -0.41 1.57 -1.96 -3.41 116.57 107.95 1gnj h LYS 4 Ca 0.00 -0.01 -0.58 0.00 -1.87 0.00 0.00 60.65 58.19 1gnj h LYS 4 Cb 0.00 -0.02 -0.37 0.00 0.08 0.00 0.00 32.23 31.93 1gnj h LYS 4 CO 0.00 0.09 -0.82 0.45 -0.57 0.00 0.00 179.45 178.60 1gnj s SER 5 N -5.29 2.78 0.06 0.86 0.15 -1.26 -4.41 113.70 106.60 1gnj s SER 5 Ca -0.13 -0.57 -0.26 0.00 0.70 0.00 0.00 55.95 55.68 1gnj s SER 5 Cb 0.06 -1.09 -0.17 0.00 -1.71 0.00 0.00 66.02 63.11 1gnj s SER 5 CO 0.67 -0.11 1.58 -0.33 1.20 0.00 0.00 173.24 176.25 1gnj h GLU 6 N 8.07 -0.28 -0.32 5.44 5.08 -1.79 -2.11 114.58 128.67 1gnj h GLU 6 Ca -0.32 0.02 0.07 0.00 -1.00 0.00 0.00 59.36 58.12 1gnj h GLU 6 Cb 1.12 0.06 -0.07 0.00 0.50 0.00 0.00 28.75 30.37 1gnj h GLU 6 CO 0.48 -0.11 -0.12 -0.39 -1.00 0.00 0.00 179.01 177.87 1gnj h VAL 7 N -0.40 0.59 -0.59 3.13 -1.51 -1.85 -0.44 116.25 115.18 1gnj h VAL 7 Ca -0.03 0.00 0.09 0.00 -1.23 0.00 0.00 66.70 65.53 1gnj h VAL 7 Cb 0.31 0.59 -0.07 0.00 -2.13 0.00 0.00 31.29 29.99 1gnj h VAL 7 CO 0.05 0.00 0.22 0.00 -1.23 0.00 0.00 177.57 176.61 1gnj h ALA 8 N 1.22 0.76 0.45 5.19 0.00 -1.81 -0.73 119.26 124.33 1gnj h ALA 8 Ca 0.16 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.13 1gnj h ALA 8 Cb 0.30 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1gnj h ALA 8 CO -0.36 -0.20 -0.22 1.25 0.00 0.00 0.00 179.25 179.72 1gnj h HIS 9 N 0.40 -0.57 -0.71 0.00 6.17 -0.51 -0.54 115.15 119.39 1gnj h HIS 9 Ca 0.30 -0.01 0.01 0.00 0.71 0.00 0.00 60.37 61.38 1gnj h HIS 9 Cb 0.36 0.19 -0.04 0.00 2.52 0.00 0.00 27.41 30.44 1gnj h HIS 9 CO -0.17 -0.35 0.46 0.00 0.71 0.00 0.00 177.93 178.58 1gnj h ARG 10 N -0.61 0.91 -0.30 5.26 2.47 -0.91 -1.29 114.38 119.91 1gnj h ARG 10 Ca -0.06 -0.05 0.02 0.00 -1.26 0.00 0.00 59.98 58.63 1gnj h ARG 10 Cb 0.47 -0.20 -0.03 0.00 -1.65 0.00 0.00 29.97 28.56 1gnj h ARG 10 CO 0.10 0.60 0.14 0.35 0.56 0.00 0.00 179.97 181.72 1gnj h PHE 11 N 0.94 0.25 0.10 3.04 3.57 -1.02 -1.89 116.94 121.92 1gnj h PHE 11 Ca 0.26 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.77 1gnj h PHE 11 Cb -0.08 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 38.59 1gnj h PHE 11 CO -0.03 0.13 -0.05 0.87 -2.23 0.00 0.00 178.31 177.01 1gnj h LYS 12 N 0.29 -0.12 -0.84 1.11 1.57 -0.41 -0.62 116.57 117.54 1gnj h LYS 12 Ca 0.12 0.01 -0.15 0.00 -1.87 0.00 0.00 60.65 58.76 1gnj h LYS 12 Cb 0.05 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 32.30 1gnj h LYS 12 CO -0.10 -0.07 0.19 -0.40 -0.57 0.00 0.00 179.45 178.50 1gnj n ASP 13 N -5.14 3.87 0.00 0.86 5.68 -0.55 -3.99 116.55 117.28 1gnj n ASP 13 Ca -0.08 -2.81 0.00 0.00 -0.50 0.00 0.00 54.79 51.40 1gnj n ASP 13 Cb 0.08 -0.67 0.00 0.00 -1.14 0.00 0.00 41.12 39.39 1gnj n ASP 13 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 1gnj n LEU 14 N -0.02 1.60 0.00 -2.12 7.94 -0.72 -4.79 117.00 118.89 1gnj n LEU 14 Ca 0.28 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.18 1gnj n LEU 14 Cb 1.05 0.00 0.00 0.00 0.53 0.00 0.00 43.42 45.00 1gnj n LEU 14 CO 0.30 0.23 0.00 0.61 -1.11 0.00 0.00 177.39 177.42 1gnj n GLY 15 N 2.78 1.37 0.23 -3.96 0.00 -0.25 -4.45 105.19 100.90 1gnj n GLY 15 Ca 0.00 -1.60 -0.08 0.00 0.00 0.00 0.00 46.02 44.34 1gnj n GLY 15 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1gnj h GLU 16 N 0.00 -0.17 -0.18 1.61 4.81 -1.94 -0.12 114.58 118.58 1gnj h GLU 16 Ca 0.00 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.29 1gnj h GLU 16 Cb 0.00 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.36 1gnj h GLU 16 CO 0.00 -0.12 -0.18 0.93 -0.73 0.00 0.00 179.01 178.92 1gnj h GLU 17 N -0.18 -0.19 -0.55 1.92 4.39 -1.98 0.22 114.58 118.21 1gnj h GLU 17 Ca 0.14 0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.75 1gnj h GLU 17 Cb 0.39 0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 1gnj h GLU 17 CO -0.35 -0.13 -0.06 -0.91 -1.16 0.00 0.00 179.01 176.40 1gnj h ASN 18 N -0.20 1.01 0.17 1.42 2.35 -1.74 -2.50 115.58 116.09 1gnj h ASN 18 Ca 0.11 -0.33 0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1gnj h ASN 18 Cb 0.37 -0.27 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 1gnj h ASN 18 CO -0.30 1.10 -0.26 0.15 -1.65 0.00 0.00 177.43 176.47 1gnj h PHE 19 N 0.90 -0.71 -0.96 1.19 3.57 -0.54 -0.54 116.94 119.85 1gnj h PHE 19 Ca 0.15 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.71 1gnj h PHE 19 Cb 0.62 0.29 -0.06 0.00 2.79 0.00 0.00 35.95 39.59 1gnj h PHE 19 CO 0.04 -0.37 0.62 0.87 -2.23 0.00 0.00 178.31 177.24 1gnj h LYS 20 N -0.50 1.14 -0.57 1.11 1.57 -0.94 -0.46 116.57 117.92 1gnj h LYS 20 Ca 0.02 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.67 1gnj h LYS 20 Cb 0.50 -0.26 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1gnj h LYS 20 CO -0.12 0.75 0.14 0.00 -0.57 0.00 0.00 179.45 179.65 1gnj h ALA 21 N 1.41 0.75 -0.32 3.86 0.00 -1.07 -1.96 119.26 121.93 1gnj h ALA 21 Ca 0.39 -0.22 -0.14 0.00 0.00 0.00 0.00 54.91 54.93 1gnj h ALA 21 Cb 0.06 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1gnj h ALA 21 CO -0.14 0.46 -0.36 -0.07 0.00 0.00 0.00 179.25 179.13 1gnj h LEU 22 N 0.82 0.87 -0.81 0.00 3.38 -0.64 -1.76 115.31 117.18 1gnj h LEU 22 Ca 0.18 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 1gnj h LEU 22 Cb 0.35 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 1gnj h LEU 22 CO 0.00 1.18 0.41 0.58 0.09 0.00 0.00 178.44 180.70 1gnj h VAL 23 N 0.59 1.25 0.39 1.22 2.07 -1.06 0.11 116.25 120.82 1gnj h VAL 23 Ca 0.04 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 1gnj h VAL 23 Cb 0.95 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1gnj h VAL 23 CO 0.09 0.29 -0.29 0.25 0.02 0.00 0.00 177.57 177.93 1gnj h LEU 24 N 1.14 -0.75 -0.63 2.57 5.85 -1.21 -0.95 115.31 121.34 1gnj h LEU 24 Ca 0.28 0.05 0.09 0.00 0.84 0.00 0.00 57.88 59.14 1gnj h LEU 24 Cb 0.09 0.23 -0.07 0.00 0.37 0.00 0.00 40.66 41.29 1gnj h LEU 24 CO -0.04 -0.44 0.27 0.40 -0.34 0.00 0.00 178.44 178.29 1gnj h ILE 25 N -0.67 0.81 -0.31 4.05 2.04 -0.75 0.95 117.51 123.62 1gnj h ILE 25 Ca -0.04 -0.16 0.02 0.00 1.00 0.00 0.00 64.86 65.68 1gnj h ILE 25 Cb 0.58 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1gnj h ILE 25 CO 0.01 0.09 0.15 0.00 0.00 0.00 0.00 178.15 178.39 1gnj h ALA 26 N 1.41 0.37 -0.32 1.87 0.00 -0.56 -0.22 119.26 121.82 1gnj h ALA 26 Ca 0.31 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.18 1gnj h ALA 26 Cb 0.35 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 1gnj h ALA 26 CO -0.28 -0.24 -0.03 0.74 0.00 0.00 0.00 179.25 179.44 1gnj h PHE 27 N 0.31 0.64 -0.48 0.00 0.04 -0.37 -2.62 116.94 114.46 1gnj h PHE 27 Ca 0.13 -0.12 0.06 0.00 2.80 0.00 0.00 57.97 60.83 1gnj h PHE 27 Cb 0.06 -0.16 -0.03 0.00 2.20 0.00 0.00 35.95 38.02 1gnj h PHE 27 CO -0.10 0.73 0.32 0.00 -0.60 0.00 0.00 178.31 178.66 1gnj h ALA 28 N 0.82 1.91 0.00 2.45 0.00 -0.57 0.90 119.26 124.77 1gnj h ALA 28 Ca 0.09 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1gnj h ALA 28 Cb 0.50 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1gnj h ALA 28 CO 0.02 0.01 -0.31 1.96 0.00 0.00 0.00 179.25 180.94 1gnj h GLN 29 N 0.43 0.00 0.00 0.00 4.20 -0.67 -3.19 115.11 115.88 1gnj h GLN 29 Ca 0.21 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.54 1gnj h GLN 29 Cb 0.28 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.00 1gnj h GLN 29 CO -0.05 0.31 -2.08 0.66 -0.67 0.00 0.00 178.83 176.99 1gnj n TYR 30 N -3.45 0.36 -2.65 2.96 4.01 -0.76 -4.59 117.16 113.05 1gnj n TYR 30 Ca 0.00 0.16 -0.43 0.00 -0.16 0.00 0.00 57.90 57.47 1gnj n TYR 30 Cb 0.48 -1.03 0.01 0.00 -0.31 0.00 0.00 39.34 38.49 1gnj n TYR 30 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1gnj n LEU 31 N -4.32 6.59 0.26 7.72 4.32 0.24 -4.79 117.00 127.02 1gnj n LEU 31 Ca -0.46 -4.93 0.18 0.00 -0.02 0.00 0.00 56.01 50.77 1gnj n LEU 31 Cb 0.81 -1.37 0.86 0.00 -1.62 0.00 0.00 43.42 42.10 1gnj n LEU 31 CO 0.09 1.55 1.02 1.56 -1.22 0.00 0.00 177.39 180.39 1gnj h GLN 32 N 5.55 0.00 0.00 3.23 4.20 -1.78 -3.12 115.11 123.19 1gnj h GLN 32 Ca 0.31 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.80 1gnj h GLN 32 Cb 0.61 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.35 1gnj h GLN 32 CO 1.49 0.00 -1.77 1.04 -0.67 0.00 0.00 178.83 178.92 1gnj n GLN 33 N -2.79 0.64 -1.84 1.46 1.13 -1.26 -4.96 117.38 109.76 1gnj n GLN 33 Ca -0.01 0.13 -0.36 0.00 -1.94 0.00 0.00 57.00 54.81 1gnj n GLN 33 Cb 0.14 -1.70 0.05 0.00 0.11 0.00 0.00 30.24 28.85 1gnj n GLN 33 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1gnj s PRO 35 N -3.43 1.85 0.13 0.00 0.04 -1.26 -4.93 135.00 127.40 1gnj s PRO 35 Ca 0.79 0.56 -0.22 0.00 0.04 0.00 0.00 61.00 62.17 1gnj s PRO 35 Cb -0.33 -1.90 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 1gnj s PRO 35 CO 0.37 -1.77 1.68 0.35 0.04 0.00 0.00 177.00 177.67 1gnj h PHE 36 N -1.19 -0.31 -0.36 0.56 3.57 -1.99 -2.68 116.94 114.54 1gnj h PHE 36 Ca -0.48 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.12 1gnj h PHE 36 Cb 1.28 0.16 -0.02 0.00 2.79 0.00 0.00 35.95 40.16 1gnj h PHE 36 CO 0.42 -0.19 0.25 0.93 -2.23 0.00 0.00 178.31 177.50 1gnj h GLU 37 N -0.15 0.13 -0.49 1.11 3.07 -1.99 -1.22 114.58 115.04 1gnj h GLU 37 Ca 0.09 -0.01 -0.10 0.00 -0.50 0.00 0.00 59.36 58.84 1gnj h GLU 37 Cb 0.28 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 28.14 1gnj h GLU 37 CO -0.22 0.08 -0.08 -0.44 -1.40 0.00 0.00 179.01 176.95 1gnj h ASP 38 N 0.13 0.92 -0.37 1.42 5.19 -1.86 -2.46 116.42 119.38 1gnj h ASP 38 Ca 0.17 -0.35 -0.15 0.00 -0.62 0.00 0.00 57.03 56.08 1gnj h ASP 38 Cb 0.50 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.75 1gnj h ASP 38 CO -0.02 1.05 -0.35 0.45 -3.12 0.00 0.00 179.24 177.25 1gnj h HIS 39 N 0.77 1.08 -1.00 4.55 3.86 -1.17 -3.00 115.15 120.24 1gnj h HIS 39 Ca 0.13 -0.31 0.03 0.00 -1.16 0.00 0.00 60.37 59.06 1gnj h HIS 39 Cb 0.63 -0.23 -0.06 0.00 1.06 0.00 0.00 27.41 28.81 1gnj h HIS 39 CO 0.05 1.12 0.66 0.28 0.86 0.00 0.00 177.93 180.90 1gnj h VAL 40 N 0.76 1.20 -0.41 2.45 2.07 -1.19 -0.51 116.25 120.63 1gnj h VAL 40 Ca 0.07 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1gnj h VAL 40 Cb 0.93 -0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.47 1gnj h VAL 40 CO 0.09 0.24 0.26 0.50 0.02 0.00 0.00 177.57 178.67 1gnj h LYS 41 N 1.30 0.54 -0.43 1.57 3.64 -1.33 -1.78 116.57 120.08 1gnj h LYS 41 Ca 0.39 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.73 1gnj h LYS 41 Cb -0.05 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.63 1gnj h LYS 41 CO -0.11 0.38 0.28 -0.07 -2.27 0.00 0.00 179.45 177.66 1gnj h LEU 42 N 0.54 0.49 -0.17 5.20 3.38 -1.18 -0.72 115.31 122.85 1gnj h LEU 42 Ca 0.15 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.15 1gnj h LEU 42 Cb -0.03 -0.12 -0.06 0.00 0.09 0.00 0.00 40.66 40.54 1gnj h LEU 42 CO -0.03 0.36 -0.19 0.58 0.09 0.00 0.00 178.44 179.25 1gnj h VAL 43 N 0.58 0.50 -0.24 1.22 2.07 -0.78 0.45 116.25 120.04 1gnj h VAL 43 Ca 0.16 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.73 1gnj h VAL 43 Cb -0.06 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.14 1gnj h VAL 43 CO -0.03 0.00 -0.15 0.78 0.02 0.00 0.00 177.57 178.19 1gnj h ASN 44 N -0.23 -0.49 -0.98 0.57 2.35 -0.78 0.12 115.58 116.14 1gnj h ASN 44 Ca 0.11 0.11 0.02 0.00 -0.55 0.00 0.00 56.30 55.99 1gnj h ASN 44 Cb 0.39 0.26 -0.05 0.00 0.05 0.00 0.00 38.32 38.97 1gnj h ASN 44 CO -0.30 -0.19 0.65 -0.33 -1.65 0.00 0.00 177.43 175.60 1gnj h GLU 45 N -0.13 1.25 -0.15 0.81 5.08 -0.45 -0.07 114.58 120.92 1gnj h GLU 45 Ca 0.13 -0.08 -0.17 0.00 -1.00 0.00 0.00 59.36 58.25 1gnj h GLU 45 Cb 0.33 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1gnj h GLU 45 CO -0.32 0.83 -0.61 0.28 -1.00 0.00 0.00 179.01 178.19 1gnj h VAL 46 N 1.29 1.34 -0.51 3.13 2.07 -0.32 -1.39 116.25 121.87 1gnj h VAL 46 Ca 0.37 -1.90 -0.06 0.00 0.82 0.00 0.00 66.70 65.92 1gnj h VAL 46 Cb -0.10 1.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 1gnj h VAL 46 CO -0.10 0.58 0.07 0.74 0.02 0.00 0.00 177.57 178.89 1gnj h THR 47 N 0.37 1.25 -0.22 2.57 2.02 -0.36 -0.50 112.91 118.05 1gnj h THR 47 Ca -0.01 -0.96 -0.00 0.00 0.77 0.00 0.00 66.41 66.21 1gnj h THR 47 Cb 1.16 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1gnj h THR 47 CO 0.11 0.34 0.12 -0.08 0.37 0.00 0.00 175.52 176.38 1gnj h GLU 48 N 0.73 0.31 -0.17 6.66 4.57 -0.93 -1.67 114.58 124.09 1gnj h GLU 48 Ca 0.15 -0.04 0.05 0.00 -1.18 0.00 0.00 59.36 58.35 1gnj h GLU 48 Cb 0.42 -0.06 -0.07 0.00 -0.16 0.00 0.00 28.75 28.88 1gnj h GLU 48 CO 0.01 0.29 -0.30 0.35 -1.18 0.00 0.00 179.01 178.18 1gnj h PHE 49 N 0.24 -0.84 -0.67 0.92 3.57 -0.90 -2.02 116.94 117.24 1gnj h PHE 49 Ca 0.08 0.04 0.14 0.00 3.53 0.00 0.00 57.97 61.75 1gnj h PHE 49 Cb 0.07 0.39 -0.10 0.00 2.79 0.00 0.00 35.95 39.11 1gnj h PHE 49 CO -0.04 -0.38 0.15 0.00 -2.23 0.00 0.00 178.31 175.82 1gnj h ALA 50 N 0.51 0.84 -0.53 2.41 0.00 -0.76 -0.30 119.26 121.43 1gnj h ALA 50 Ca 0.11 0.15 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1gnj h ALA 50 Cb 0.53 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1gnj h ALA 50 CO -0.37 -0.32 0.26 0.87 0.00 0.00 0.00 179.25 179.70 1gnj h LYS 51 N 0.27 0.74 -0.92 0.00 1.57 -0.67 0.60 116.57 118.17 1gnj h LYS 51 Ca 0.37 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 1gnj h LYS 51 Cb 0.59 -0.15 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 1gnj h LYS 51 CO -0.46 0.57 0.53 1.15 -0.57 0.00 0.00 179.45 180.67 1gnj h THR 52 N 0.75 1.26 0.00 -0.16 2.02 -0.39 -1.52 112.91 114.86 1gnj h THR 52 Ca 0.19 -0.60 -0.15 0.00 0.77 0.00 0.00 66.41 66.62 1gnj h THR 52 Cb 0.07 -0.01 -0.02 0.00 -1.74 0.00 0.00 68.15 66.44 1gnj h THR 52 CO -0.03 0.28 -0.73 0.00 0.37 0.00 0.00 175.52 175.41 1gnj h VAL 54 N 0.00 1.24 0.01 0.00 2.07 -0.35 -2.86 116.25 116.37 1gnj h VAL 54 Ca -0.01 -1.12 -0.20 0.00 0.82 0.00 0.00 66.70 66.20 1gnj h VAL 54 Cb 1.40 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.38 1gnj h VAL 54 CO 0.10 0.36 -0.90 0.00 0.02 0.00 0.00 177.57 177.14 1gnj h ALA 55 N 1.37 0.50 -1.97 1.67 0.00 -1.18 -3.42 119.26 116.23 1gnj h ALA 55 Ca 0.08 -0.76 -0.33 0.00 0.00 0.00 0.00 54.91 53.90 1gnj h ALA 55 Cb 0.56 -0.09 -0.31 0.00 0.00 0.00 0.00 17.79 17.95 1gnj h ALA 55 CO 0.04 0.98 -0.65 0.34 0.00 0.00 0.00 179.25 179.96 1gnj s ASP 56 N -6.89 1.18 0.63 0.00 -1.08 -0.96 -5.00 116.67 104.55 1gnj s ASP 56 Ca -0.02 -1.13 0.23 0.00 -0.52 0.00 0.00 52.55 51.10 1gnj s ASP 56 Cb 0.10 0.64 1.04 0.00 -1.46 0.00 0.00 42.92 43.25 1gnj s ASP 56 CO 0.82 -0.31 1.54 -0.33 0.52 0.00 0.00 175.17 177.41 1gnj h GLU 57 N 7.61 0.00 -0.25 4.34 5.08 -1.77 0.41 114.58 130.00 1gnj h GLU 57 Ca -0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1gnj h GLU 57 Cb 1.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1gnj h GLU 57 CO 0.25 0.00 0.00 0.43 -1.00 0.00 0.00 179.01 178.69 1gnj n SER 58 N -3.16 2.79 -4.74 1.42 7.64 -1.26 -4.53 113.62 111.78 1gnj n SER 58 Ca 0.09 -1.89 -0.36 0.00 1.01 0.00 0.00 58.87 57.72 1gnj n SER 58 Cb 0.94 -0.16 0.05 0.00 -1.01 0.00 0.00 64.21 64.04 1gnj n SER 58 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1gnj s ALA 59 N -1.69 2.46 0.09 -0.43 0.00 0.14 -4.87 121.76 117.47 1gnj s ALA 59 Ca 0.35 1.08 -0.36 0.00 0.00 0.00 0.00 51.96 53.04 1gnj s ALA 59 Cb 0.21 -3.49 -0.18 0.00 0.00 0.00 0.00 23.12 19.66 1gnj s ALA 59 CO 0.30 -1.36 1.11 0.39 0.00 0.00 0.00 175.76 176.20 1gnj n GLU 60 N -1.76 0.62 0.00 0.00 4.71 -1.26 -1.25 120.64 121.69 1gnj n GLU 60 Ca 0.14 0.22 0.00 0.00 -0.01 0.00 0.00 57.16 57.52 1gnj n GLU 60 Cb 0.49 -1.71 0.00 0.00 -1.01 0.00 0.00 31.44 29.21 1gnj n GLU 60 CO 0.00 0.00 0.00 0.09 0.09 0.00 0.00 177.13 177.31 1gnj n ASN 61 N 1.97 0.00 0.33 1.62 3.02 -1.26 -4.80 115.26 116.13 1gnj n ASN 61 Ca 0.18 0.00 0.18 0.00 -0.03 0.00 0.00 54.58 54.91 1gnj n ASN 61 Cb 0.17 -0.12 0.99 0.00 -0.61 0.00 0.00 39.78 40.20 1gnj n ASN 61 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1gnj h ASP 63 N 0.00 0.20 -2.95 0.00 3.04 -1.77 -3.37 116.42 111.57 1gnj h ASP 63 Ca 0.00 -0.14 -0.56 0.00 -3.24 0.00 0.00 57.03 53.09 1gnj h ASP 63 Cb 0.35 -0.06 0.20 0.00 -1.04 0.00 0.00 39.33 38.78 1gnj h ASP 63 CO 0.00 0.86 -0.73 0.29 -2.04 0.00 0.00 179.24 177.62 1gnj n LYS 64 N -3.75 0.09 -2.42 4.15 4.76 0.25 -4.77 118.16 116.47 1gnj n LYS 64 Ca -0.02 0.07 -0.26 0.00 -2.87 0.00 0.00 58.31 55.22 1gnj n LYS 64 Cb 0.71 -1.63 0.03 0.00 -1.84 0.00 0.00 35.03 32.30 1gnj n LYS 64 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1gnj s SER 65 N -1.47 5.56 0.10 4.39 1.04 -1.26 -4.50 113.70 117.55 1gnj s SER 65 Ca 0.59 0.66 -0.19 0.00 0.48 0.00 0.00 55.95 57.48 1gnj s SER 65 Cb -0.31 -1.65 -0.08 0.00 0.10 0.00 0.00 66.02 64.09 1gnj s SER 65 CO 0.65 -1.07 1.63 -0.07 0.98 0.00 0.00 173.24 175.36 1gnj h LEU 66 N -0.16 0.31 -0.73 2.42 3.38 -1.97 -0.51 115.31 118.04 1gnj h LEU 66 Ca -0.45 -0.17 0.07 0.00 0.09 0.00 0.00 57.88 57.41 1gnj h LEU 66 Cb 1.26 -0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.87 1gnj h LEU 66 CO 0.60 0.39 0.42 0.45 0.09 0.00 0.00 178.44 180.39 1gnj h HIS 67 N 0.20 0.77 0.04 1.13 3.86 -1.98 0.45 115.15 119.63 1gnj h HIS 67 Ca 0.07 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.31 1gnj h HIS 67 Cb 0.18 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.42 1gnj h HIS 67 CO -0.01 0.36 -0.02 1.15 0.86 0.00 0.00 177.93 180.27 1gnj h THR 68 N 0.76 1.05 0.42 2.45 2.02 -1.90 0.79 112.91 118.50 1gnj h THR 68 Ca 0.33 -0.32 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 1gnj h THR 68 Cb 0.21 1.27 -0.00 0.00 -1.74 0.00 0.00 68.15 67.88 1gnj h THR 68 CO -0.19 0.08 -0.26 -0.07 0.37 0.00 0.00 175.52 175.45 1gnj h LEU 69 N -0.20 -0.64 -0.53 2.58 3.38 -0.56 -1.80 115.31 117.55 1gnj h LEU 69 Ca -0.01 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.10 1gnj h LEU 69 Cb 0.18 0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.04 1gnj h LEU 69 CO 0.01 -0.41 0.09 0.15 0.09 0.00 0.00 178.44 178.37 1gnj h PHE 70 N -0.65 0.14 -0.70 1.13 3.57 -0.05 -2.20 116.94 118.18 1gnj h PHE 70 Ca -0.05 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 1gnj h PHE 70 Cb 0.53 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.25 1gnj h PHE 70 CO -0.09 -0.03 0.32 0.78 -2.23 0.00 0.00 178.31 177.06 1gnj h GLY 71 N 0.22 1.08 0.82 2.40 0.00 -0.71 -2.44 103.07 104.44 1gnj h GLY 71 Ca 0.27 -0.53 -0.01 0.00 0.00 0.00 0.00 47.33 47.06 1gnj h GLY 71 CO -0.36 0.50 -0.08 -0.55 0.00 0.00 0.00 176.54 176.05 1gnj h ASP 72 N 1.00 -0.19 -0.17 0.19 3.32 -0.71 -1.82 116.42 118.04 1gnj h ASP 72 Ca 0.24 -0.14 0.04 0.00 0.02 0.00 0.00 57.03 57.19 1gnj h ASP 72 Cb 0.12 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1gnj h ASP 72 CO -0.03 0.03 0.12 0.11 -1.72 0.00 0.00 179.24 177.76 1gnj h LYS 73 N -0.41 0.03 -0.23 3.56 1.79 -1.41 -0.84 116.57 119.06 1gnj h LYS 73 Ca -0.02 -0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.37 1gnj h LYS 73 Cb 0.32 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.96 1gnj h LYS 73 CO 0.04 0.02 -0.14 1.25 -1.08 0.00 0.00 179.45 179.54 1gnj h LEU 74 N 0.03 0.51 0.00 2.94 5.85 -1.20 -2.33 115.31 121.12 1gnj h LEU 74 Ca 0.08 -0.43 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1gnj h LEU 74 Cb 0.29 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1gnj h LEU 74 CO -0.00 0.83 0.00 0.00 -0.34 0.00 0.00 178.44 178.93 1gnj h THR 76 N 0.00 1.37 -0.87 0.00 2.02 -1.01 -3.46 112.91 110.97 1gnj h THR 76 Ca 0.00 -2.49 -0.83 0.00 0.77 0.00 0.00 66.41 63.86 1gnj h THR 76 Cb 0.00 3.05 -0.00 0.00 -1.74 0.00 0.00 68.15 69.46 1gnj h THR 76 CO 0.00 0.71 0.88 0.52 0.37 0.00 0.00 175.52 178.00 1gnj n VAL 77 N -4.08 0.05 -0.09 3.16 0.31 -0.95 -4.85 118.33 111.88 1gnj n VAL 77 Ca -0.17 -0.02 -0.12 0.00 -0.01 0.00 0.00 64.34 64.02 1gnj n VAL 77 Cb 0.84 -0.65 -0.04 0.00 -0.91 0.00 0.00 33.84 33.08 1gnj n VAL 77 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1gnj h ALA 78 N 6.46 0.37 0.00 3.52 0.00 -1.91 -2.95 119.26 124.75 1gnj h ALA 78 Ca -0.36 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.24 1gnj h ALA 78 Cb 1.37 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1gnj h ALA 78 CO 1.00 0.22 0.00 0.25 0.00 0.00 0.00 179.25 180.73 1gnj n THR 79 N -4.48 0.00 -0.20 0.00 -2.24 -1.26 -4.32 114.28 101.78 1gnj n THR 79 Ca -0.04 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.69 1gnj n THR 79 Cb 0.34 -0.45 -0.05 0.00 -2.10 0.00 0.00 70.33 68.08 1gnj n THR 79 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1gnj n LEU 80 N -0.85 -0.50 -0.20 3.22 7.94 -1.12 0.22 117.00 125.71 1gnj n LEU 80 Ca 0.14 1.33 -0.07 0.00 -1.11 0.00 0.00 56.01 56.30 1gnj n LEU 80 Cb 0.06 -0.36 0.02 0.00 0.53 0.00 0.00 43.42 43.68 1gnj n LEU 80 CO 0.10 -0.93 1.01 -0.09 -1.11 0.00 0.00 177.39 176.38 1gnj h ARG 81 N 0.00 0.80 -0.24 1.96 2.43 -1.81 0.91 114.38 118.44 1gnj h ARG 81 Ca 0.08 -0.12 -0.07 0.00 -0.81 0.00 0.00 59.98 59.06 1gnj h ARG 81 Cb 0.19 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1gnj h ARG 81 CO -0.44 0.65 -0.15 0.93 -1.51 0.00 0.00 179.97 179.45 1gnj h GLU 82 N 0.75 0.40 0.06 0.20 5.08 -1.52 -0.32 114.58 119.23 1gnj h GLU 82 Ca 0.19 -0.11 -0.31 0.00 -1.00 0.00 0.00 59.36 58.13 1gnj h GLU 82 Cb 0.12 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 1gnj h GLU 82 CO -0.02 0.55 -1.72 2.41 -1.00 0.00 0.00 179.01 179.22 1gnj n THR 83 N -4.21 1.64 -0.17 1.13 -1.04 0.59 -4.57 114.28 107.65 1gnj n THR 83 Ca 0.00 -0.35 0.05 0.00 -2.04 0.00 0.00 64.05 61.71 1gnj n THR 83 Cb 0.32 -1.87 0.14 0.00 -1.82 0.00 0.00 70.33 67.09 1gnj n THR 83 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1gnj n TYR 84 N -3.96 0.41 0.00 -1.42 4.01 0.31 -5.04 117.16 111.48 1gnj n TYR 84 Ca -0.34 -0.51 0.00 0.00 -0.16 0.00 0.00 57.90 56.89 1gnj n TYR 84 Cb 0.87 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.86 1gnj n TYR 84 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gnj n GLY 85 N 0.36 1.40 0.34 2.72 0.00 -0.13 -1.94 105.19 107.93 1gnj n GLY 85 Ca 0.10 0.70 0.20 0.00 0.00 0.00 0.00 46.02 47.02 1gnj n GLY 85 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1gnj h GLU 86 N 0.00 0.43 -0.95 1.61 5.08 -1.91 -1.80 114.58 117.04 1gnj h GLU 86 Ca 0.00 -0.03 0.17 0.00 -1.00 0.00 0.00 59.36 58.50 1gnj h GLU 86 Cb 0.00 -0.10 -0.08 0.00 0.50 0.00 0.00 28.75 29.07 1gnj h GLU 86 CO 0.00 0.28 0.60 1.98 -1.00 0.00 0.00 179.01 180.87 1gnj h MET 87 N 0.44 0.69 -0.36 2.33 4.05 -1.74 0.78 114.93 121.11 1gnj h MET 87 Ca 0.69 -0.04 0.05 0.00 -0.28 0.00 0.00 59.70 60.11 1gnj h MET 87 Cb 1.44 -0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 32.07 1gnj h MET 87 CO -0.55 0.46 0.24 0.00 0.23 0.00 0.00 176.91 177.29 1gnj h ALA 88 N 1.60 1.98 0.00 0.39 0.00 -1.54 0.75 119.26 122.45 1gnj h ALA 88 Ca 0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.40 1gnj h ALA 88 Cb 0.83 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1gnj h ALA 88 CO -0.26 -0.04 0.00 -0.44 0.00 0.00 0.00 179.25 178.50 1gnj h ASP 89 N 0.28 0.00 -0.73 0.00 3.32 -0.97 -2.08 116.42 116.24 1gnj h ASP 89 Ca 0.15 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.15 1gnj h ASP 89 Cb 0.26 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.78 1gnj h ASP 89 CO -0.03 0.00 0.24 0.00 -1.72 0.00 0.00 179.24 177.73 1gnj n ALA 92 N -1.77 2.54 -2.70 0.00 0.00 -1.01 -4.89 120.51 112.69 1gnj n ALA 92 Ca -0.02 -0.34 -0.23 0.00 0.00 0.00 0.00 53.44 52.86 1gnj n ALA 92 Cb 0.20 -1.14 -0.07 0.00 0.00 0.00 0.00 19.45 18.44 1gnj n ALA 92 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1gnj s LYS 93 N -1.86 2.48 0.50 0.00 1.02 0.47 -5.11 119.74 117.25 1gnj s LYS 93 Ca 0.26 -1.26 -0.21 0.00 0.02 0.00 0.00 55.97 54.78 1gnj s LYS 93 Cb 0.13 -2.30 -0.07 0.00 -0.52 0.00 0.00 37.83 35.07 1gnj s LYS 93 CO 0.21 0.39 1.11 -0.65 -0.92 0.00 0.00 175.35 175.49 1gnj s GLN 94 N -3.58 3.60 0.08 1.68 -1.52 -1.26 -4.49 119.66 114.17 1gnj s GLN 94 Ca 0.31 1.59 -0.16 0.00 -1.95 0.00 0.00 55.36 55.14 1gnj s GLN 94 Cb -0.07 -2.15 -0.04 0.00 -0.22 0.00 0.00 33.01 30.53 1gnj s GLN 94 CO 0.21 -0.64 0.90 -1.91 -0.25 0.00 0.00 175.29 173.60 1gnj n GLU 95 N -0.95 -0.23 -0.04 2.91 4.07 -1.26 -0.26 120.64 124.88 1gnj n GLU 95 Ca 0.10 0.88 -0.10 0.00 -0.06 0.00 0.00 57.16 57.97 1gnj n GLU 95 Cb 0.50 -1.30 -0.04 0.00 -0.06 0.00 0.00 31.44 30.55 1gnj n GLU 95 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1gnj h PRO 96 N 0.00 -0.38 -0.39 5.31 0.13 -2.00 -0.98 132.00 133.69 1gnj h PRO 96 Ca 0.08 0.03 -0.08 0.00 -0.87 0.00 0.00 66.00 65.16 1gnj h PRO 96 Cb 0.22 0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.41 1gnj h PRO 96 CO -0.50 -0.25 -0.07 0.93 -0.23 0.00 0.00 178.00 177.88 1gnj h GLU 97 N -0.39 0.67 0.09 0.86 3.07 -1.68 -2.48 114.58 114.72 1gnj h GLU 97 Ca 0.11 -0.19 0.02 0.00 -0.50 0.00 0.00 59.36 58.80 1gnj h GLU 97 Cb 0.58 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.38 1gnj h GLU 97 CO -0.43 0.74 -0.25 -0.09 -1.40 0.00 0.00 179.01 177.57 1gnj h ARG 98 N 0.62 -0.42 -0.22 2.33 2.43 0.31 0.70 114.38 120.12 1gnj h ARG 98 Ca 0.11 0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.34 1gnj h ARG 98 Cb 0.50 0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 1gnj h ARG 98 CO 0.03 -0.28 0.06 -0.97 -1.51 0.00 0.00 179.97 177.29 1gnj h ASN 99 N -0.44 0.04 -0.84 -3.80 -1.24 -1.15 -1.29 115.58 106.87 1gnj h ASN 99 Ca 0.04 0.03 0.09 0.00 0.71 0.00 0.00 56.30 57.17 1gnj h ASN 99 Cb 0.48 0.03 -0.07 0.00 0.73 0.00 0.00 38.32 39.49 1gnj h ASN 99 CO -0.16 0.05 0.49 -0.08 -1.29 0.00 0.00 177.43 176.44 1gnj h GLU 100 N 0.15 0.80 -0.54 6.67 4.57 -0.95 -1.55 114.58 123.73 1gnj h GLU 100 Ca 0.10 -0.05 -0.06 0.00 -1.18 0.00 0.00 59.36 58.17 1gnj h GLU 100 Cb 0.09 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 28.47 1gnj h GLU 100 CO -0.12 0.53 0.09 0.00 -1.18 0.00 0.00 179.01 178.33 1gnj h PHE 102 N 0.82 0.73 -0.93 0.00 0.04 -0.26 -3.06 116.94 114.28 1gnj h PHE 102 Ca 0.17 -0.10 0.10 0.00 2.80 0.00 0.00 57.97 60.94 1gnj h PHE 102 Cb 0.37 -0.20 -0.07 0.00 2.20 0.00 0.00 35.95 38.25 1gnj h PHE 102 CO 0.02 0.71 0.60 -0.07 -0.60 0.00 0.00 178.31 178.97 1gnj h LEU 103 N 0.54 0.85 -0.16 1.54 4.07 -1.32 -1.75 115.31 119.08 1gnj h LEU 103 Ca 0.13 0.03 0.00 0.00 0.08 0.00 0.00 57.88 58.12 1gnj h LEU 103 Cb 0.37 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 41.97 1gnj h LEU 103 CO 0.01 0.49 0.00 0.00 -1.08 0.00 0.00 178.44 177.85 1gnj n GLN 104 N -4.55 0.06 -0.27 1.13 6.02 -1.16 -2.61 117.38 116.00 1gnj n GLN 104 Ca 0.16 0.25 0.07 0.00 -0.01 0.00 0.00 57.00 57.47 1gnj n GLN 104 Cb 0.32 -1.60 0.19 0.00 1.02 0.00 0.00 30.24 30.17 1gnj n GLN 104 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1gnj n HIS 105 N -1.71 0.59 -2.80 1.08 8.25 -0.67 -4.89 115.22 115.08 1gnj n HIS 105 Ca 0.04 -0.72 -0.43 0.00 -0.26 0.00 0.00 57.72 56.35 1gnj n HIS 105 Cb 0.22 -0.17 -0.04 0.00 1.12 0.00 0.00 29.99 31.12 1gnj n HIS 105 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1gnj s LYS 106 N -2.03 3.14 -0.39 -0.41 2.20 -1.07 -4.97 119.74 116.20 1gnj s LYS 106 Ca 0.31 -0.74 -0.28 0.00 -0.36 0.00 0.00 55.97 54.89 1gnj s LYS 106 Cb 0.23 -4.24 -0.02 0.00 -1.51 0.00 0.00 37.83 32.28 1gnj s LYS 106 CO 0.10 -1.88 1.84 0.34 -0.36 0.00 0.00 175.35 175.39 1gnj s ASP 107 N 3.70 5.69 0.00 1.43 2.15 -1.26 -4.86 116.67 123.53 1gnj s ASP 107 Ca 0.25 1.10 0.00 0.00 0.43 0.00 0.00 52.55 54.33 1gnj s ASP 107 Cb -0.15 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.95 1gnj s ASP 107 CO 0.11 -1.90 0.84 -0.90 -0.17 0.00 0.00 175.17 173.15 1gnj n ASP 108 N 11.06 0.00 -2.84 -0.34 3.85 -1.26 -4.03 116.55 122.98 1gnj n ASP 108 Ca 0.23 0.36 -0.00 0.00 -0.71 0.00 0.00 54.79 54.66 1gnj n ASP 108 Cb 0.48 -0.36 0.01 0.00 -1.35 0.00 0.00 41.12 39.91 1gnj n ASP 108 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1gnj s ASN 109 N -2.69 -0.72 1.15 -1.12 6.03 -1.26 -4.75 114.94 111.58 1gnj s ASN 109 Ca 0.00 -0.54 -0.18 0.00 -1.03 0.00 0.00 52.86 51.11 1gnj s ASN 109 Cb 0.00 0.93 0.26 0.00 -3.03 0.00 0.00 41.25 39.41 1gnj s ASN 109 CO 0.00 -0.06 1.10 -0.81 -2.03 0.00 0.00 177.10 175.30 1gnj n PRO 110 N 3.49 -2.38 -3.45 3.55 -0.04 -1.26 -5.00 135.00 129.92 1gnj n PRO 110 Ca 0.10 -1.74 -0.37 0.00 -0.04 0.00 0.00 63.50 61.45 1gnj n PRO 110 Cb 0.61 -1.44 -0.04 0.00 -0.04 0.00 0.00 33.50 32.59 1gnj n PRO 110 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1gnj n ASN 111 N -4.42 4.74 -4.69 3.54 5.03 -1.26 -5.02 115.26 113.18 1gnj n ASN 111 Ca 0.15 -3.22 -0.26 0.00 0.87 0.00 0.00 54.58 52.11 1gnj n ASN 111 Cb 0.55 -1.08 -0.07 0.00 -1.02 0.00 0.00 39.78 38.16 1gnj n ASN 111 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1gnj s LEU 112 N -1.82 3.42 0.62 3.41 1.43 -1.26 -5.09 118.68 119.39 1gnj s LEU 112 Ca 0.31 -0.35 -0.18 0.00 -1.03 0.00 0.00 54.13 52.88 1gnj s LEU 112 Cb -0.02 -2.05 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 1gnj s LEU 112 CO -0.06 0.08 1.22 -2.84 0.23 0.00 0.00 176.35 174.98 1gnj s PRO 113 N -3.03 2.77 -0.04 1.29 0.02 -1.26 -4.92 135.00 129.83 1gnj s PRO 113 Ca 0.28 1.84 -0.30 0.00 0.02 0.00 0.00 61.00 62.84 1gnj s PRO 113 Cb -0.09 -1.90 -0.05 0.00 0.02 0.00 0.00 34.50 32.48 1gnj s PRO 113 CO 0.20 -1.36 1.42 -0.98 -0.33 0.00 0.00 177.00 175.94 1gnj s ARG 114 N -3.46 4.25 0.01 5.54 1.70 -1.26 -4.93 118.95 120.81 1gnj s ARG 114 Ca 0.77 1.95 -0.32 0.00 -0.47 0.00 0.00 55.73 57.66 1gnj s ARG 114 Cb -0.31 -3.69 -0.11 0.00 -0.57 0.00 0.00 34.95 30.27 1gnj s ARG 114 CO 0.36 -0.65 1.87 -0.11 -1.08 0.00 0.00 175.30 175.69 1gnj n LEU 115 N 5.95 3.74 -4.89 -1.89 7.94 -1.26 -4.98 117.00 121.61 1gnj n LEU 115 Ca 0.14 0.97 -0.35 0.00 -1.11 0.00 0.00 56.01 55.66 1gnj n LEU 115 Cb 0.44 -1.46 -0.05 0.00 0.53 0.00 0.00 43.42 42.88 1gnj n LEU 115 CO 0.59 0.04 -0.11 0.68 -1.11 0.00 0.00 177.39 177.48 1gnj s VAL 116 N 3.60 5.38 -0.31 1.96 -7.23 -1.26 -5.06 120.40 117.48 1gnj s VAL 116 Ca 0.88 0.07 -0.23 0.00 -1.81 0.00 0.00 61.98 60.89 1gnj s VAL 116 Cb -0.58 -3.53 0.00 0.00 0.56 0.00 0.00 36.38 32.84 1gnj s VAL 116 CO 0.45 0.40 0.76 -0.60 -0.31 0.00 0.00 175.10 175.80 1gnj s ARG 117 N -1.67 3.93 1.15 4.82 3.52 -1.26 -5.05 118.95 124.38 1gnj s ARG 117 Ca 0.25 0.52 -0.18 0.00 -0.13 0.00 0.00 55.73 56.18 1gnj s ARG 117 Cb -0.13 -3.74 0.27 0.00 -1.56 0.00 0.00 34.95 29.79 1gnj s ARG 117 CO 0.15 -0.68 1.15 -1.25 -0.81 0.00 0.00 175.30 173.85 1gnj s PRO 118 N 2.92 -0.80 0.47 5.12 0.04 -1.26 -5.00 135.00 136.49 1gnj s PRO 118 Ca 0.31 -0.11 -0.22 0.00 0.04 0.00 0.00 61.00 61.02 1gnj s PRO 118 Cb -0.14 -1.65 -0.08 0.00 0.04 0.00 0.00 34.50 32.67 1gnj s PRO 118 CO 0.13 -3.42 1.11 -1.21 0.04 0.00 0.00 177.00 173.64 1gnj s GLU 119 N -5.48 3.77 0.24 4.56 0.41 -1.26 -4.85 118.70 116.09 1gnj s GLU 119 Ca 0.71 1.60 -0.07 0.00 -0.41 0.00 0.00 54.97 56.80 1gnj s GLU 119 Cb -0.09 -2.29 0.41 0.00 -1.78 0.00 0.00 34.13 30.38 1gnj s GLU 119 CO 0.55 -0.50 1.65 0.28 -0.49 0.00 0.00 175.26 176.76 1gnj h VAL 120 N 1.74 0.42 -0.02 2.63 2.07 -1.99 -0.12 116.25 120.98 1gnj h VAL 120 Ca -0.49 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 66.99 1gnj h VAL 120 Cb 1.24 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.25 1gnj h VAL 120 CO 0.60 0.03 -0.06 0.44 0.02 0.00 0.00 177.57 178.60 1gnj h ASP 121 N 0.15 -0.16 -0.53 0.57 3.45 -1.98 0.27 116.42 118.18 1gnj h ASP 121 Ca 0.39 0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.87 1gnj h ASP 121 Cb 0.68 0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 39.50 1gnj h ASP 121 CO -0.59 -0.08 0.28 -0.37 -1.57 0.00 0.00 179.24 176.90 1gnj h VAL 122 N -0.09 1.19 0.20 -1.35 -1.51 -1.67 0.14 116.25 113.15 1gnj h VAL 122 Ca 0.03 -0.50 -0.00 0.00 -1.23 0.00 0.00 66.70 65.00 1gnj h VAL 122 Cb 0.13 0.55 -0.01 0.00 -2.13 0.00 0.00 31.29 29.82 1gnj h VAL 122 CO -0.07 0.20 -0.16 0.24 -1.23 0.00 0.00 177.57 176.55 1gnj h MET 123 N 0.71 -0.36 -0.62 5.19 2.86 -0.72 0.15 114.93 122.14 1gnj h MET 123 Ca 0.18 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 57.88 1gnj h MET 123 Cb 0.08 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.78 1gnj h MET 123 CO -0.03 -0.24 0.38 0.00 1.06 0.00 0.00 176.91 178.08 1gnj h THR 125 N 0.73 1.19 -0.62 0.00 2.02 -0.50 -1.63 112.91 114.10 1gnj h THR 125 Ca 0.26 -0.57 -0.04 0.00 0.77 0.00 0.00 66.41 66.83 1gnj h THR 125 Cb 0.05 0.95 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 1gnj h THR 125 CO -0.12 0.20 0.23 0.00 0.37 0.00 0.00 175.52 176.20 1gnj h ALA 126 N 0.97 1.23 -0.23 6.16 0.00 -0.25 -1.45 119.26 125.69 1gnj h ALA 126 Ca 0.11 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.87 1gnj h ALA 126 Cb 0.19 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1gnj h ALA 126 CO -0.01 0.56 0.07 0.35 0.00 0.00 0.00 179.25 180.22 1gnj h PHE 127 N 0.90 0.12 -0.10 0.00 3.57 0.54 -2.73 116.94 119.23 1gnj h PHE 127 Ca 0.21 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.66 1gnj h PHE 127 Cb 0.21 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 38.93 1gnj h PHE 127 CO 0.01 0.05 -0.17 0.45 -2.23 0.00 0.00 178.31 176.43 1gnj h HIS 128 N 0.17 0.37 -0.41 0.41 3.86 -1.05 -0.85 115.15 117.64 1gnj h HIS 128 Ca 0.10 -0.13 0.12 0.00 -1.16 0.00 0.00 60.37 59.30 1gnj h HIS 128 Cb 0.08 -0.07 -0.02 0.00 1.06 0.00 0.00 27.41 28.46 1gnj h HIS 128 CO -0.13 0.77 0.36 -0.44 0.86 0.00 0.00 177.93 179.35 1gnj h ASP 129 N -0.13 0.00 0.00 2.45 3.45 -1.23 -3.35 116.42 117.61 1gnj h ASP 129 Ca 0.01 0.00 -0.13 0.00 0.43 0.00 0.00 57.03 57.34 1gnj h ASP 129 Cb 0.74 0.00 -0.13 0.00 -0.56 0.00 0.00 39.33 39.38 1gnj h ASP 129 CO 0.04 0.00 -0.21 -3.20 -1.57 0.00 0.00 179.24 174.30 1gnj n ASN 130 N -4.04 -1.91 -0.32 6.45 2.85 -1.04 -5.04 115.26 112.21 1gnj n ASN 130 Ca 0.07 -2.40 0.03 0.00 -0.11 0.00 0.00 54.58 52.18 1gnj n ASN 130 Cb 0.55 1.17 0.09 0.00 1.24 0.00 0.00 39.78 42.84 1gnj n ASN 130 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 1gnj n GLU 131 N 1.49 -0.12 0.15 1.20 2.13 -0.33 -2.32 120.64 122.85 1gnj n GLU 131 Ca 0.04 1.34 -0.06 0.00 0.66 0.00 0.00 57.16 59.14 1gnj n GLU 131 Cb 0.68 -1.99 -0.03 0.00 0.27 0.00 0.00 31.44 30.37 1gnj n GLU 131 CO 0.00 0.00 0.00 1.49 -0.41 0.00 0.00 177.13 178.21 1gnj h GLU 132 N 0.00 -0.37 -0.31 5.31 4.81 -1.94 -2.36 114.58 119.72 1gnj h GLU 132 Ca 0.38 0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.72 1gnj h GLU 132 Cb 0.59 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.04 1gnj h GLU 132 CO -0.88 -0.25 0.30 1.79 -0.73 0.00 0.00 179.01 179.25 1gnj h THR 133 N -0.40 0.51 -0.02 0.32 1.35 -1.96 0.14 112.91 112.85 1gnj h THR 133 Ca -0.04 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.82 1gnj h THR 133 Cb 0.30 0.77 -0.00 0.00 -1.73 0.00 0.00 68.15 67.48 1gnj h THR 133 CO 0.07 0.00 0.00 0.15 -0.25 0.00 0.00 175.52 175.49 1gnj h PHE 134 N 0.00 0.03 -0.02 4.73 3.57 -1.34 -0.26 116.94 123.64 1gnj h PHE 134 Ca 0.15 -0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.47 1gnj h PHE 134 Cb 0.75 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 1gnj h PHE 134 CO 0.00 0.24 -0.75 -0.07 -2.23 0.00 0.00 178.31 175.51 1gnj h LEU 135 N -0.19 0.21 -0.27 0.59 3.38 -0.59 -3.18 115.31 115.25 1gnj h LEU 135 Ca 0.01 -0.15 -0.18 0.00 0.09 0.00 0.00 57.88 57.64 1gnj h LEU 135 Cb 0.23 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1gnj h LEU 135 CO 0.00 0.88 -0.55 0.11 0.09 0.00 0.00 178.44 178.97 1gnj h LYS 136 N 0.11 0.86 -0.78 1.13 1.79 -0.75 -1.69 116.57 117.24 1gnj h LYS 136 Ca -0.02 -0.56 -0.05 0.00 -2.18 0.00 0.00 60.65 57.84 1gnj h LYS 136 Cb 1.32 0.07 -0.03 0.00 -1.58 0.00 0.00 32.23 32.00 1gnj h LYS 136 CO 0.11 1.19 0.29 -0.22 -1.08 0.00 0.00 179.45 179.74 1gnj h LYS 137 N 0.64 1.17 -0.19 3.15 3.64 -1.09 0.96 116.57 124.85 1gnj h LYS 137 Ca 0.01 -0.22 -0.17 0.00 -1.27 0.00 0.00 60.65 58.99 1gnj h LYS 137 Cb 1.16 -0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.79 1gnj h LYS 137 CO 0.12 0.96 -0.59 1.88 -2.27 0.00 0.00 179.45 179.55 1gnj h TYR 138 N 1.14 0.79 -0.80 1.91 0.05 -1.55 -0.35 116.97 118.17 1gnj h TYR 138 Ca 0.26 -0.30 -0.00 0.00 0.05 0.00 0.00 58.73 58.74 1gnj h TYR 138 Cb 0.24 -0.14 -0.04 0.00 1.01 0.00 0.00 36.73 37.80 1gnj h TYR 138 CO 0.02 1.06 0.48 1.25 -1.05 0.00 0.00 178.16 179.92 1gnj h LEU 139 N 0.47 0.95 -0.06 3.88 5.85 -0.89 0.24 115.31 125.74 1gnj h LEU 139 Ca -0.00 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 1gnj h LEU 139 Cb 1.16 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 1gnj h LEU 139 CO 0.12 0.72 0.01 0.22 -0.34 0.00 0.00 178.44 179.17 1gnj h TYR 140 N 1.09 0.11 -0.86 1.25 3.20 -0.42 -0.99 116.97 120.35 1gnj h TYR 140 Ca 0.29 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.13 1gnj h TYR 140 Cb -0.05 -0.03 -0.04 0.00 1.54 0.00 0.00 36.73 38.15 1gnj h TYR 140 CO 0.00 0.30 0.49 0.93 -1.64 0.00 0.00 178.16 178.24 1gnj h GLU 141 N -0.11 1.18 -0.23 1.82 4.39 -0.25 -2.07 114.58 119.31 1gnj h GLU 141 Ca 0.02 -0.13 -0.13 0.00 0.34 0.00 0.00 59.36 59.47 1gnj h GLU 141 Cb 0.25 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1gnj h GLU 141 CO 0.00 0.85 -0.35 0.82 -1.16 0.00 0.00 179.01 179.17 1gnj h ILE 142 N 1.19 1.32 -0.08 3.13 1.08 -0.50 -3.10 117.51 120.54 1gnj h ILE 142 Ca 0.30 -1.55 -0.10 0.00 -0.39 0.00 0.00 64.86 63.12 1gnj h ILE 142 Cb -0.00 1.76 -0.01 0.00 -3.07 0.00 0.00 36.82 35.50 1gnj h ILE 142 CO -0.05 0.49 -0.41 0.00 -0.69 0.00 0.00 178.15 177.49 1gnj h ALA 143 N 0.64 1.16 0.00 1.87 0.00 -1.03 -1.14 119.26 120.76 1gnj h ALA 143 Ca 0.02 -0.40 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 1gnj h ALA 143 Cb 0.94 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1gnj h ALA 143 CO 0.08 0.57 -0.29 0.07 0.00 0.00 0.00 179.25 179.68 1gnj h ARG 144 N 0.15 0.00 0.00 0.00 0.11 -1.44 -3.03 114.38 110.17 1gnj h ARG 144 Ca 0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.09 1gnj h ARG 144 Cb 0.79 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.87 1gnj h ARG 144 CO 0.06 0.29 -0.76 0.00 0.10 0.00 0.00 179.97 179.66 1gnj h ARG 145 N 0.00 0.00 -2.35 0.08 3.08 -1.37 -3.39 114.38 110.42 1gnj h ARG 145 Ca -0.00 0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.46 1gnj h ARG 145 Cb 0.97 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.61 1gnj h ARG 145 CO 0.04 0.00 -0.81 0.72 -1.07 0.00 0.00 179.97 178.85 1gnj n HIS 146 N -2.74 1.55 0.25 3.04 8.25 -0.47 -4.81 115.22 120.29 1gnj n HIS 146 Ca 0.01 -3.86 0.13 0.00 -0.26 0.00 0.00 57.72 53.74 1gnj n HIS 146 Cb 0.54 -0.36 0.63 0.00 1.12 0.00 0.00 29.99 31.92 1gnj n HIS 146 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1gnj h PRO 147 N 4.65 0.00 -0.02 -0.41 0.13 -1.75 -2.77 132.00 131.83 1gnj h PRO 147 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1gnj h PRO 147 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 1gnj h PRO 147 CO 0.62 0.00 -0.02 0.66 -0.23 0.00 0.00 178.00 179.02 1gnj n TYR 148 N -2.37 0.00 -2.09 1.56 4.02 -1.26 -4.94 117.16 112.08 1gnj n TYR 148 Ca -0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.46 1gnj n TYR 148 Cb 0.11 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.40 1gnj n TYR 148 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 1gnj s PHE 149 N -1.30 2.40 -0.28 -0.72 5.36 -1.05 -4.88 117.98 117.51 1gnj s PHE 149 Ca 0.17 0.47 -0.36 0.00 -0.96 0.00 0.00 56.93 56.25 1gnj s PHE 149 Cb 0.13 -3.82 -0.12 0.00 -0.34 0.00 0.00 43.02 38.87 1gnj s PHE 149 CO 0.20 -3.27 2.05 0.98 -1.46 0.00 0.00 175.22 173.72 1gnj n TYR 150 N 6.24 1.84 -0.28 10.12 9.36 -1.26 -4.84 117.16 138.34 1gnj n TYR 150 Ca 0.15 0.26 -0.02 0.00 3.32 0.00 0.00 57.90 61.61 1gnj n TYR 150 Cb 0.43 -2.55 0.04 0.00 -0.63 0.00 0.00 39.34 36.63 1gnj n TYR 150 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1gnj h ALA 151 N 10.86 0.15 -0.56 2.98 0.00 -1.97 0.56 119.26 131.29 1gnj h ALA 151 Ca -0.35 0.23 0.13 0.00 0.00 0.00 0.00 54.91 54.92 1gnj h ALA 151 Cb 1.31 0.81 -0.03 0.00 0.00 0.00 0.00 17.79 19.88 1gnj h ALA 151 CO 0.99 -0.60 0.39 -1.35 0.00 0.00 0.00 179.25 178.68 1gnj h PRO 152 N -0.08 0.15 0.01 0.00 0.11 -1.95 -0.27 132.00 129.98 1gnj h PRO 152 Ca 0.30 -0.01 -0.20 0.00 0.11 0.00 0.00 66.00 66.21 1gnj h PRO 152 Cb 0.58 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.63 1gnj h PRO 152 CO -0.81 0.10 -0.91 1.49 -0.21 0.00 0.00 178.00 177.66 1gnj h GLU 153 N 0.16 0.08 -0.26 1.05 4.81 -1.27 -1.98 114.58 117.16 1gnj h GLU 153 Ca 0.26 -0.10 -0.08 0.00 -0.13 0.00 0.00 59.36 59.32 1gnj h GLU 153 Cb 0.83 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.23 1gnj h GLU 153 CO -0.04 0.93 -0.16 1.25 -0.73 0.00 0.00 179.01 180.26 1gnj h LEU 154 N 0.04 0.44 -0.28 1.64 5.85 -0.49 -2.08 115.31 120.44 1gnj h LEU 154 Ca -0.03 -0.12 -0.10 0.00 0.84 0.00 0.00 57.88 58.47 1gnj h LEU 154 Cb 1.58 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.49 1gnj h LEU 154 CO 0.13 0.63 -0.21 0.25 -0.34 0.00 0.00 178.44 178.90 1gnj h LEU 155 N 0.42 0.66 -1.58 2.25 5.85 -0.97 -2.52 115.31 119.43 1gnj h LEU 155 Ca 0.07 -0.45 -0.01 0.00 0.84 0.00 0.00 57.88 58.34 1gnj h LEU 155 Cb 0.53 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1gnj h LEU 155 CO 0.03 0.97 0.15 -0.26 -0.34 0.00 0.00 178.44 178.99 1gnj h PHE 156 N 0.36 0.42 -0.16 1.25 0.05 -0.88 -2.27 116.94 115.71 1gnj h PHE 156 Ca 0.05 -0.00 -0.08 0.00 3.82 0.00 0.00 57.97 61.76 1gnj h PHE 156 Cb 0.75 -0.14 -0.00 0.00 2.00 0.00 0.00 35.95 38.56 1gnj h PHE 156 CO 0.07 0.32 -0.19 0.74 -0.18 0.00 0.00 178.31 179.06 1gnj h PHE 157 N 0.44 0.51 -0.66 -0.55 0.04 -1.29 -3.09 116.94 112.34 1gnj h PHE 157 Ca 0.11 -0.16 0.11 0.00 2.80 0.00 0.00 57.97 60.84 1gnj h PHE 157 Cb 0.05 -0.10 -0.08 0.00 2.20 0.00 0.00 35.95 38.01 1gnj h PHE 157 CO 0.00 0.81 0.23 0.00 -0.60 0.00 0.00 178.31 178.75 1gnj h ALA 158 N 0.61 0.86 -0.63 2.45 0.00 -0.97 -0.34 119.26 121.22 1gnj h ALA 158 Ca 0.02 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1gnj h ALA 158 Cb 0.74 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1gnj h ALA 158 CO 0.05 -0.22 0.35 0.87 0.00 0.00 0.00 179.25 180.29 1gnj h LYS 159 N 0.38 0.87 -0.18 0.00 1.57 -1.45 0.10 116.57 117.86 1gnj h LYS 159 Ca 0.34 -0.09 -0.11 0.00 -1.87 0.00 0.00 60.65 58.93 1gnj h LYS 159 Cb 0.48 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1gnj h LYS 159 CO -0.36 0.63 -0.38 0.00 -0.57 0.00 0.00 179.45 178.77 1gnj h ARG 160 N 0.88 0.38 -0.59 3.15 3.08 -1.03 -1.45 114.38 118.80 1gnj h ARG 160 Ca 0.23 -0.18 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 1gnj h ARG 160 Cb 0.01 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1gnj h ARG 160 CO -0.04 0.71 -0.02 1.88 -1.07 0.00 0.00 179.97 181.43 1gnj h TYR 161 N 0.32 1.13 -0.23 3.04 0.05 0.04 -2.33 116.97 118.99 1gnj h TYR 161 Ca 0.03 -0.20 -0.02 0.00 0.05 0.00 0.00 58.73 58.60 1gnj h TYR 161 Cb 0.81 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.25 1gnj h TYR 161 CO 0.02 1.00 0.07 -0.22 -1.05 0.00 0.00 178.16 177.98 1gnj h LYS 162 N 0.94 0.36 -0.91 4.88 3.64 -0.64 -2.26 116.57 122.58 1gnj h LYS 162 Ca 0.17 -0.08 0.10 0.00 -1.27 0.00 0.00 60.65 59.57 1gnj h LYS 162 Cb 0.56 -0.05 -0.07 0.00 -0.41 0.00 0.00 32.23 32.27 1gnj h LYS 162 CO 0.03 0.45 0.59 0.00 -2.27 0.00 0.00 179.45 178.25 1gnj h ALA 163 N 0.89 1.61 -0.32 5.00 0.00 -1.14 -0.35 119.26 124.96 1gnj h ALA 163 Ca 0.07 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1gnj h ALA 163 Cb 0.24 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1gnj h ALA 163 CO -0.00 0.20 -0.21 0.00 0.00 0.00 0.00 179.25 179.23 1gnj h ALA 164 N 1.55 1.03 -0.09 0.00 0.00 -1.06 -0.91 119.26 119.77 1gnj h ALA 164 Ca 0.43 -0.34 -0.20 0.00 0.00 0.00 0.00 54.91 54.79 1gnj h ALA 164 Cb 0.41 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 18.08 1gnj h ALA 164 CO -0.19 0.58 -0.74 0.74 0.00 0.00 0.00 179.25 179.65 1gnj h PHE 165 N 0.54 0.92 0.03 0.00 0.04 -0.64 0.13 116.94 117.96 1gnj h PHE 165 Ca 0.08 -0.44 0.02 0.00 2.80 0.00 0.00 57.97 60.44 1gnj h PHE 165 Cb 0.66 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 38.65 1gnj h PHE 165 CO 0.03 1.25 -0.14 1.15 -0.60 0.00 0.00 178.31 180.00 1gnj h THR 166 N 0.33 0.65 0.00 -1.55 2.02 -0.98 0.28 112.91 113.66 1gnj h THR 166 Ca -0.07 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 67.02 1gnj h THR 166 Cb 1.39 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1gnj h THR 166 CO 0.15 0.00 -0.43 -0.08 0.37 0.00 0.00 175.52 175.53 1gnj h GLU 167 N -0.26 0.00 0.00 6.66 4.81 -1.18 -3.33 114.58 121.29 1gnj h GLU 167 Ca 0.04 0.00 -0.20 0.00 -0.13 0.00 0.00 59.36 59.07 1gnj h GLU 167 Cb 0.30 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.64 1gnj h GLU 167 CO -0.12 0.43 -2.12 0.00 -0.73 0.00 0.00 179.01 176.47 1gnj n GLN 170 N -1.34 0.66 -1.72 0.00 -0.00 -1.25 -5.00 117.38 108.74 1gnj n GLN 170 Ca 0.10 -0.07 -0.37 0.00 -0.00 0.00 0.00 57.00 56.67 1gnj n GLN 170 Cb 0.21 -1.57 0.07 0.00 -0.00 0.00 0.00 30.24 28.96 1gnj n GLN 170 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1gnj s ALA 171 N -3.08 2.35 0.07 2.61 0.00 -0.88 -4.96 121.76 117.87 1gnj s ALA 171 Ca -0.08 1.16 -0.33 0.00 0.00 0.00 0.00 51.96 52.71 1gnj s ALA 171 Cb 0.10 -3.54 -0.19 0.00 0.00 0.00 0.00 23.12 19.50 1gnj s ALA 171 CO 0.87 -1.60 1.63 0.00 0.00 0.00 0.00 175.76 176.65 1gnj h ALA 172 N 0.46 -0.91 -2.21 0.00 0.00 -1.94 -3.21 119.26 111.45 1gnj h ALA 172 Ca -0.50 -0.20 -0.78 0.00 0.00 0.00 0.00 54.91 53.43 1gnj h ALA 172 Cb 1.33 0.36 -0.24 0.00 0.00 0.00 0.00 17.79 19.24 1gnj h ALA 172 CO 0.53 -1.01 0.81 -3.47 0.00 0.00 0.00 179.25 176.11 1gnj n ASP 173 N -5.48 5.44 -0.13 0.00 -0.08 -1.26 -4.89 116.55 110.14 1gnj n ASP 173 Ca -0.13 -3.03 -0.06 0.00 -1.51 0.00 0.00 54.79 50.05 1gnj n ASP 173 Cb 0.37 -1.45 -0.00 0.00 2.34 0.00 0.00 41.12 42.38 1gnj n ASP 173 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1gnj h LYS 174 N 6.77 -0.20 -0.15 -0.67 1.57 -1.77 -2.45 116.57 119.67 1gnj h LYS 174 Ca 0.23 0.01 0.01 0.00 -1.87 0.00 0.00 60.65 59.03 1gnj h LYS 174 Cb 0.86 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1gnj h LYS 174 CO 1.12 -0.13 0.09 0.00 -0.57 0.00 0.00 179.45 179.95 1gnj h ALA 175 N 0.91 0.18 -0.07 3.86 0.00 -1.90 -0.26 119.26 121.98 1gnj h ALA 175 Ca 0.19 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.12 1gnj h ALA 175 Cb 0.52 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1gnj h ALA 175 CO -0.55 -0.35 0.10 0.00 0.00 0.00 0.00 179.25 178.45 1gnj h ALA 176 N 1.07 1.54 0.00 0.00 0.00 -1.90 -1.81 119.26 118.17 1gnj h ALA 176 Ca 0.06 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1gnj h ALA 176 Cb -0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1gnj h ALA 176 CO -0.03 -0.13 -0.20 0.00 0.00 0.00 0.00 179.25 178.89 1gnj h LEU 178 N -0.63 -0.86 -0.84 0.00 5.85 -0.99 -3.30 115.31 114.53 1gnj h LEU 178 Ca 0.00 0.01 0.13 0.00 0.84 0.00 0.00 57.88 58.86 1gnj h LEU 178 Cb 0.20 0.22 -0.14 0.00 0.37 0.00 0.00 40.66 41.31 1gnj h LEU 178 CO 0.00 -0.55 -0.32 0.18 -0.34 0.00 0.00 178.44 177.40 1gnj n LEU 179 N -5.49 -0.53 0.08 2.25 4.32 -0.69 0.09 117.00 117.04 1gnj n LEU 179 Ca -0.14 1.47 -0.01 0.00 -0.02 0.00 0.00 56.01 57.31 1gnj n LEU 179 Cb 0.41 -0.34 0.28 0.00 -1.62 0.00 0.00 43.42 42.15 1gnj n LEU 179 CO 0.36 -1.33 0.75 1.55 -1.22 0.00 0.00 177.39 177.51 1gnj h PRO 180 N 0.00 0.30 -0.27 3.23 0.13 -1.77 -1.93 132.00 131.68 1gnj h PRO 180 Ca 0.30 -0.11 -0.10 0.00 -0.87 0.00 0.00 66.00 65.23 1gnj h PRO 180 Cb 0.51 -0.02 -0.01 0.00 0.13 0.00 0.00 31.00 31.61 1gnj h PRO 180 CO -0.84 0.55 -0.26 0.87 -0.23 0.00 0.00 178.00 178.09 1gnj h LYS 181 N 0.26 0.54 -0.21 0.86 1.57 -0.43 -2.27 116.57 116.89 1gnj h LYS 181 Ca 0.04 -0.21 -0.09 0.00 -1.87 0.00 0.00 60.65 58.52 1gnj h LYS 181 Cb 0.62 -0.03 -0.00 0.00 0.08 0.00 0.00 32.23 32.90 1gnj h LYS 181 CO 0.04 0.75 -0.24 -0.07 -0.57 0.00 0.00 179.45 179.36 1gnj h LEU 182 N 0.47 0.57 -0.97 2.94 3.38 -0.87 -1.59 115.31 119.25 1gnj h LEU 182 Ca 0.07 -0.49 0.04 0.00 0.09 0.00 0.00 57.88 57.59 1gnj h LEU 182 Cb 0.69 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 1gnj h LEU 182 CO 0.05 0.95 0.63 0.44 0.09 0.00 0.00 178.44 180.60 1gnj h ASP 183 N 0.21 1.04 -0.27 -0.43 5.19 -1.21 -0.41 116.42 120.54 1gnj h ASP 183 Ca 0.03 -0.01 -0.09 0.00 -0.62 0.00 0.00 57.03 56.35 1gnj h ASP 183 Cb 0.80 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 40.07 1gnj h ASP 183 CO 0.06 0.70 -0.18 -0.08 -3.12 0.00 0.00 179.24 176.62 1gnj h GLU 184 N 1.20 0.60 -0.79 3.56 4.81 -1.36 -2.72 114.58 119.88 1gnj h GLU 184 Ca 0.39 -0.28 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1gnj h GLU 184 Cb 0.03 -0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 1gnj h GLU 184 CO -0.13 0.87 0.53 -0.07 -0.73 0.00 0.00 179.01 179.47 1gnj h LEU 185 N 0.33 0.91 0.19 1.64 4.07 -0.78 -2.34 115.31 119.32 1gnj h LEU 185 Ca 0.05 -0.02 -0.01 0.00 0.08 0.00 0.00 57.88 57.98 1gnj h LEU 185 Cb 0.71 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.23 1gnj h LEU 185 CO 0.05 0.66 -0.09 -0.09 -1.08 0.00 0.00 178.44 177.89 1gnj h ARG 186 N 1.07 -0.24 -0.74 1.13 2.43 -0.95 -1.08 114.38 116.01 1gnj h ARG 186 Ca 0.29 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.54 1gnj h ARG 186 Cb -0.12 0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.43 1gnj h ARG 186 CO -0.06 -0.03 0.43 -0.44 -1.51 0.00 0.00 179.97 178.36 1gnj h ASP 187 N -0.42 0.66 -0.86 -3.80 3.32 -1.33 0.35 116.42 114.35 1gnj h ASP 187 Ca -0.03 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1gnj h ASP 187 Cb 0.33 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 1gnj h ASP 187 CO 0.04 0.43 0.43 -0.08 -1.72 0.00 0.00 179.24 178.34 1gnj h GLU 188 N 0.79 1.22 -0.29 3.56 4.81 -1.34 0.43 114.58 123.76 1gnj h GLU 188 Ca 0.33 -0.16 -0.13 0.00 -0.13 0.00 0.00 59.36 59.26 1gnj h GLU 188 Cb 0.18 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.32 1gnj h GLU 188 CO -0.18 0.92 -0.34 0.78 -0.73 0.00 0.00 179.01 179.46 1gnj h GLY 189 N 1.22 0.82 1.38 1.92 0.00 -0.02 0.19 103.07 108.58 1gnj h GLY 189 Ca 0.30 -0.87 -0.10 0.00 0.00 0.00 0.00 47.33 46.67 1gnj h GLY 189 CO -0.04 0.78 -0.15 0.50 0.00 0.00 0.00 176.54 177.63 1gnj h LYS 190 N 0.50 0.73 0.01 4.80 1.57 -0.07 -0.89 116.57 123.22 1gnj h LYS 190 Ca 0.04 -0.25 -0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1gnj h LYS 190 Cb 0.92 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.18 1gnj h LYS 190 CO 0.08 0.84 -0.00 0.00 -0.57 0.00 0.00 179.45 179.80 1gnj h ALA 191 N 1.18 -0.01 -0.62 3.86 0.00 0.06 -0.73 119.26 123.00 1gnj h ALA 191 Ca 0.11 -0.11 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1gnj h ALA 191 Cb 0.62 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 1gnj h ALA 191 CO 0.04 -0.39 0.34 1.03 0.00 0.00 0.00 179.25 180.27 1gnj h SER 192 N -0.24 0.49 0.07 0.00 0.87 -0.50 -1.58 113.55 112.67 1gnj h SER 192 Ca -0.00 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1gnj h SER 192 Cb 0.23 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.12 1gnj h SER 192 CO 0.00 0.32 -0.04 -1.28 -0.53 0.00 0.00 176.83 175.30 1gnj h SER 193 N 0.63 -0.11 -0.91 6.23 0.87 -0.99 -2.08 113.55 117.19 1gnj h SER 193 Ca 0.28 0.01 0.02 0.00 -1.23 0.00 0.00 61.79 60.87 1gnj h SER 193 Cb 0.18 0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 62.12 1gnj h SER 193 CO -0.18 -0.07 0.60 0.00 -0.53 0.00 0.00 176.83 176.64 1gnj h ALA 194 N 0.82 1.17 -0.31 6.23 0.00 -0.67 -2.23 119.26 124.26 1gnj h ALA 194 Ca -0.00 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1gnj h ALA 194 Cb 0.10 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1gnj h ALA 194 CO 0.00 0.51 0.10 0.87 0.00 0.00 0.00 179.25 180.73 1gnj h LYS 195 N 1.19 0.48 -0.41 0.00 1.57 -1.19 0.16 116.57 118.38 1gnj h LYS 195 Ca 0.34 -0.10 0.09 0.00 -1.87 0.00 0.00 60.65 59.11 1gnj h LYS 195 Cb -0.08 -0.07 -0.09 0.00 0.08 0.00 0.00 32.23 32.07 1gnj h LYS 195 CO -0.09 0.52 -0.23 0.37 -0.57 0.00 0.00 179.45 179.45 1gnj h GLN 196 N 0.35 -0.15 -0.41 3.15 5.75 -0.87 0.19 115.11 123.12 1gnj h GLN 196 Ca 0.10 0.01 -0.13 0.00 -0.15 0.00 0.00 58.65 58.49 1gnj h GLN 196 Cb 0.24 0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.81 1gnj h GLN 196 CO -0.00 -0.10 -0.25 0.00 -2.65 0.00 0.00 178.83 175.83 1gnj h ARG 197 N -0.16 0.85 0.22 1.69 3.08 -1.21 -3.10 114.38 115.75 1gnj h ARG 197 Ca 0.20 -0.36 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 1gnj h ARG 197 Cb 0.46 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1gnj h ARG 197 CO -0.50 1.00 -0.16 1.25 -1.07 0.00 0.00 179.97 180.49 1gnj h LEU 198 N 0.73 -0.40 -1.05 3.04 5.85 0.48 -1.50 115.31 122.45 1gnj h LEU 198 Ca 0.09 0.03 0.05 0.00 0.84 0.00 0.00 57.88 58.89 1gnj h LEU 198 Cb 0.79 0.13 -0.06 0.00 0.37 0.00 0.00 40.66 41.89 1gnj h LEU 198 CO 0.07 -0.25 0.63 0.11 -0.34 0.00 0.00 178.44 178.66 1gnj h LYS 199 N -0.38 1.16 -0.20 1.25 1.57 -0.68 -0.92 116.57 118.37 1gnj h LYS 199 Ca -0.01 -0.07 -0.16 0.00 -1.87 0.00 0.00 60.65 58.54 1gnj h LYS 199 Cb 0.33 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1gnj h LYS 199 CO 0.00 0.77 -0.52 0.00 -0.57 0.00 0.00 179.45 179.12 1gnj h ALA 201 N 0.99 0.72 -0.21 0.00 0.00 -0.77 -2.32 119.26 117.67 1gnj h ALA 201 Ca 0.01 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1gnj h ALA 201 Cb 1.06 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1gnj h ALA 201 CO 0.10 0.51 0.12 0.77 0.00 0.00 0.00 179.25 180.75 1gnj h SER 202 N 0.81 0.26 -0.84 0.00 0.02 -1.05 -0.73 113.55 112.02 1gnj h SER 202 Ca 0.16 -0.07 0.13 0.00 -0.84 0.00 0.00 61.79 61.16 1gnj h SER 202 Cb 0.48 -0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.89 1gnj h SER 202 CO 0.02 0.26 0.54 0.25 -1.14 0.00 0.00 176.83 176.76 1gnj h LEU 203 N 0.25 0.62 0.41 5.07 5.85 -1.04 -2.19 115.31 124.27 1gnj h LEU 203 Ca 0.08 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 1gnj h LEU 203 Cb 0.05 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.99 1gnj h LEU 203 CO -0.01 0.34 -0.20 1.56 -0.34 0.00 0.00 178.44 179.78 1gnj h GLN 204 N 0.67 -0.53 0.00 1.25 7.50 -0.73 -2.80 115.11 120.46 1gnj h GLN 204 Ca 0.41 0.04 0.00 0.00 0.50 0.00 0.00 58.65 59.59 1gnj h GLN 204 Cb 0.64 0.12 0.00 0.00 0.05 0.00 0.00 27.48 28.29 1gnj h GLN 204 CO -0.17 -0.36 0.00 1.63 -1.50 0.00 0.00 178.83 178.43 1gnj n LYS 205 N -4.18 0.00 0.33 1.46 5.02 -0.38 -3.75 118.16 116.66 1gnj n LYS 205 Ca -0.07 0.26 0.21 0.00 -2.02 0.00 0.00 58.31 56.69 1gnj n LYS 205 Cb 0.22 -1.12 1.13 0.00 -0.02 0.00 0.00 35.03 35.24 1gnj n LYS 205 CO 0.00 0.00 0.00 0.74 -0.52 0.00 0.00 177.40 177.62 1gnj h PHE 206 N 0.00 0.00 0.00 2.13 0.05 -1.61 -3.49 116.94 114.03 1gnj h PHE 206 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 1gnj h PHE 206 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 35.95 37.95 1gnj h PHE 206 CO -0.02 0.00 0.00 0.41 -0.18 0.00 0.00 178.31 178.52 1gnj n GLY 207 N -1.13 -0.84 0.32 -1.45 0.00 -1.06 -4.31 105.19 96.71 1gnj n GLY 207 Ca -0.03 -1.65 -0.01 0.00 0.00 0.00 0.00 46.02 44.33 1gnj n GLY 207 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1gnj h GLU 208 N 0.00 1.00 0.00 1.61 4.81 -1.94 -2.83 114.58 117.23 1gnj h GLU 208 Ca 0.00 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.20 1gnj h GLU 208 Cb 0.00 -0.23 -0.05 0.00 0.63 0.00 0.00 28.75 29.10 1gnj h GLU 208 CO 0.00 0.66 -0.32 -0.09 -0.73 0.00 0.00 179.01 178.53 1gnj h ARG 209 N 1.03 -0.45 -0.77 1.92 2.43 -1.98 -0.08 114.38 116.48 1gnj h ARG 209 Ca 0.34 0.03 0.04 0.00 -0.81 0.00 0.00 59.98 59.58 1gnj h ARG 209 Cb 0.03 0.10 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 1gnj h ARG 209 CO -0.12 -0.30 0.51 0.00 -1.51 0.00 0.00 179.97 178.54 1gnj h ALA 210 N 0.26 1.56 -0.21 2.80 0.00 -1.73 -1.57 119.26 120.37 1gnj h ALA 210 Ca 0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1gnj h ALA 210 Cb 0.56 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1gnj h ALA 210 CO -0.26 0.35 -0.03 0.35 0.00 0.00 0.00 179.25 179.67 1gnj h PHE 211 N 0.92 0.44 -0.73 0.00 3.57 -1.11 -1.14 116.94 118.90 1gnj h PHE 211 Ca 0.31 -0.09 0.05 0.00 3.53 0.00 0.00 57.97 61.77 1gnj h PHE 211 Cb 0.08 -0.11 -0.05 0.00 2.79 0.00 0.00 35.95 38.66 1gnj h PHE 211 CO -0.00 0.61 0.44 0.87 -2.23 0.00 0.00 178.31 178.00 1gnj h LYS 212 N 0.14 0.81 -0.09 1.11 1.57 -0.57 0.25 116.57 119.79 1gnj h LYS 212 Ca 0.06 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 1gnj h LYS 212 Cb 0.45 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1gnj h LYS 212 CO 0.02 0.53 0.03 0.00 -0.57 0.00 0.00 179.45 179.46 1gnj h ALA 213 N 1.34 0.11 -0.75 3.86 0.00 -1.17 0.22 119.26 122.87 1gnj h ALA 213 Ca 0.31 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 55.22 1gnj h ALA 213 Cb 0.11 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 1gnj h ALA 213 CO -0.15 -0.30 0.39 2.35 0.00 0.00 0.00 179.25 181.54 1gnj h TRP 214 N -0.02 0.71 -0.43 0.00 7.01 -0.66 -2.25 115.95 120.30 1gnj h TRP 214 Ca 0.03 0.03 -0.06 0.00 2.11 0.00 0.00 58.89 61.00 1gnj h TRP 214 Cb 0.17 -0.20 -0.02 0.00 -2.10 0.00 0.00 29.16 27.01 1gnj h TRP 214 CO -0.02 0.26 0.05 0.00 -2.79 0.00 0.00 178.44 175.95 1gnj h ALA 215 N 1.45 0.58 -0.12 2.65 0.00 0.09 -1.86 119.26 122.04 1gnj h ALA 215 Ca 0.37 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 55.08 1gnj h ALA 215 Cb 0.39 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1gnj h ALA 215 CO -0.27 0.31 -0.08 0.28 0.00 0.00 0.00 179.25 179.49 1gnj h VAL 216 N 0.58 0.76 0.01 0.00 2.07 -0.08 0.22 116.25 119.81 1gnj h VAL 216 Ca 0.13 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.66 1gnj h VAL 216 Cb 0.40 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1gnj h VAL 216 CO 0.01 0.00 -0.08 0.00 0.02 0.00 0.00 177.57 177.53 1gnj h ALA 217 N 1.02 -0.09 -0.01 1.67 0.00 -1.36 -0.74 119.26 119.75 1gnj h ALA 217 Ca 0.08 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1gnj h ALA 217 Cb 0.19 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1gnj h ALA 217 CO -0.17 -0.57 -0.07 -0.09 0.00 0.00 0.00 179.25 178.35 1gnj h ARG 218 N -0.14 -0.10 -0.52 0.00 9.65 -0.99 -2.37 114.38 119.91 1gnj h ARG 218 Ca 0.03 0.01 -0.03 0.00 -1.10 0.00 0.00 59.98 58.88 1gnj h ARG 218 Cb 0.17 0.02 -0.03 0.00 -1.39 0.00 0.00 29.97 28.75 1gnj h ARG 218 CO -0.07 -0.07 0.20 -0.07 2.80 0.00 0.00 179.97 182.76 1gnj h LEU 219 N -0.11 0.68 -0.85 3.80 3.38 -0.43 -2.90 115.31 118.89 1gnj h LEU 219 Ca 0.03 -0.08 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 1gnj h LEU 219 Cb 0.15 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1gnj h LEU 219 CO -0.08 0.62 -0.35 0.28 0.09 0.00 0.00 178.44 179.01 1gnj h SER 220 N 0.74 0.46 -0.45 -0.43 0.02 -0.84 0.97 113.55 114.01 1gnj h SER 220 Ca 0.18 -0.18 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 1gnj h SER 220 Cb 0.16 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 1gnj h SER 220 CO -0.02 0.78 -0.17 1.56 -1.14 0.00 0.00 176.83 177.85 1gnj h GLN 221 N 0.38 0.94 0.09 3.45 4.20 -1.24 -2.70 115.11 120.23 1gnj h GLN 221 Ca 0.04 -0.37 -0.28 0.00 0.06 0.00 0.00 58.65 58.11 1gnj h GLN 221 Cb 0.79 -0.05 0.02 0.00 0.30 0.00 0.00 27.48 28.54 1gnj h GLN 221 CO 0.06 1.03 -1.17 0.00 -0.67 0.00 0.00 178.83 178.08 1gnj h ARG 222 N 0.83 0.51 -2.27 1.46 3.08 -1.33 -3.38 114.38 113.28 1gnj h ARG 222 Ca 0.12 -0.67 -0.61 0.00 0.07 0.00 0.00 59.98 58.89 1gnj h ARG 222 Cb 0.72 0.22 -0.41 0.00 0.08 0.00 0.00 29.97 30.58 1gnj h ARG 222 CO 0.06 1.28 -0.50 1.19 -1.07 0.00 0.00 179.97 180.92 1gnj n PHE 223 N -3.73 3.78 0.31 3.04 3.72 0.31 -1.69 117.46 123.20 1gnj n PHE 223 Ca -0.11 -3.96 0.20 0.00 -0.05 0.00 0.00 57.45 53.52 1gnj n PHE 223 Cb 0.96 -0.57 1.02 0.00 -0.94 0.00 0.00 39.48 39.95 1gnj n PHE 223 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1gnj h PRO 224 N 3.64 0.00 -0.00 -1.08 0.13 -1.65 -2.64 132.00 130.39 1gnj h PRO 224 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1gnj h PRO 224 Cb 0.57 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.70 1gnj h PRO 224 CO 0.86 0.01 -0.34 1.63 -0.23 0.00 0.00 178.00 179.94 1gnj n LYS 225 N -3.20 0.08 -2.49 0.86 5.02 -1.26 -4.77 118.16 112.40 1gnj n LYS 225 Ca -0.02 -0.04 -0.32 0.00 -2.02 0.00 0.00 58.31 55.91 1gnj n LYS 225 Cb 0.15 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.62 1gnj n LYS 225 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1gnj s ALA 226 N -2.94 3.04 0.63 7.82 0.00 -1.00 -4.92 121.76 124.39 1gnj s ALA 226 Ca 0.13 0.26 -0.13 0.00 0.00 0.00 0.00 51.96 52.23 1gnj s ALA 226 Cb 0.18 -3.14 -0.03 0.00 0.00 0.00 0.00 23.12 20.14 1gnj s ALA 226 CO 0.63 -0.18 1.04 -1.21 0.00 0.00 0.00 175.76 176.05 1gnj s GLU 227 N -3.82 3.31 0.49 0.00 2.02 -1.26 -4.90 118.70 114.54 1gnj s GLU 227 Ca 0.60 0.98 0.15 0.00 0.02 0.00 0.00 54.97 56.72 1gnj s GLU 227 Cb -0.10 -2.04 1.17 0.00 0.10 0.00 0.00 34.13 33.25 1gnj s GLU 227 CO 0.27 -0.81 2.11 0.35 0.02 0.00 0.00 175.26 177.20 1gnj h PHE 228 N -0.11 0.06 -0.51 1.61 3.57 -1.99 -1.80 116.94 117.77 1gnj h PHE 228 Ca -0.45 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 60.99 1gnj h PHE 228 Cb 1.21 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.90 1gnj h PHE 228 CO 0.62 0.08 0.07 0.00 -2.23 0.00 0.00 178.31 176.85 1gnj h ALA 229 N 1.93 0.69 0.10 2.41 0.00 -1.99 -0.48 119.26 121.91 1gnj h ALA 229 Ca 0.02 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.68 1gnj h ALA 229 Cb 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1gnj h ALA 229 CO 0.00 0.43 -0.05 1.49 0.00 0.00 0.00 179.25 181.13 1gnj h GLU 230 N 0.74 -0.12 -0.43 0.00 4.57 -1.73 -1.54 114.58 116.06 1gnj h GLU 230 Ca 0.16 0.01 0.04 0.00 -1.18 0.00 0.00 59.36 58.38 1gnj h GLU 230 Cb 0.42 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.01 1gnj h GLU 230 CO 0.01 0.05 0.29 0.28 -1.18 0.00 0.00 179.01 178.46 1gnj h VAL 231 N -0.28 1.02 -0.13 0.32 2.07 -1.26 0.52 116.25 118.50 1gnj h VAL 231 Ca -0.01 -0.15 -0.04 0.00 0.82 0.00 0.00 66.70 67.32 1gnj h VAL 231 Cb 0.23 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 30.54 1gnj h VAL 231 CO 0.02 0.08 -0.07 0.28 0.02 0.00 0.00 177.57 177.90 1gnj h SER 232 N 0.44 0.29 -0.74 0.57 0.02 -0.81 0.38 113.55 113.70 1gnj h SER 232 Ca 0.18 -0.42 0.10 0.00 -0.84 0.00 0.00 61.79 60.80 1gnj h SER 232 Cb 0.16 -0.08 -0.07 0.00 0.14 0.00 0.00 62.40 62.55 1gnj h SER 232 CO -0.04 0.65 0.38 0.50 -1.14 0.00 0.00 176.83 177.18 1gnj h LYS 233 N -0.07 0.62 -0.40 3.45 3.11 -0.24 -1.21 116.57 121.84 1gnj h LYS 233 Ca 0.03 -0.04 -0.11 0.00 -2.81 0.00 0.00 60.65 57.72 1gnj h LYS 233 Cb 0.55 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.63 1gnj h LYS 233 CO 0.02 0.41 -0.19 -0.07 -2.81 0.00 0.00 179.45 176.81 1gnj h LEU 234 N 0.64 0.85 -0.85 5.20 3.38 -0.72 -2.68 115.31 121.13 1gnj h LEU 234 Ca 0.36 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1gnj h LEU 234 Cb 0.38 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.86 1gnj h LEU 234 CO -0.27 1.06 0.45 0.58 0.09 0.00 0.00 178.44 180.36 1gnj h VAL 235 N 0.64 1.25 0.69 1.22 2.07 -0.20 0.49 116.25 122.41 1gnj h VAL 235 Ca 0.09 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 1gnj h VAL 235 Cb 0.74 0.12 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1gnj h VAL 235 CO 0.06 0.29 -0.35 0.74 0.02 0.00 0.00 177.57 178.33 1gnj h THR 236 N 1.19 0.29 -0.88 2.57 2.02 -1.20 -1.41 112.91 115.50 1gnj h THR 236 Ca 0.30 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.50 1gnj h THR 236 Cb 0.06 0.29 -0.05 0.00 -1.74 0.00 0.00 68.15 66.71 1gnj h THR 236 CO -0.04 0.00 0.57 0.44 0.37 0.00 0.00 175.52 176.86 1gnj h ASP 237 N -0.95 0.96 0.05 4.18 3.32 -1.30 -1.01 116.42 121.67 1gnj h ASP 237 Ca -0.09 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1gnj h ASP 237 Cb 0.73 -0.22 -0.00 0.00 0.22 0.00 0.00 39.33 40.06 1gnj h ASP 237 CO 0.14 0.67 -0.06 0.25 -1.72 0.00 0.00 179.24 178.53 1gnj h LEU 238 N 1.13 0.02 -0.08 1.55 7.12 -0.81 -0.50 115.31 123.73 1gnj h LEU 238 Ca 0.34 -0.00 -0.25 0.00 0.13 0.00 0.00 57.88 58.10 1gnj h LEU 238 Cb -0.03 -0.00 0.02 0.00 -0.53 0.00 0.00 40.66 40.11 1gnj h LEU 238 CO -0.10 0.08 -0.94 0.74 -0.13 0.00 0.00 178.44 178.09 1gnj h THR 239 N 0.02 1.29 -0.57 1.05 2.02 -0.06 -1.56 112.91 115.10 1gnj h THR 239 Ca 0.00 -2.16 -0.04 0.00 0.77 0.00 0.00 66.41 64.98 1gnj h THR 239 Cb 0.12 2.23 -0.02 0.00 -1.74 0.00 0.00 68.15 68.74 1gnj h THR 239 CO 0.01 0.67 0.19 0.50 0.37 0.00 0.00 175.52 177.26 1gnj h LYS 240 N 0.43 0.87 -0.78 6.66 3.11 -0.66 -2.47 116.57 123.74 1gnj h LYS 240 Ca -0.10 -0.18 0.01 0.00 -2.81 0.00 0.00 60.65 57.57 1gnj h LYS 240 Cb 1.58 -0.13 -0.04 0.00 -1.00 0.00 0.00 32.23 32.64 1gnj h LYS 240 CO 0.18 0.78 0.52 0.28 -2.81 0.00 0.00 179.45 178.40 1gnj h VAL 241 N 0.79 1.20 -0.37 2.00 2.07 -1.02 -1.48 116.25 119.44 1gnj h VAL 241 Ca 0.18 -0.36 -0.13 0.00 0.82 0.00 0.00 66.70 67.22 1gnj h VAL 241 Cb 0.26 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.08 1gnj h VAL 241 CO -0.01 0.19 -0.27 0.45 0.02 0.00 0.00 177.57 177.96 1gnj h HIS 242 N 1.05 0.98 0.42 1.57 3.86 -1.11 0.84 115.15 122.76 1gnj h HIS 242 Ca 0.29 -0.27 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1gnj h HIS 242 Cb -0.11 -0.22 -0.01 0.00 1.06 0.00 0.00 27.41 28.13 1gnj h HIS 242 CO -0.02 1.05 -0.27 1.15 0.86 0.00 0.00 177.93 180.70 1gnj h THR 243 N 0.63 0.44 0.04 2.45 2.02 -1.31 0.27 112.91 117.45 1gnj h THR 243 Ca 0.07 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.26 1gnj h THR 243 Cb 0.84 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.66 1gnj h THR 243 CO 0.07 0.00 -0.30 -0.08 0.37 0.00 0.00 175.52 175.58 1gnj h GLU 244 N -0.67 -0.39 -0.30 6.66 4.81 -1.24 -0.97 114.58 122.47 1gnj h GLU 244 Ca -0.05 0.03 0.09 0.00 -0.13 0.00 0.00 59.36 59.30 1gnj h GLU 244 Cb 0.55 0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.01 1gnj h GLU 244 CO 0.04 -0.26 0.34 0.00 -0.73 0.00 0.00 179.01 178.40 1gnj h HIS 247 N 0.00 0.00 0.00 0.00 6.17 0.06 -3.46 115.15 117.92 1gnj h HIS 247 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.00 1gnj h HIS 247 Cb 1.59 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.52 1gnj h HIS 247 CO 0.00 0.00 0.00 0.41 0.71 0.00 0.00 177.93 179.05 1gnj n GLY 248 N -1.17 0.29 3.55 5.26 0.00 -1.19 -5.01 105.19 106.93 1gnj n GLY 248 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1gnj n GLY 248 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1gnj s ASP 249 N -2.21 6.07 0.19 1.61 -1.08 -1.26 -4.90 116.67 115.08 1gnj s ASP 249 Ca 0.00 -0.45 -0.19 0.00 -0.52 0.00 0.00 52.55 51.39 1gnj s ASP 249 Cb 0.00 -2.56 0.14 0.00 -1.46 0.00 0.00 42.92 39.04 1gnj s ASP 249 CO 0.00 -1.89 1.61 0.25 0.52 0.00 0.00 175.17 175.66 1gnj h LEU 250 N 13.51 -0.86 0.48 -1.34 5.85 -1.93 -0.23 115.31 130.79 1gnj h LEU 250 Ca -0.23 0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.67 1gnj h LEU 250 Cb 1.06 0.46 -0.00 0.00 0.37 0.00 0.00 40.66 42.55 1gnj h LEU 250 CO 1.29 -0.26 -0.27 -0.07 -0.34 0.00 0.00 178.44 178.78 1gnj h LEU 251 N -0.13 -0.66 -0.91 2.25 3.38 -1.99 0.27 115.31 117.52 1gnj h LEU 251 Ca 0.23 0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.26 1gnj h LEU 251 Cb 0.50 0.19 -0.05 0.00 0.09 0.00 0.00 40.66 41.39 1gnj h LEU 251 CO -0.60 -0.44 0.60 -0.08 0.09 0.00 0.00 178.44 178.01 1gnj h GLU 252 N -0.70 1.16 -0.19 1.13 4.81 -1.95 -1.10 114.58 117.75 1gnj h GLU 252 Ca -0.06 -0.07 0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1gnj h GLU 252 Cb 0.56 -0.26 -0.02 0.00 0.63 0.00 0.00 28.75 29.65 1gnj h GLU 252 CO 0.08 0.77 0.04 0.00 -0.73 0.00 0.00 179.01 179.16 1gnj h ALA 254 N 1.13 1.13 -0.30 0.00 0.00 0.12 -2.08 119.26 119.27 1gnj h ALA 254 Ca 0.08 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1gnj h ALA 254 Cb 0.08 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1gnj h ALA 254 CO -0.11 0.62 -0.16 -0.44 0.00 0.00 0.00 179.25 179.16 1gnj h ASP 255 N 1.22 0.65 -0.91 0.00 5.19 -0.95 -0.67 116.42 120.95 1gnj h ASP 255 Ca 0.31 -0.42 0.01 0.00 -0.62 0.00 0.00 57.03 56.32 1gnj h ASP 255 Cb 0.01 -0.18 -0.05 0.00 0.18 0.00 0.00 39.33 39.29 1gnj h ASP 255 CO -0.05 0.93 0.61 0.44 -3.12 0.00 0.00 179.24 178.04 1gnj h ASP 256 N 0.38 1.05 0.03 6.45 3.32 -1.14 0.17 116.42 126.68 1gnj h ASP 256 Ca 0.06 -0.03 -0.11 0.00 0.02 0.00 0.00 57.03 56.98 1gnj h ASP 256 Cb 0.69 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.97 1gnj h ASP 256 CO 0.05 0.76 -0.33 0.03 -1.72 0.00 0.00 179.24 178.02 1gnj h ARG 257 N 1.23 0.43 0.30 3.56 3.08 -1.19 -2.13 114.38 119.67 1gnj h ARG 257 Ca 0.34 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 60.19 1gnj h ARG 257 Cb -0.13 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 29.91 1gnj h ARG 257 CO -0.08 0.71 -0.15 0.00 -1.07 0.00 0.00 179.97 179.39 1gnj h ALA 258 N 1.28 -0.41 -0.55 0.04 0.00 0.03 -2.39 119.26 117.27 1gnj h ALA 258 Ca 0.05 -0.17 0.09 0.00 0.00 0.00 0.00 54.91 54.87 1gnj h ALA 258 Cb 0.76 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 1gnj h ALA 258 CO 0.06 -0.59 0.16 -0.44 0.00 0.00 0.00 179.25 178.44 1gnj h ASP 259 N -0.68 0.11 -0.23 0.00 3.32 -0.96 -1.54 116.42 116.44 1gnj h ASP 259 Ca -0.04 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1gnj h ASP 259 Cb 0.48 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 1gnj h ASP 259 CO 0.07 0.08 0.11 0.25 -1.72 0.00 0.00 179.24 178.03 1gnj h LEU 260 N 0.32 0.34 -0.06 1.55 5.85 -1.35 -0.99 115.31 120.98 1gnj h LEU 260 Ca 0.28 -0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.86 1gnj h LEU 260 Cb 0.35 -0.09 0.01 0.00 0.37 0.00 0.00 40.66 41.30 1gnj h LEU 260 CO -0.31 0.32 -0.40 0.00 -0.34 0.00 0.00 178.44 177.71 1gnj h ALA 261 N 1.74 0.13 -0.64 1.25 0.00 -0.77 -2.37 119.26 118.59 1gnj h ALA 261 Ca 0.10 -0.48 -0.06 0.00 0.00 0.00 0.00 54.91 54.47 1gnj h ALA 261 Cb 0.08 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1gnj h ALA 261 CO -0.01 0.25 0.16 1.57 0.00 0.00 0.00 179.25 181.22 1gnj h LYS 262 N -0.12 1.01 0.36 0.00 2.10 -1.08 0.28 116.57 119.11 1gnj h LYS 262 Ca -0.03 -0.22 -0.01 0.00 -2.00 0.00 0.00 60.65 58.39 1gnj h LYS 262 Cb 1.07 -0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 32.24 1gnj h LYS 262 CO 0.08 0.89 -0.25 -0.92 -2.00 0.00 0.00 179.45 177.25 1gnj h TYR 263 N 0.96 -0.67 -0.62 0.07 3.20 -1.21 -0.43 116.97 118.28 1gnj h TYR 263 Ca 0.21 -0.00 0.08 0.00 3.14 0.00 0.00 58.73 62.15 1gnj h TYR 263 Cb 0.33 0.24 -0.06 0.00 1.54 0.00 0.00 36.73 38.78 1gnj h TYR 263 CO 0.02 -0.38 0.28 0.82 -1.64 0.00 0.00 178.16 177.26 1gnj h ILE 264 N -0.60 0.85 -0.31 1.81 2.04 -1.07 -1.58 117.51 118.66 1gnj h ILE 264 Ca -0.03 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.60 1gnj h ILE 264 Cb 0.51 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 1gnj h ILE 264 CO 0.01 0.09 -0.02 0.00 0.00 0.00 0.00 178.15 178.24 1gnj h GLU 266 N 0.47 0.74 -0.82 0.00 5.08 -0.35 -3.03 114.58 116.66 1gnj h GLU 266 Ca 0.10 -0.55 -0.20 0.00 -1.00 0.00 0.00 59.36 57.71 1gnj h GLU 266 Cb 0.33 0.10 -0.12 0.00 0.50 0.00 0.00 28.75 29.56 1gnj h GLU 266 CO 0.01 1.17 0.26 0.09 -1.00 0.00 0.00 179.01 179.53 1gnj n ASN 267 N -3.94 4.31 -0.13 1.42 5.03 -0.66 -4.62 115.26 116.67 1gnj n ASN 267 Ca -0.06 -3.03 0.28 0.00 0.87 0.00 0.00 54.58 52.64 1gnj n ASN 267 Cb 0.69 -0.71 0.70 0.00 -1.02 0.00 0.00 39.78 39.44 1gnj n ASN 267 CO 0.00 0.00 0.00 -0.61 -1.83 0.00 0.00 177.26 174.82 1gnj h GLN 268 N 2.14 0.00 0.05 3.52 4.15 -1.02 -0.71 115.11 123.24 1gnj h GLN 268 Ca 0.25 0.00 -0.23 0.00 0.77 0.00 0.00 58.65 59.44 1gnj h GLN 268 Cb 2.12 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 29.80 1gnj h GLN 268 CO 0.65 0.00 -1.08 -0.44 -1.93 0.00 0.00 178.83 176.03 1gnj h ASP 269 N 0.00 0.22 -0.41 -0.69 3.32 -1.82 -2.71 116.42 114.33 1gnj h ASP 269 Ca 0.39 -0.23 0.00 0.00 0.02 0.00 0.00 57.03 57.22 1gnj h ASP 269 Cb 1.81 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 41.29 1gnj h ASP 269 CO -0.00 1.15 0.00 -1.54 -1.72 0.00 0.00 179.24 177.12 1gnj n SER 270 N -3.48 3.45 0.05 6.45 3.41 -0.29 -4.45 113.62 118.75 1gnj n SER 270 Ca -0.04 -2.36 0.00 0.00 -0.26 0.00 0.00 58.87 56.21 1gnj n SER 270 Cb 0.95 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1gnj n SER 270 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1gnj n ILE 271 N 0.60 0.46 -3.52 -1.33 5.41 -1.12 -4.46 119.36 115.42 1gnj n ILE 271 Ca 0.17 0.15 -0.09 0.00 1.00 0.00 0.00 62.75 63.99 1gnj n ILE 271 Cb 0.68 -1.19 -0.03 0.00 -0.71 0.00 0.00 39.64 38.39 1gnj n ILE 271 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1gnj s SER 272 N -5.37 -0.36 0.00 4.38 0.15 -1.02 -4.05 113.70 107.42 1gnj s SER 272 Ca 0.00 0.07 0.22 0.00 0.70 0.00 0.00 55.95 56.94 1gnj s SER 272 Cb 0.00 0.36 -0.25 0.00 -1.71 0.00 0.00 66.02 64.43 1gnj s SER 272 CO 0.00 -0.56 0.67 -1.54 1.20 0.00 0.00 173.24 173.01 1gnj n SER 273 N -0.08 0.34 -0.15 5.45 3.41 -1.26 -4.26 113.62 117.08 1gnj n SER 273 Ca -0.09 -0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 1gnj n SER 273 Cb 0.61 1.54 0.01 0.00 -0.26 0.00 0.00 64.21 66.11 1gnj n SER 273 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1gnj n LYS 274 N -2.10 1.09 -0.03 4.33 4.76 -1.26 -3.94 118.16 121.02 1gnj n LYS 274 Ca -0.01 -0.12 0.12 0.00 -2.87 0.00 0.00 58.31 55.43 1gnj n LYS 274 Cb 0.50 -1.11 0.25 0.00 -1.84 0.00 0.00 35.03 32.83 1gnj n LYS 274 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1gnj n LEU 275 N -0.33 2.55 0.24 -0.35 4.77 -1.26 -4.60 117.00 118.03 1gnj n LEU 275 Ca 0.01 -0.90 -0.15 0.00 -0.03 0.00 0.00 56.01 54.94 1gnj n LEU 275 Cb 0.07 -0.03 -0.08 0.00 -2.33 0.00 0.00 43.42 41.05 1gnj n LEU 275 CO 0.01 0.45 0.72 0.11 -1.33 0.00 0.00 177.39 177.35 1gnj h LYS 276 N 3.88 -0.56 0.19 3.23 1.79 -1.90 -1.89 116.57 121.31 1gnj h LYS 276 Ca 0.00 0.04 0.01 0.00 -2.18 0.00 0.00 60.65 58.52 1gnj h LYS 276 Cb 0.83 0.13 -0.04 0.00 -1.58 0.00 0.00 32.23 31.56 1gnj h LYS 276 CO 0.00 -0.37 -0.50 1.05 -1.08 0.00 0.00 179.45 178.55 1gnj h GLU 277 N -0.58 -0.75 -0.96 3.15 -0.00 -1.92 -2.50 114.58 111.02 1gnj h GLU 277 Ca -0.05 0.05 0.19 0.00 -0.00 0.00 0.00 59.36 59.55 1gnj h GLU 277 Cb 0.46 0.17 -0.09 0.00 -0.00 0.00 0.00 28.75 29.29 1gnj h GLU 277 CO 0.07 -0.50 0.61 0.00 -0.00 0.00 0.00 179.01 179.18 1gnj n GLU 280 N -0.78 0.35 -1.68 0.00 -0.58 -0.30 -4.97 120.64 112.68 1gnj n GLU 280 Ca 0.20 -0.03 -0.29 0.00 -0.42 0.00 0.00 57.16 56.61 1gnj n GLU 280 Cb 0.21 -1.58 0.09 0.00 -0.57 0.00 0.00 31.44 29.59 1gnj n GLU 280 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1gnj s LYS 281 N -3.25 1.95 0.55 3.49 1.02 -1.18 -5.04 119.74 117.28 1gnj s LYS 281 Ca 0.02 0.41 -0.18 0.00 0.02 0.00 0.00 55.97 56.24 1gnj s LYS 281 Cb 0.14 -1.92 -0.06 0.00 -0.52 0.00 0.00 37.83 35.47 1gnj s LYS 281 CO 0.83 -1.66 1.05 -1.25 -0.92 0.00 0.00 175.35 173.40 1gnj s PRO 282 N -5.31 3.53 0.08 -1.68 0.04 -1.26 -4.74 135.00 125.65 1gnj s PRO 282 Ca 0.61 1.29 -0.11 0.00 0.04 0.00 0.00 61.00 62.83 1gnj s PRO 282 Cb -0.13 -2.06 0.03 0.00 0.04 0.00 0.00 34.50 32.38 1gnj s PRO 282 CO 0.52 -0.65 0.66 -0.11 0.04 0.00 0.00 177.00 177.47 1gnj n LEU 283 N -1.55 -0.38 -0.13 -3.56 7.94 -1.26 -0.08 117.00 117.99 1gnj n LEU 283 Ca 0.09 0.76 0.25 0.00 -1.11 0.00 0.00 56.01 56.00 1gnj n LEU 283 Cb 0.53 -0.13 0.70 0.00 0.53 0.00 0.00 43.42 45.04 1gnj n LEU 283 CO 0.44 -0.65 1.23 0.25 -1.11 0.00 0.00 177.39 177.56 1gnj h LEU 284 N 0.00 0.03 -0.62 -1.96 5.85 -1.92 -3.01 115.31 113.67 1gnj h LEU 284 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1gnj h LEU 284 Cb 0.21 -0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.24 1gnj h LEU 284 CO -0.41 0.01 -0.32 -0.62 -0.34 0.00 0.00 178.44 176.76 1gnj n GLU 285 N -4.32 2.21 0.18 1.25 1.02 0.89 -4.75 120.64 117.11 1gnj n GLU 285 Ca 0.16 -0.53 -0.16 0.00 -0.02 0.00 0.00 57.16 56.61 1gnj n GLU 285 Cb 0.83 -1.13 -0.09 0.00 -0.02 0.00 0.00 31.44 31.04 1gnj n GLU 285 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1gnj h LYS 286 N 1.06 -0.76 -0.15 3.49 1.57 -1.38 -1.52 116.57 118.89 1gnj h LYS 286 Ca 0.00 0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.86 1gnj h LYS 286 Cb 0.38 0.17 -0.07 0.00 0.08 0.00 0.00 32.23 32.80 1gnj h LYS 286 CO 0.00 -0.50 -0.55 0.77 -0.57 0.00 0.00 179.45 178.60 1gnj h SER 287 N -0.78 -1.74 -0.70 0.86 0.02 -1.86 0.22 113.55 109.57 1gnj h SER 287 Ca -0.01 0.21 0.15 0.00 -0.84 0.00 0.00 61.79 61.30 1gnj h SER 287 Cb 0.75 0.68 -0.11 0.00 0.14 0.00 0.00 62.40 63.86 1gnj h SER 287 CO -0.18 -0.48 0.08 -0.74 -1.14 0.00 0.00 176.83 174.37 1gnj h HIS 288 N -0.58 0.10 0.07 3.45 -0.00 -1.84 0.23 115.15 116.58 1gnj h HIS 288 Ca 0.03 0.05 -0.00 0.00 -0.00 0.00 0.00 60.37 60.45 1gnj h HIS 288 Cb 0.68 0.07 0.00 0.00 -0.00 0.00 0.00 27.41 28.16 1gnj h HIS 288 CO -0.59 -0.15 -0.03 0.00 -0.00 0.00 0.00 177.93 177.15 1gnj h ILE 290 N -0.20 1.03 0.00 0.00 2.04 0.04 -1.16 117.51 119.25 1gnj h ILE 290 Ca -0.01 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.65 1gnj h ILE 290 Cb 0.17 0.38 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 1gnj h ILE 290 CO 0.01 0.11 0.00 0.00 0.00 0.00 0.00 178.15 178.27 1gnj h ALA 291 N 1.25 1.00 0.00 1.87 0.00 -0.95 -2.10 119.26 120.32 1gnj h ALA 291 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1gnj h ALA 291 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1gnj h ALA 291 CO -0.11 0.00 -1.47 -1.91 0.00 0.00 0.00 179.25 175.76 1gnj n GLU 292 N -2.39 0.41 -1.28 0.00 4.07 -0.61 -5.03 120.64 115.80 1gnj n GLU 292 Ca 0.00 -0.10 -0.38 0.00 -0.06 0.00 0.00 57.16 56.62 1gnj n GLU 292 Cb 0.14 -1.49 0.02 0.00 -0.06 0.00 0.00 31.44 30.05 1gnj n GLU 292 CO 0.00 0.00 0.00 1.55 -0.06 0.00 0.00 177.13 178.62 1gnj n VAL 293 N -1.86 0.69 -2.32 6.31 3.14 -0.54 -4.96 118.33 118.80 1gnj n VAL 293 Ca 0.00 -0.49 -0.32 0.00 -2.96 0.00 0.00 64.34 60.57 1gnj n VAL 293 Cb 0.44 -0.22 -0.03 0.00 -1.06 0.00 0.00 33.84 32.97 1gnj n VAL 293 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1gnj s GLU 294 N -1.48 3.87 0.28 1.45 2.12 -1.26 -5.00 118.70 118.69 1gnj s GLU 294 Ca 0.59 0.95 -0.30 0.00 0.36 0.00 0.00 54.97 56.57 1gnj s GLU 294 Cb -0.45 -2.12 -0.11 0.00 0.26 0.00 0.00 34.13 31.71 1gnj s GLU 294 CO 0.64 -0.34 1.50 -0.80 -0.54 0.00 0.00 175.26 175.72 1gnj s ASN 295 N -3.18 6.52 0.65 -1.70 0.01 -1.26 -4.88 114.94 111.10 1gnj s ASN 295 Ca 0.59 2.82 -0.09 0.00 -0.71 0.00 0.00 52.86 55.46 1gnj s ASN 295 Cb -0.10 -2.63 0.01 0.00 0.41 0.00 0.00 41.25 38.93 1gnj s ASN 295 CO 0.34 -0.79 1.01 -0.62 -1.51 0.00 0.00 177.10 175.53 1gnj s ASP 296 N 0.31 5.55 0.29 -1.22 2.15 -0.68 -5.00 116.67 118.06 1gnj s ASP 296 Ca 0.59 0.96 -0.22 0.00 0.43 0.00 0.00 52.55 54.32 1gnj s ASP 296 Cb -0.44 -1.86 -0.09 0.00 -0.30 0.00 0.00 42.92 40.23 1gnj s ASP 296 CO 0.48 -1.20 0.83 -1.61 -0.17 0.00 0.00 175.17 173.50 1gnj s GLU 297 N -5.19 4.36 0.46 4.34 2.02 -1.26 -4.67 118.70 118.76 1gnj s GLU 297 Ca 0.56 1.05 -0.16 0.00 0.02 0.00 0.00 54.97 56.44 1gnj s GLU 297 Cb -0.11 -2.75 -0.08 0.00 0.10 0.00 0.00 34.13 31.29 1gnj s GLU 297 CO 0.49 0.29 0.91 0.00 0.02 0.00 0.00 175.26 176.98 1gnj s MET 298 N -2.19 3.96 0.57 1.61 0.23 -1.26 -4.53 119.30 117.69 1gnj s MET 298 Ca 0.48 0.86 0.38 0.00 -1.03 0.00 0.00 55.69 56.38 1gnj s MET 298 Cb -0.16 -2.22 1.45 0.00 -1.53 0.00 0.00 34.83 32.36 1gnj s MET 298 CO 0.21 -0.15 1.61 -1.35 -2.03 0.00 0.00 175.02 173.32 1gnj h PRO 299 N 1.26 0.00 0.00 3.16 0.11 -1.93 -3.46 132.00 131.15 1gnj h PRO 299 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1gnj h PRO 299 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1gnj h PRO 299 CO 0.62 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.41 1gnj n ALA 300 N -2.63 0.00 -1.52 -0.75 0.00 -1.26 -4.55 120.51 109.80 1gnj n ALA 300 Ca 0.29 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.44 1gnj n ALA 300 Cb 1.49 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.92 1gnj n ALA 300 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1gnj n ASP 301 N 0.72 6.70 -4.67 0.00 5.68 -1.26 -4.94 116.55 118.78 1gnj n ASP 301 Ca 0.00 -3.33 -0.35 0.00 -0.50 0.00 0.00 54.79 50.61 1gnj n ASP 301 Cb 0.00 -1.18 -0.09 0.00 -1.14 0.00 0.00 41.12 38.70 1gnj n ASP 301 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1gnj s LEU 302 N -2.55 3.71 0.00 -2.12 1.43 -1.26 -5.11 118.68 112.78 1gnj s LEU 302 Ca 0.56 0.13 -0.16 0.00 -1.03 0.00 0.00 54.13 53.63 1gnj s LEU 302 Cb 0.39 -1.89 0.24 0.00 0.03 0.00 0.00 46.19 44.96 1gnj s LEU 302 CO -0.23 0.29 0.60 -2.65 0.23 0.00 0.00 176.35 174.58 1gnj n PRO 303 N 2.73 -3.62 -3.91 1.29 -0.02 -1.26 -5.03 135.00 125.17 1gnj n PRO 303 Ca -0.18 -0.99 -0.36 0.00 -2.02 0.00 0.00 63.50 59.95 1gnj n PRO 303 Cb 0.53 -1.21 -0.07 0.00 -0.02 0.00 0.00 33.50 32.73 1gnj n PRO 303 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1gnj s SER 304 N -2.86 6.17 0.31 2.55 0.15 -1.26 -5.00 113.70 113.76 1gnj s SER 304 Ca 0.44 0.35 -0.01 0.00 0.70 0.00 0.00 55.95 57.44 1gnj s SER 304 Cb -0.07 -2.00 0.50 0.00 -1.71 0.00 0.00 66.02 62.74 1gnj s SER 304 CO 0.36 0.34 1.97 -0.07 1.20 0.00 0.00 173.24 177.04 1gnj h LEU 305 N 5.48 0.90 -1.71 3.45 3.38 -1.97 -2.33 115.31 122.51 1gnj h LEU 305 Ca -0.50 -0.02 0.20 0.00 0.09 0.00 0.00 57.88 57.65 1gnj h LEU 305 Cb 1.20 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 1gnj h LEU 305 CO 0.62 0.64 0.56 0.00 0.09 0.00 0.00 178.44 180.35 1gnj h ALA 306 N 1.51 2.38 -0.11 1.53 0.00 -1.94 0.11 119.26 122.75 1gnj h ALA 306 Ca 0.31 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1gnj h ALA 306 Cb -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1gnj h ALA 306 CO -0.08 -0.63 0.00 0.00 0.00 0.00 0.00 179.25 178.55 1gnj n ALA 307 N -2.58 -0.32 0.22 0.00 0.00 -0.88 0.13 120.51 117.09 1gnj n ALA 307 Ca 0.17 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.71 1gnj n ALA 307 Cb 0.71 0.17 0.43 0.00 0.00 0.00 0.00 19.45 20.76 1gnj n ALA 307 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1gnj h ASP 308 N 0.00 0.00 -0.01 0.00 3.32 -1.66 0.12 116.42 118.19 1gnj h ASP 308 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1gnj h ASP 308 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1gnj h ASP 308 CO 0.00 0.20 0.00 0.49 -1.72 0.00 0.00 179.24 178.21 1gnj n PHE 309 N -3.31 0.00 0.00 4.55 3.01 0.00 -4.71 117.46 117.01 1gnj n PHE 309 Ca 0.01 -0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1gnj n PHE 309 Cb 0.45 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.92 1gnj n PHE 309 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1gnj n VAL 310 N 0.47 0.00 -0.07 -4.37 0.31 0.00 -4.96 118.33 109.71 1gnj n VAL 310 Ca 0.05 0.00 -0.14 0.00 -0.01 0.00 0.00 64.34 64.24 1gnj n VAL 310 Cb 0.21 -0.61 -0.12 0.00 -0.91 0.00 0.00 33.84 32.41 1gnj n VAL 310 CO 0.00 0.00 0.00 -0.33 -1.32 0.00 0.00 176.83 175.18 1gnj h GLU 311 N 0.00 0.00 -6.19 5.55 5.08 -0.33 -3.46 114.58 115.24 1gnj h GLU 311 Ca 0.00 0.00 -0.71 0.00 -1.00 0.00 0.00 59.36 57.65 1gnj h GLU 311 Cb 0.14 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.41 1gnj h GLU 311 CO 0.00 0.95 0.82 0.45 -1.00 0.00 0.00 179.01 180.23 1gnj n SER 312 N -4.59 2.33 -4.76 1.42 2.88 0.41 -4.92 113.62 106.40 1gnj n SER 312 Ca -0.13 1.08 -0.32 0.00 -1.33 0.00 0.00 58.87 58.17 1gnj n SER 312 Cb 0.49 -1.18 0.09 0.00 -0.75 0.00 0.00 64.21 62.85 1gnj n SER 312 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1gnj s LYS 313 N 2.85 2.28 0.00 -1.46 0.00 -1.26 -3.35 119.74 118.80 1gnj s LYS 313 Ca 0.94 1.31 0.00 0.00 0.00 0.00 0.00 55.97 58.23 1gnj s LYS 313 Cb -1.00 -1.89 0.00 0.00 0.00 0.00 0.00 37.83 34.94 1gnj s LYS 313 CO 0.60 -1.64 0.00 -0.25 0.00 0.00 0.00 175.35 174.05 1gnj n ASP 314 N -3.22 0.00 -0.20 0.03 8.00 -1.26 -4.95 116.55 114.94 1gnj n ASP 314 Ca 0.10 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.57 1gnj n ASP 314 Cb 0.52 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.61 1gnj n ASP 314 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1gnj n VAL 315 N -1.99 -0.31 -0.18 2.53 0.31 -1.21 0.13 118.33 117.61 1gnj n VAL 315 Ca 0.00 1.20 -0.07 0.00 -0.01 0.00 0.00 64.34 65.45 1gnj n VAL 315 Cb 0.00 -1.53 0.02 0.00 -0.91 0.00 0.00 33.84 31.42 1gnj n VAL 315 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1gnj h LYS 317 N 0.69 0.09 -0.09 0.00 2.10 0.65 0.49 116.57 120.51 1gnj h LYS 317 Ca 0.18 -0.01 -0.09 0.00 -2.00 0.00 0.00 60.65 58.74 1gnj h LYS 317 Cb 0.05 -0.02 -0.01 0.00 -0.90 0.00 0.00 32.23 31.35 1gnj h LYS 317 CO -0.03 0.06 -0.34 -0.91 -2.00 0.00 0.00 179.45 176.23 1gnj h ASN 318 N 0.10 0.17 0.04 7.07 4.21 -0.89 -1.82 115.58 124.47 1gnj h ASN 318 Ca 0.13 -0.06 -0.25 0.00 1.21 0.00 0.00 56.30 57.33 1gnj h ASN 318 Cb 0.17 -0.05 0.02 0.00 -1.12 0.00 0.00 38.32 37.34 1gnj h ASN 318 CO -0.21 0.51 -0.98 0.22 -1.29 0.00 0.00 177.43 175.68 1gnj h TYR 319 N 0.15 0.97 0.00 1.19 3.20 -0.17 -3.20 116.97 119.11 1gnj h TYR 319 Ca 0.02 -0.51 -0.08 0.00 3.14 0.00 0.00 58.73 61.30 1gnj h TYR 319 Cb 0.68 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 1gnj h TYR 319 CO 0.01 1.34 -0.36 0.00 -1.64 0.00 0.00 178.16 177.51 1gnj h ALA 320 N 0.50 1.01 -0.24 1.82 0.00 0.08 -1.65 119.26 120.78 1gnj h ALA 320 Ca -0.11 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.39 1gnj h ALA 320 Cb 1.63 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.34 1gnj h ALA 320 CO 0.19 0.45 -0.20 1.49 0.00 0.00 0.00 179.25 181.18 1gnj h GLU 321 N 0.00 0.43 -0.73 0.00 4.81 -1.33 -3.40 114.58 114.35 1gnj h GLU 321 Ca -0.00 -0.14 -0.03 0.00 -0.13 0.00 0.00 59.36 59.06 1gnj h GLU 321 Cb 0.88 -0.04 -0.18 0.00 0.63 0.00 0.00 28.75 30.05 1gnj h GLU 321 CO 0.05 0.62 -0.35 0.00 -0.73 0.00 0.00 179.01 178.60 1gnj s ALA 322 N -4.58 -3.02 0.12 2.92 0.00 -1.15 -5.09 121.76 110.96 1gnj s ALA 322 Ca -0.06 0.37 -0.26 0.00 0.00 0.00 0.00 51.96 52.00 1gnj s ALA 322 Cb 0.14 -2.83 -0.06 0.00 0.00 0.00 0.00 23.12 20.38 1gnj s ALA 322 CO 0.78 -2.32 1.63 0.87 0.00 0.00 0.00 175.76 176.72 1gnj h LYS 323 N 5.91 -0.41 -0.40 0.00 1.57 -1.53 -0.68 116.57 121.02 1gnj h LYS 323 Ca 0.03 0.03 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1gnj h LYS 323 Cb 1.18 0.09 -0.02 0.00 0.08 0.00 0.00 32.23 33.56 1gnj h LYS 323 CO 0.02 -0.28 -0.09 -0.44 -0.57 0.00 0.00 179.45 178.09 1gnj h ASP 324 N -0.43 0.69 -0.39 0.86 3.32 -1.98 -1.22 116.42 117.27 1gnj h ASP 324 Ca 0.05 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.88 1gnj h ASP 324 Cb 0.50 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1gnj h ASP 324 CO -0.21 0.81 0.12 0.58 -1.72 0.00 0.00 179.24 178.83 1gnj h VAL 325 N 0.65 1.21 -0.26 -1.35 2.07 -1.89 0.55 116.25 117.23 1gnj h VAL 325 Ca 0.12 -0.69 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 1gnj h VAL 325 Cb 0.53 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 1gnj h VAL 325 CO 0.03 0.24 0.11 0.15 0.02 0.00 0.00 177.57 178.12 1gnj h PHE 326 N 0.48 0.38 -0.22 1.57 3.57 -0.96 0.88 116.94 122.64 1gnj h PHE 326 Ca 0.13 -0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.56 1gnj h PHE 326 Cb 0.25 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1gnj h PHE 326 CO 0.01 0.38 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.35 1gnj h LEU 327 N 0.27 0.32 -0.62 0.59 3.38 -0.94 -0.17 115.31 118.14 1gnj h LEU 327 Ca 0.09 -0.05 -0.06 0.00 0.09 0.00 0.00 57.88 57.94 1gnj h LEU 327 Cb 0.16 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1gnj h LEU 327 CO -0.01 0.42 0.15 1.23 0.09 0.00 0.00 178.44 180.32 1gnj h GLY 328 N 0.72 1.07 1.01 0.83 0.00 0.83 -1.51 103.07 106.01 1gnj h GLY 328 Ca 0.07 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.72 1gnj h GLY 328 CO 0.01 0.63 0.47 1.98 0.00 0.00 0.00 176.54 179.63 1gnj h MET 329 N 0.91 1.09 0.11 4.80 4.05 0.30 0.41 114.93 126.60 1gnj h MET 329 Ca 0.19 -0.10 0.01 0.00 -0.28 0.00 0.00 59.70 59.52 1gnj h MET 329 Cb 0.36 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 30.91 1gnj h MET 329 CO 0.00 0.77 -0.18 0.35 0.23 0.00 0.00 176.91 178.08 1gnj h PHE 330 N 1.09 -0.48 0.16 1.39 3.57 -0.47 -0.15 116.94 122.05 1gnj h PHE 330 Ca 0.28 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.80 1gnj h PHE 330 Cb -0.03 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 38.89 1gnj h PHE 330 CO -0.00 -0.27 -0.19 -0.07 -2.23 0.00 0.00 178.31 175.54 1gnj h LEU 331 N -0.36 -0.52 -0.34 0.59 3.38 -0.96 0.38 115.31 117.48 1gnj h LEU 331 Ca 0.02 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1gnj h LEU 331 Cb 0.37 0.19 -0.08 0.00 0.09 0.00 0.00 40.66 41.22 1gnj h LEU 331 CO -0.09 -0.28 -0.32 0.22 0.09 0.00 0.00 178.44 178.06 1gnj h TYR 332 N -0.40 -0.88 -0.25 1.13 3.20 -0.72 1.08 116.97 120.13 1gnj h TYR 332 Ca 0.01 0.05 0.02 0.00 3.14 0.00 0.00 58.73 61.96 1gnj h TYR 332 Cb 0.39 0.44 -0.03 0.00 1.54 0.00 0.00 36.73 39.07 1gnj h TYR 332 CO -0.16 -0.38 0.09 0.93 -1.64 0.00 0.00 178.16 177.00 1gnj h GLU 333 N -0.28 0.21 -0.41 1.82 4.39 -0.64 -2.10 114.58 117.57 1gnj h GLU 333 Ca 0.16 -0.01 -0.14 0.00 0.34 0.00 0.00 59.36 59.70 1gnj h GLU 333 Cb 0.53 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 1gnj h GLU 333 CO -0.50 0.14 -0.31 -0.92 -1.16 0.00 0.00 179.01 176.26 1gnj h TYR 334 N 0.21 1.08 -0.48 4.33 5.03 0.87 -3.28 116.97 124.73 1gnj h TYR 334 Ca 0.11 -0.29 -0.09 0.00 2.58 0.00 0.00 58.73 61.04 1gnj h TYR 334 Cb 0.07 -0.24 -0.02 0.00 1.55 0.00 0.00 36.73 38.10 1gnj h TYR 334 CO -0.12 1.10 -0.06 0.00 -1.32 0.00 0.00 178.16 177.76 1gnj h ALA 335 N 0.86 0.66 0.00 1.82 0.00 0.14 -2.99 119.26 119.74 1gnj h ALA 335 Ca 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1gnj h ALA 335 Cb 0.89 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1gnj h ALA 335 CO 0.08 0.51 0.00 2.89 0.00 0.00 0.00 179.25 182.73 1gnj n ARG 336 N -4.28 0.02 0.00 0.00 1.85 -0.81 -1.62 116.66 111.82 1gnj n ARG 336 Ca 0.00 0.22 0.11 0.00 -1.00 0.00 0.00 57.85 57.18 1gnj n ARG 336 Cb 0.35 -1.53 -0.01 0.00 -1.05 0.00 0.00 32.46 30.22 1gnj n ARG 336 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1gnj n ARG 337 N -1.57 1.21 -3.35 2.89 1.74 -1.14 -4.69 116.66 111.75 1gnj n ARG 337 Ca 0.04 -0.94 -0.26 0.00 -0.77 0.00 0.00 57.85 55.93 1gnj n ARG 337 Cb 0.21 -1.46 -0.09 0.00 -1.02 0.00 0.00 32.46 30.10 1gnj n ARG 337 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1gnj n HIS 338 N -0.10 0.45 0.62 -1.55 8.25 -0.64 -4.87 115.22 117.38 1gnj n HIS 338 Ca 0.09 -3.65 0.09 0.00 -0.26 0.00 0.00 57.72 53.98 1gnj n HIS 338 Cb 0.45 -0.23 0.39 0.00 1.12 0.00 0.00 29.99 31.73 1gnj n HIS 338 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1gnj n PRO 339 N 1.79 0.01 0.00 -0.41 -0.02 -1.25 -2.50 135.00 132.61 1gnj n PRO 339 Ca 0.25 0.19 0.13 0.00 -2.02 0.00 0.00 63.50 62.06 1gnj n PRO 339 Cb 0.48 -1.52 0.51 0.00 -0.02 0.00 0.00 33.50 32.95 1gnj n PRO 339 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1gnj n ASP 340 N -1.53 0.26 -4.91 2.55 3.85 -1.26 -4.81 116.55 110.71 1gnj n ASP 340 Ca 0.04 0.00 -0.29 0.00 -0.71 0.00 0.00 54.79 53.83 1gnj n ASP 340 Cb 0.22 -0.17 -0.04 0.00 -1.35 0.00 0.00 41.12 39.78 1gnj n ASP 340 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1gnj s TYR 341 N -2.87 3.47 0.55 2.11 2.02 -1.04 -4.34 117.35 117.26 1gnj s TYR 341 Ca 0.17 0.55 -0.16 0.00 -0.37 0.00 0.00 57.07 57.26 1gnj s TYR 341 Cb 0.19 -2.02 -0.06 0.00 -0.40 0.00 0.00 41.96 39.67 1gnj s TYR 341 CO 0.57 0.32 1.02 -1.54 -1.57 0.00 0.00 175.55 174.35 1gnj s SER 342 N -2.85 6.18 0.17 2.29 1.04 -1.26 -4.57 113.70 114.69 1gnj s SER 342 Ca 0.42 1.71 -0.15 0.00 0.48 0.00 0.00 55.95 58.41 1gnj s SER 342 Cb -0.11 -2.52 0.05 0.00 0.10 0.00 0.00 66.02 63.53 1gnj s SER 342 CO 0.27 -0.89 1.83 0.58 0.98 0.00 0.00 173.24 176.00 1gnj h VAL 343 N 0.70 1.11 -0.84 5.02 2.07 -1.94 -2.71 116.25 119.65 1gnj h VAL 343 Ca -0.47 -0.22 0.04 0.00 0.82 0.00 0.00 66.70 66.88 1gnj h VAL 343 Cb 1.20 0.43 -0.05 0.00 -1.52 0.00 0.00 31.29 31.35 1gnj h VAL 343 CO 0.59 0.11 0.55 1.62 0.02 0.00 0.00 177.57 180.47 1gnj h VAL 344 N 0.63 1.11 -0.45 2.57 3.04 -1.97 0.06 116.25 121.23 1gnj h VAL 344 Ca 0.18 -0.34 0.02 0.00 -1.01 0.00 0.00 66.70 65.54 1gnj h VAL 344 Cb -0.06 0.02 -0.03 0.00 -2.01 0.00 0.00 31.29 29.21 1gnj h VAL 344 CO -0.04 0.18 0.28 0.25 -1.01 0.00 0.00 177.57 177.22 1gnj h LEU 345 N 1.00 0.46 -1.24 3.16 5.85 -1.88 0.22 115.31 122.89 1gnj h LEU 345 Ca 0.34 -0.00 -0.00 0.00 0.84 0.00 0.00 57.88 59.06 1gnj h LEU 345 Cb 0.09 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1gnj h LEU 345 CO -0.11 0.33 0.43 -0.07 -0.34 0.00 0.00 178.44 178.67 1gnj h LEU 346 N 0.56 0.83 -0.63 2.25 3.38 -0.97 -1.38 115.31 119.35 1gnj h LEU 346 Ca 0.18 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 1gnj h LEU 346 Cb -0.01 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1gnj h LEU 346 CO -0.07 0.64 -0.10 -0.07 0.09 0.00 0.00 178.44 178.93 1gnj h LEU 347 N 0.96 0.97 -1.39 1.67 3.38 0.37 -1.67 115.31 119.59 1gnj h LEU 347 Ca 0.25 -0.31 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1gnj h LEU 347 Cb -0.05 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1gnj h LEU 347 CO -0.05 1.08 -0.11 0.03 0.09 0.00 0.00 178.44 179.48 1gnj h ARG 348 N 0.87 0.26 -0.08 1.13 3.08 0.29 -0.44 114.38 119.50 1gnj h ARG 348 Ca 0.14 -0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.05 1gnj h ARG 348 Cb 0.64 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.66 1gnj h ARG 348 CO 0.04 0.39 -0.26 -0.07 -1.07 0.00 0.00 179.97 179.00 1gnj h LEU 349 N 0.25 0.37 -1.52 3.04 3.38 -0.96 -2.01 115.31 117.86 1gnj h LEU 349 Ca 0.05 -0.61 0.03 0.00 0.09 0.00 0.00 57.88 57.44 1gnj h LEU 349 Cb 0.36 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.97 1gnj h LEU 349 CO 0.02 0.92 0.36 0.00 0.09 0.00 0.00 178.44 179.84 1gnj h ALA 350 N 0.46 1.73 -0.13 1.53 0.00 -1.01 -0.11 119.26 121.73 1gnj h ALA 350 Ca -0.01 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1gnj h ALA 350 Cb 0.89 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1gnj h ALA 350 CO 0.06 0.21 -0.34 -0.22 0.00 0.00 0.00 179.25 178.96 1gnj h LYS 351 N 0.63 0.46 -1.01 0.00 1.63 -1.06 -1.41 116.57 115.82 1gnj h LYS 351 Ca 0.22 -0.32 0.03 0.00 -0.85 0.00 0.00 60.65 59.73 1gnj h LYS 351 Cb 0.10 0.05 -0.06 0.00 -0.60 0.00 0.00 32.23 31.72 1gnj h LYS 351 CO -0.06 0.93 0.66 1.15 -3.45 0.00 0.00 179.45 178.69 1gnj h THR 352 N 0.05 1.20 -0.31 1.00 2.02 -0.62 0.19 112.91 116.44 1gnj h THR 352 Ca -0.01 -0.45 -0.12 0.00 0.77 0.00 0.00 66.41 66.61 1gnj h THR 352 Cb 0.95 -0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1gnj h THR 352 CO 0.07 0.24 -0.29 0.22 0.37 0.00 0.00 175.52 176.13 1gnj h TYR 353 N 1.31 0.75 -0.40 3.16 3.20 -0.98 -1.87 116.97 122.14 1gnj h TYR 353 Ca 0.39 -0.19 -0.10 0.00 3.14 0.00 0.00 58.73 61.98 1gnj h TYR 353 Cb -0.05 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 1gnj h TYR 353 CO -0.00 0.87 -0.13 1.49 -1.64 0.00 0.00 178.16 178.75 1gnj h GLU 354 N 0.56 0.79 -0.39 1.82 4.81 -0.29 -0.50 114.58 121.38 1gnj h GLU 354 Ca 0.07 -0.32 -0.00 0.00 -0.13 0.00 0.00 59.36 58.98 1gnj h GLU 354 Cb 0.78 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.11 1gnj h GLU 354 CO 0.06 0.94 0.23 1.15 -0.73 0.00 0.00 179.01 180.66 1gnj h THR 355 N 0.61 1.13 0.39 0.32 2.02 -0.88 -1.66 112.91 114.83 1gnj h THR 355 Ca 0.10 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.94 1gnj h THR 355 Cb 0.66 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 1gnj h THR 355 CO 0.05 0.14 -0.18 0.74 0.37 0.00 0.00 175.52 176.63 1gnj h THR 356 N 0.51 0.63 -0.67 3.16 2.02 -1.18 -1.85 112.91 115.53 1gnj h THR 356 Ca 0.14 -0.06 0.14 0.00 0.77 0.00 0.00 66.41 67.40 1gnj h THR 356 Cb 0.02 0.66 -0.04 0.00 -1.74 0.00 0.00 68.15 67.04 1gnj h THR 356 CO -0.03 0.01 0.46 -0.07 0.37 0.00 0.00 175.52 176.26 1gnj h LEU 357 N -0.55 0.29 -0.46 2.58 3.38 -0.98 0.39 115.31 119.96 1gnj h LEU 357 Ca -0.05 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.78 1gnj h LEU 357 Cb 0.42 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1gnj h LEU 357 CO 0.09 0.15 -0.39 -0.33 0.09 0.00 0.00 178.44 178.05 1gnj h GLU 358 N 0.31 0.86 0.12 1.13 4.39 -0.90 -1.29 114.58 119.20 1gnj h GLU 358 Ca 0.33 -0.45 -0.23 0.00 0.34 0.00 0.00 59.36 59.34 1gnj h GLU 358 Cb 0.85 0.01 0.02 0.00 -0.10 0.00 0.00 28.75 29.53 1gnj h GLU 358 CO -0.08 1.09 -0.98 0.87 -1.16 0.00 0.00 179.01 178.74 1gnj h LYS 359 N 0.70 0.45 -0.02 2.33 1.79 -0.20 -3.38 116.57 118.25 1gnj h LYS 359 Ca 0.06 -0.65 -0.26 0.00 -2.18 0.00 0.00 60.65 57.62 1gnj h LYS 359 Cb 0.97 0.22 0.02 0.00 -1.58 0.00 0.00 32.23 31.86 1gnj h LYS 359 CO 0.09 1.28 -1.01 0.00 -1.08 0.00 0.00 179.45 178.74 1gnj n ALA 362 N -1.58 5.37 -2.19 0.00 0.00 -1.23 -4.96 120.51 115.92 1gnj n ALA 362 Ca 0.01 -4.21 -0.11 0.00 0.00 0.00 0.00 53.44 49.13 1gnj n ALA 362 Cb 0.10 -0.82 -0.10 0.00 0.00 0.00 0.00 19.45 18.63 1gnj n ALA 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gnj s ALA 363 N -3.65 1.07 0.00 0.00 0.00 -0.84 -5.03 121.76 113.31 1gnj s ALA 363 Ca 0.50 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.87 1gnj s ALA 363 Cb 0.41 1.01 0.00 0.00 0.00 0.00 0.00 23.12 24.55 1gnj s ALA 363 CO -0.20 -0.50 0.63 0.00 0.00 0.00 0.00 175.76 175.69 1gnj n ALA 364 N -0.19 -0.01 -3.69 0.00 0.00 -1.26 -3.97 120.51 111.39 1gnj n ALA 364 Ca -0.03 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.04 1gnj n ALA 364 Cb 0.65 0.28 -0.09 0.00 0.00 0.00 0.00 19.45 20.28 1gnj n ALA 364 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1gnj s ASP 365 N -2.89 5.38 0.00 0.00 2.15 -1.26 -5.00 116.67 115.05 1gnj s ASP 365 Ca 0.00 -2.72 0.00 0.00 0.43 0.00 0.00 52.55 50.26 1gnj s ASP 365 Cb 0.00 -1.89 0.00 0.00 -0.30 0.00 0.00 42.92 40.73 1gnj s ASP 365 CO 0.00 -0.42 0.80 -2.65 -0.17 0.00 0.00 175.17 172.73 1gnj n PRO 366 N 3.70 0.00 -0.51 4.34 -0.02 -1.25 -2.02 135.00 139.23 1gnj n PRO 366 Ca 0.07 0.77 0.39 0.00 -2.02 0.00 0.00 63.50 62.71 1gnj n PRO 366 Cb 0.39 -1.30 0.60 0.00 -0.02 0.00 0.00 33.50 33.17 1gnj n PRO 366 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1gnj n HIS 367 N -2.16 0.06 0.04 6.00 -0.00 -1.26 0.76 115.22 118.66 1gnj n HIS 367 Ca 0.00 0.06 0.02 0.00 -0.00 0.00 0.00 57.72 57.80 1gnj n HIS 367 Cb 0.00 -0.44 -0.08 0.00 -0.00 0.00 0.00 29.99 29.48 1gnj n HIS 367 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 1gnj n GLU 368 N -3.52 0.62 0.03 1.57 4.71 -0.85 -2.57 120.64 120.63 1gnj n GLU 368 Ca 0.33 0.20 -0.13 0.00 -0.01 0.00 0.00 57.16 57.54 1gnj n GLU 368 Cb 1.48 -1.80 -0.02 0.00 -1.01 0.00 0.00 31.44 30.09 1gnj n GLU 368 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1gnj n TYR 370 N -3.85 0.55 0.27 0.00 0.18 -1.02 -4.65 117.16 108.63 1gnj n TYR 370 Ca -0.06 -0.47 0.11 0.00 1.88 0.00 0.00 57.90 59.36 1gnj n TYR 370 Cb 0.75 -0.02 0.73 0.00 -0.38 0.00 0.00 39.34 40.42 1gnj n TYR 370 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1gnj h ALA 371 N 2.58 1.75 -0.39 -3.48 0.00 -1.58 -2.78 119.26 115.34 1gnj h ALA 371 Ca 0.00 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.77 1gnj h ALA 371 Cb 0.78 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.50 1gnj h ALA 371 CO 0.00 0.04 0.04 0.36 0.00 0.00 0.00 179.25 179.69 1gnj n LYS 372 N -4.21 2.65 -0.07 0.00 0.00 -1.26 -4.72 118.16 110.56 1gnj n LYS 372 Ca -0.03 -3.00 0.07 0.00 -0.00 0.00 0.00 58.31 55.36 1gnj n LYS 372 Cb 0.12 -1.91 0.44 0.00 -0.00 0.00 0.00 35.03 33.68 1gnj n LYS 372 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 177.40 177.16 1gnj h VAL 373 N 1.62 1.01 0.00 0.58 3.04 -1.82 -0.96 116.25 119.72 1gnj h VAL 373 Ca 0.14 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 1gnj h VAL 373 Cb 1.71 0.42 0.00 0.00 -2.01 0.00 0.00 31.29 31.40 1gnj h VAL 373 CO 0.39 0.10 0.00 -0.26 -1.01 0.00 0.00 177.57 176.79 1gnj h PHE 374 N 0.54 0.00 0.00 3.17 -1.00 -1.86 -1.03 116.94 116.77 1gnj h PHE 374 Ca 0.23 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.01 1gnj h PHE 374 Cb 0.23 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.79 1gnj h PHE 374 CO -0.00 0.00 0.00 -0.44 -1.61 0.00 0.00 178.31 176.26 1gnj h ASP 375 N 0.00 0.00 0.79 2.17 3.32 -1.54 -3.06 116.42 118.10 1gnj h ASP 375 Ca 0.00 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 1gnj h ASP 375 Cb 0.24 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1gnj h ASP 375 CO 0.00 0.00 -0.96 -0.33 -1.72 0.00 0.00 179.24 176.23 1gnj h GLU 376 N 0.00 0.09 -0.37 3.56 5.08 -1.28 -3.25 114.58 118.42 1gnj h GLU 376 Ca 0.00 -0.13 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1gnj h GLU 376 Cb 0.80 0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.08 1gnj h GLU 376 CO 0.00 0.98 0.15 0.74 -1.00 0.00 0.00 179.01 179.88 1gnj h PHE 377 N 0.04 0.50 -0.49 4.33 0.04 -1.56 -3.35 116.94 116.45 1gnj h PHE 377 Ca -0.04 -0.01 0.05 0.00 2.80 0.00 0.00 57.97 60.77 1gnj h PHE 377 Cb 1.66 -0.16 -0.06 0.00 2.20 0.00 0.00 35.95 39.58 1gnj h PHE 377 CO 0.02 0.40 -0.33 -0.22 -0.60 0.00 0.00 178.31 177.57 1gnj h LYS 378 N 0.51 -0.05 0.00 1.51 3.64 -1.64 -0.34 116.57 120.20 1gnj h LYS 378 Ca 0.13 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.48 1gnj h LYS 378 Cb 0.09 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 1gnj h LYS 378 CO -0.01 -0.03 -0.14 -1.00 -2.27 0.00 0.00 179.45 175.99 1gnj h PRO 379 N -0.05 0.00 -0.58 1.90 0.13 -1.81 -0.29 132.00 131.30 1gnj h PRO 379 Ca 0.08 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.10 1gnj h PRO 379 Cb 0.26 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.37 1gnj h PRO 379 CO -0.49 0.14 -0.06 -0.07 -0.23 0.00 0.00 178.00 177.29 1gnj h LEU 380 N 0.00 1.04 -0.04 1.56 4.07 -1.35 -1.41 115.31 119.18 1gnj h LEU 380 Ca -0.00 -0.32 -0.25 0.00 0.08 0.00 0.00 57.88 57.39 1gnj h LEU 380 Cb 0.32 -0.28 0.01 0.00 1.08 0.00 0.00 40.66 41.79 1gnj h LEU 380 CO 0.02 1.12 -1.08 0.58 -1.08 0.00 0.00 178.44 178.00 1gnj h VAL 381 N 0.95 1.41 0.00 1.22 2.07 -0.57 -3.35 116.25 117.98 1gnj h VAL 381 Ca 0.16 -2.63 -0.13 0.00 0.82 0.00 0.00 66.70 64.91 1gnj h VAL 381 Cb 0.62 2.62 -0.02 0.00 -1.52 0.00 0.00 31.29 32.99 1gnj h VAL 381 CO 0.04 0.78 -0.63 -0.33 0.02 0.00 0.00 177.57 177.45 1gnj h GLU 382 N 0.19 0.00 0.78 1.57 5.08 -0.94 -3.21 114.58 118.05 1gnj h GLU 382 Ca -0.11 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.21 1gnj h GLU 382 Cb 1.75 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.99 1gnj h GLU 382 CO 0.19 0.63 -0.50 1.49 -1.00 0.00 0.00 179.01 179.82 1gnj h GLU 383 N 0.00 -1.16 -0.66 2.33 4.22 -1.39 -1.38 114.58 116.55 1gnj h GLU 383 Ca -0.01 0.08 0.01 0.00 0.08 0.00 0.00 59.36 59.52 1gnj h GLU 383 Cb 1.23 0.26 -0.03 0.00 0.50 0.00 0.00 28.75 30.71 1gnj h GLU 383 CO 0.08 -0.77 0.43 -1.00 -2.18 0.00 0.00 179.01 175.57 1gnj h PRO 384 N -1.20 0.85 -0.53 0.92 0.13 -1.76 -2.32 132.00 128.09 1gnj h PRO 384 Ca -0.11 -0.05 0.10 0.00 -0.87 0.00 0.00 66.00 65.07 1gnj h PRO 384 Cb 0.97 -0.19 -0.08 0.00 0.13 0.00 0.00 31.00 31.82 1gnj h PRO 384 CO 0.10 0.57 0.03 1.96 -0.23 0.00 0.00 178.00 180.42 1gnj h GLN 385 N 0.88 0.15 0.00 0.86 4.20 -1.53 -1.61 115.11 118.05 1gnj h GLN 385 Ca 0.24 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.85 1gnj h GLN 385 Cb -0.09 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 1gnj h GLN 385 CO -0.06 0.10 -0.47 -0.91 -0.67 0.00 0.00 178.83 176.82 1gnj h ASN 386 N 0.15 0.00 -0.28 1.46 2.35 -0.93 -2.50 115.58 115.83 1gnj h ASN 386 Ca 0.27 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.99 1gnj h ASN 386 Cb 0.40 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 1gnj h ASN 386 CO -0.42 0.47 0.06 -0.07 -1.65 0.00 0.00 177.43 175.83 1gnj h LEU 387 N 0.00 0.43 0.28 1.61 3.38 -0.78 -1.69 115.31 118.54 1gnj h LEU 387 Ca -0.00 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1gnj h LEU 387 Cb 0.85 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1gnj h LEU 387 CO 0.06 0.56 -0.29 0.40 0.09 0.00 0.00 178.44 179.26 1gnj h ILE 388 N 0.28 0.40 0.14 1.22 1.08 -1.27 -1.59 117.51 117.77 1gnj h ILE 388 Ca 0.09 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 64.57 1gnj h ILE 388 Cb 0.30 0.40 -0.04 0.00 -3.07 0.00 0.00 36.82 34.40 1gnj h ILE 388 CO 0.00 0.00 -0.41 0.11 -0.69 0.00 0.00 178.15 177.16 1gnj h LYS 389 N -0.60 -0.64 -0.04 2.37 6.56 -1.39 0.32 116.57 123.15 1gnj h LYS 389 Ca -0.01 0.04 0.03 0.00 -1.06 0.00 0.00 60.65 59.65 1gnj h LYS 389 Cb 0.55 0.14 -0.04 0.00 -0.57 0.00 0.00 32.23 32.32 1gnj h LYS 389 CO -0.06 -0.42 -0.17 1.96 -2.06 0.00 0.00 179.45 178.69 1gnj h GLN 390 N -0.66 -0.25 -0.39 3.15 4.20 -1.30 0.10 115.11 119.96 1gnj h GLN 390 Ca 0.02 0.02 -0.08 0.00 0.06 0.00 0.00 58.65 58.67 1gnj h GLN 390 Cb 0.68 0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.50 1gnj h GLN 390 CO -0.23 -0.17 -0.07 -0.91 -0.67 0.00 0.00 178.83 176.78 1gnj h ASN 391 N -0.26 0.64 0.46 1.46 2.35 -1.09 -1.92 115.58 117.22 1gnj h ASN 391 Ca 0.07 -0.16 -0.14 0.00 -0.55 0.00 0.00 56.30 55.52 1gnj h ASN 391 Cb 0.35 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.53 1gnj h ASN 391 CO -0.19 0.76 -0.59 0.00 -1.65 0.00 0.00 177.43 175.75 1gnj h GLU 393 N 0.10 -0.16 -0.94 0.00 5.08 -0.63 -2.22 114.58 115.80 1gnj h GLU 393 Ca -0.01 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.49 1gnj h GLU 393 Cb 1.07 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 30.28 1gnj h GLU 393 CO 0.09 0.09 0.60 1.25 -1.00 0.00 0.00 179.01 180.04 1gnj h LEU 394 N -0.41 0.80 -1.19 1.33 5.85 -1.26 -0.36 115.31 120.08 1gnj h LEU 394 Ca -0.02 0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.67 1gnj h LEU 394 Cb 0.33 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1gnj h LEU 394 CO 0.03 0.42 -0.27 0.15 -0.34 0.00 0.00 178.44 178.43 1gnj h PHE 395 N 0.85 0.24 -0.18 1.25 3.04 -1.06 -2.22 116.94 118.88 1gnj h PHE 395 Ca 0.47 -0.05 -0.18 0.00 3.98 0.00 0.00 57.97 62.19 1gnj h PHE 395 Cb 0.58 -0.06 -0.00 0.00 2.56 0.00 0.00 35.95 39.03 1gnj h PHE 395 CO -0.00 0.48 -0.63 0.93 -2.02 0.00 0.00 178.31 177.07 1gnj h GLU 396 N 0.20 0.62 0.68 1.11 5.08 -0.45 -3.31 114.58 118.51 1gnj h GLU 396 Ca 0.03 -0.43 -0.03 0.00 -1.00 0.00 0.00 59.36 57.92 1gnj h GLU 396 Cb 0.59 0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.91 1gnj h GLU 396 CO 0.04 1.05 -0.33 1.96 -1.00 0.00 0.00 179.01 180.74 1gnj h GLN 397 N 0.46 -0.88 0.00 2.33 4.20 -1.27 -3.44 115.11 116.51 1gnj h GLN 397 Ca -0.01 0.06 -0.39 0.00 0.06 0.00 0.00 58.65 58.37 1gnj h GLN 397 Cb 1.20 0.20 0.11 0.00 0.30 0.00 0.00 27.48 29.29 1gnj h GLN 397 CO 0.12 -0.56 0.23 1.28 -0.67 0.00 0.00 178.83 179.23 1gnj n LEU 398 N -5.41 0.00 0.00 1.46 4.77 -0.85 -5.11 117.00 111.87 1gnj n LEU 398 Ca -0.12 -1.59 -0.11 0.00 -0.03 0.00 0.00 56.01 54.15 1gnj n LEU 398 Cb 0.38 -0.72 0.01 0.00 -2.33 0.00 0.00 43.42 40.75 1gnj n LEU 398 CO 0.32 -1.12 0.06 0.61 -1.33 0.00 0.00 177.39 175.92 1gnj n GLY 399 N -2.17 2.73 0.37 -0.72 0.00 -1.26 -4.71 105.19 99.44 1gnj n GLY 399 Ca 0.15 -2.22 0.13 0.00 0.00 0.00 0.00 46.02 44.08 1gnj n GLY 399 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1gnj h GLU 400 N 0.00 0.65 0.42 1.61 4.81 -1.93 0.19 114.58 120.33 1gnj h GLU 400 Ca -0.15 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.02 1gnj h GLU 400 Cb 0.58 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.81 1gnj h GLU 400 CO 0.23 0.43 -0.20 -0.92 -0.73 0.00 0.00 179.01 177.82 1gnj h TYR 401 N 0.67 -0.52 0.00 0.92 3.20 -1.96 -1.62 116.97 117.66 1gnj h TYR 401 Ca 0.48 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.34 1gnj h TYR 401 Cb 0.84 0.17 -0.00 0.00 1.54 0.00 0.00 36.73 39.28 1gnj h TYR 401 CO -0.00 -0.32 -0.02 0.87 -1.64 0.00 0.00 178.16 177.04 1gnj h LYS 402 N -1.12 0.00 -0.22 1.82 6.56 -1.90 0.31 116.57 122.01 1gnj h LYS 402 Ca -0.06 0.00 -0.17 0.00 -1.06 0.00 0.00 60.65 59.36 1gnj h LYS 402 Cb 0.43 0.00 -0.00 0.00 -0.57 0.00 0.00 32.23 32.09 1gnj h LYS 402 CO 0.09 0.02 -0.57 0.35 -2.06 0.00 0.00 179.45 177.29 1gnj h PHE 403 N 0.00 0.87 -0.09 -1.35 3.57 -0.64 -2.62 116.94 116.67 1gnj h PHE 403 Ca -0.00 -0.32 -0.06 0.00 3.53 0.00 0.00 57.97 61.12 1gnj h PHE 403 Cb 0.06 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1gnj h PHE 403 CO 0.00 1.09 -0.23 1.96 -2.23 0.00 0.00 178.31 178.91 1gnj h GLN 404 N 0.52 0.16 0.00 1.11 4.20 0.07 -2.28 115.11 118.89 1gnj h GLN 404 Ca 0.01 -0.05 -0.13 0.00 0.06 0.00 0.00 58.65 58.54 1gnj h GLN 404 Cb 1.14 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.89 1gnj h GLN 404 CO 0.11 0.39 -0.62 -0.91 -0.67 0.00 0.00 178.83 177.13 1gnj h ASN 405 N 0.15 0.00 -0.31 1.46 2.35 -1.15 -1.46 115.58 116.63 1gnj h ASN 405 Ca 0.03 0.00 -0.09 0.00 -0.55 0.00 0.00 56.30 55.69 1gnj h ASN 405 Cb 0.49 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.85 1gnj h ASN 405 CO 0.03 0.62 -0.15 0.00 -1.65 0.00 0.00 177.43 176.28 1gnj h ALA 406 N 1.38 0.43 -0.57 -0.83 0.00 -1.06 -1.92 119.26 116.68 1gnj h ALA 406 Ca -0.01 -0.33 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1gnj h ALA 406 Cb 1.16 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1gnj h ALA 406 CO 0.08 0.33 -0.00 -0.07 0.00 0.00 0.00 179.25 179.59 1gnj h LEU 407 N 0.40 0.97 0.19 0.00 3.38 -1.34 -1.94 115.31 116.97 1gnj h LEU 407 Ca 0.07 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.78 1gnj h LEU 407 Cb 0.68 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.14 1gnj h LEU 407 CO 0.05 1.02 -0.29 0.25 0.09 0.00 0.00 178.44 179.56 1gnj h LEU 408 N 0.91 -0.79 -0.05 1.67 5.85 -1.01 -0.05 115.31 121.83 1gnj h LEU 408 Ca 0.16 0.08 0.02 0.00 0.84 0.00 0.00 57.88 58.99 1gnj h LEU 408 Cb 0.53 0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.82 1gnj h LEU 408 CO 0.03 -0.39 -0.10 0.58 -0.34 0.00 0.00 178.44 178.22 1gnj h VAL 409 N -0.55 0.74 -0.37 1.05 2.07 -1.28 -1.80 116.25 116.12 1gnj h VAL 409 Ca 0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.61 1gnj h VAL 409 Cb 0.54 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 30.98 1gnj h VAL 409 CO -0.12 0.00 -0.11 -0.09 0.02 0.00 0.00 177.57 177.27 1gnj h ARG 410 N -0.14 -0.03 0.00 1.57 2.43 -1.02 -2.80 114.38 114.39 1gnj h ARG 410 Ca 0.05 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.11 1gnj h ARG 410 Cb 0.22 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1gnj h ARG 410 CO -0.13 -0.02 -0.68 1.88 -1.51 0.00 0.00 179.97 179.50 1gnj h TYR 411 N -0.03 0.00 -0.48 2.20 0.05 -0.97 -3.02 116.97 114.72 1gnj h TYR 411 Ca 0.18 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.90 1gnj h TYR 411 Cb 0.31 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.02 1gnj h TYR 411 CO -0.35 0.49 0.08 1.15 -1.05 0.00 0.00 178.16 178.48 1gnj h THR 412 N 0.00 1.22 -0.41 -2.88 2.02 -1.21 -1.80 112.91 109.85 1gnj h THR 412 Ca -0.03 -0.84 -0.14 0.00 0.77 0.00 0.00 66.41 66.17 1gnj h THR 412 Cb 1.40 0.77 -0.01 0.00 -1.74 0.00 0.00 68.15 68.58 1gnj h THR 412 CO 0.06 0.30 -0.27 0.11 0.37 0.00 0.00 175.52 176.09 1gnj h LYS 413 N 0.72 0.91 -0.09 6.66 1.57 -1.49 -1.20 116.57 123.66 1gnj h LYS 413 Ca 0.15 -0.43 -0.00 0.00 -1.87 0.00 0.00 60.65 58.50 1gnj h LYS 413 Cb 0.33 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 1gnj h LYS 413 CO 0.01 1.08 0.04 0.87 -0.57 0.00 0.00 179.45 180.88 1gnj h LYS 414 N 0.74 0.12 -2.31 3.15 1.79 -1.30 -2.91 116.57 115.85 1gnj h LYS 414 Ca 0.08 -0.02 -0.58 0.00 -2.18 0.00 0.00 60.65 57.95 1gnj h LYS 414 Cb 0.85 -0.02 -0.39 0.00 -1.58 0.00 0.00 32.23 31.08 1gnj h LYS 414 CO 0.07 0.19 -0.92 1.33 -1.08 0.00 0.00 179.45 179.04 1gnj n VAL 415 N -4.97 -0.24 0.27 0.50 0.24 -0.72 -3.72 118.33 109.69 1gnj n VAL 415 Ca -0.06 -4.03 0.15 0.00 -2.04 0.00 0.00 64.34 58.36 1gnj n VAL 415 Cb 0.08 -1.88 0.86 0.00 -1.47 0.00 0.00 33.84 31.43 1gnj n VAL 415 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1gnj h PRO 416 N 4.85 0.00 -0.25 7.34 0.11 -1.39 -1.82 132.00 140.84 1gnj h PRO 416 Ca 0.18 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1gnj h PRO 416 Cb 0.85 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 1gnj h PRO 416 CO 0.50 0.00 0.16 1.96 -0.21 0.00 0.00 178.00 180.41 1gnj h GLN 417 N 0.00 0.33 -7.00 1.05 7.50 -1.92 -3.44 115.11 111.63 1gnj h GLN 417 Ca 0.02 -0.02 -0.55 0.00 0.50 0.00 0.00 58.65 58.61 1gnj h GLN 417 Cb 0.13 -0.07 0.12 0.00 0.05 0.00 0.00 27.48 27.71 1gnj h GLN 417 CO -0.00 0.23 0.70 0.08 -1.50 0.00 0.00 178.83 178.33 1gnj s VAL 418 N -5.31 2.03 0.42 -0.54 1.01 -0.69 -4.94 120.40 112.38 1gnj s VAL 418 Ca -0.07 0.02 -0.26 0.00 0.00 0.00 0.00 61.98 61.68 1gnj s VAL 418 Cb 0.17 -3.01 -0.09 0.00 0.00 0.00 0.00 36.38 33.45 1gnj s VAL 418 CO 0.71 0.00 1.35 -0.55 0.00 0.00 0.00 175.10 176.61 1gnj s SER 419 N -0.55 6.14 0.10 3.32 0.15 -1.26 -4.88 113.70 116.71 1gnj s SER 419 Ca 0.63 2.76 -0.23 0.00 0.70 0.00 0.00 55.95 59.81 1gnj s SER 419 Cb -0.44 -2.64 -0.11 0.00 -1.71 0.00 0.00 66.02 61.11 1gnj s SER 419 CO 0.56 -0.98 1.72 0.74 1.20 0.00 0.00 173.24 176.47 1gnj h THR 420 N 2.40 0.86 -0.09 6.45 2.02 -1.93 -1.60 112.91 121.03 1gnj h THR 420 Ca -0.50 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.70 1gnj h THR 420 Cb 1.25 0.86 -0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1gnj h THR 420 CO 0.62 0.00 0.09 1.55 0.37 0.00 0.00 175.52 178.15 1gnj h PRO 421 N -0.09 0.00 0.16 6.66 0.13 -1.97 -1.24 132.00 135.64 1gnj h PRO 421 Ca 0.02 0.00 -0.29 0.00 -0.87 0.00 0.00 66.00 64.86 1gnj h PRO 421 Cb 0.12 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.26 1gnj h PRO 421 CO -0.05 0.00 -1.30 1.15 -0.23 0.00 0.00 178.00 177.56 1gnj h THR 422 N 0.00 1.44 -0.32 1.56 2.02 -1.82 -2.66 112.91 113.13 1gnj h THR 422 Ca 0.04 -2.95 -0.08 0.00 0.77 0.00 0.00 66.41 64.18 1gnj h THR 422 Cb 0.22 2.96 -0.02 0.00 -1.74 0.00 0.00 68.15 69.58 1gnj h THR 422 CO -0.00 0.87 -0.15 -0.07 0.37 0.00 0.00 175.52 176.54 1gnj h LEU 423 N 0.10 0.56 -0.22 2.58 3.38 -0.30 -1.91 115.31 119.50 1gnj h LEU 423 Ca -0.17 -0.16 -0.17 0.00 0.09 0.00 0.00 57.88 57.47 1gnj h LEU 423 Cb 2.02 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.62 1gnj h LEU 423 CO 0.22 0.74 -0.52 0.58 0.09 0.00 0.00 178.44 179.55 1gnj h VAL 424 N 0.52 1.30 0.16 1.22 2.07 -1.32 -2.22 116.25 117.99 1gnj h VAL 424 Ca 0.09 -1.73 -0.01 0.00 0.82 0.00 0.00 66.70 65.87 1gnj h VAL 424 Cb 0.56 1.83 -0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1gnj h VAL 424 CO 0.04 0.55 -0.10 -0.08 0.02 0.00 0.00 177.57 178.00 1gnj h GLU 425 N 0.46 -0.24 -0.06 1.57 4.57 -1.32 -2.34 114.58 117.21 1gnj h GLU 425 Ca -0.00 0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1gnj h GLU 425 Cb 1.13 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.78 1gnj h GLU 425 CO 0.11 -0.16 0.04 0.28 -1.18 0.00 0.00 179.01 178.10 1gnj h VAL 426 N -0.25 1.07 -0.49 0.32 2.07 -1.40 -2.53 116.25 115.04 1gnj h VAL 426 Ca -0.02 -0.19 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1gnj h VAL 426 Cb 0.21 1.09 -0.02 0.00 -1.52 0.00 0.00 31.29 31.04 1gnj h VAL 426 CO 0.02 0.06 0.26 0.28 0.02 0.00 0.00 177.57 178.21 1gnj h SER 427 N 0.02 0.60 -0.36 0.57 0.02 -1.39 -0.26 113.55 112.75 1gnj h SER 427 Ca 0.02 -0.04 -0.13 0.00 -0.84 0.00 0.00 61.79 60.80 1gnj h SER 427 Cb 0.06 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 1gnj h SER 427 CO -0.00 0.49 -0.26 0.03 -1.14 0.00 0.00 176.83 175.94 1gnj h ARG 428 N 0.68 0.88 -0.34 3.45 3.08 -1.27 -0.17 114.38 120.69 1gnj h ARG 428 Ca 0.18 -0.39 -0.14 0.00 0.07 0.00 0.00 59.98 59.70 1gnj h ARG 428 Cb 0.03 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 1gnj h ARG 428 CO -0.03 1.03 -0.35 -0.91 -1.07 0.00 0.00 179.97 178.64 1gnj h ASN 429 N 0.75 0.82 -0.75 7.04 2.35 -0.98 -0.77 115.58 124.05 1gnj h ASN 429 Ca 0.09 -0.35 -0.01 0.00 -0.55 0.00 0.00 56.30 55.47 1gnj h ASN 429 Cb 0.81 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 38.92 1gnj h ASN 429 CO 0.07 1.09 0.41 -0.07 -1.65 0.00 0.00 177.43 177.28 1gnj h LEU 430 N 0.65 0.93 -1.22 1.61 4.07 -0.89 -0.94 115.31 119.53 1gnj h LEU 430 Ca 0.06 -0.10 -0.02 0.00 0.08 0.00 0.00 57.88 57.90 1gnj h LEU 430 Cb 0.90 -0.24 -0.03 0.00 1.08 0.00 0.00 40.66 42.38 1gnj h LEU 430 CO 0.08 0.76 0.27 1.23 -1.08 0.00 0.00 178.44 179.70 1gnj h GLY 431 N 1.03 0.87 0.80 0.83 0.00 -0.57 -1.12 103.07 104.91 1gnj h GLY 431 Ca 0.26 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.18 1gnj h GLY 431 CO -0.04 0.39 -0.05 0.50 0.00 0.00 0.00 176.54 177.34 1gnj h LYS 432 N 0.81 -0.12 -0.80 4.80 1.57 -0.10 -2.14 116.57 120.58 1gnj h LYS 432 Ca 0.20 0.01 0.17 0.00 -1.87 0.00 0.00 60.65 59.16 1gnj h LYS 432 Cb 0.10 0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.38 1gnj h LYS 432 CO -0.03 0.10 0.54 0.28 -0.57 0.00 0.00 179.45 179.77 1gnj h VAL 433 N -0.33 0.75 -0.14 0.50 2.07 -0.80 0.40 116.25 118.69 1gnj h VAL 433 Ca -0.01 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.37 1gnj h VAL 433 Cb 0.28 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1gnj h VAL 433 CO 0.02 0.07 0.08 1.23 0.02 0.00 0.00 177.57 178.99 1gnj h GLY 434 N 0.39 0.21 2.00 2.17 0.00 -0.57 -0.72 103.07 106.55 1gnj h GLY 434 Ca 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.64 1gnj h GLY 434 CO -0.13 0.09 0.00 1.48 0.00 0.00 0.00 176.54 177.98 1gnj h SER 435 N 0.14 0.00 0.00 0.19 4.64 -0.78 -1.58 113.55 116.16 1gnj h SER 435 Ca 0.05 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.36 1gnj h SER 435 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 1gnj h SER 435 CO -0.01 0.00 -0.03 0.50 -0.87 0.00 0.00 176.83 176.42 1gnj h LYS 436 N 0.00 0.02 0.00 4.77 1.63 -0.67 -3.39 116.57 118.92 1gnj h LYS 436 Ca 0.00 -0.02 -0.25 0.00 -0.85 0.00 0.00 60.65 59.53 1gnj h LYS 436 Cb 0.80 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 32.39 1gnj h LYS 436 CO 0.00 0.93 -1.66 0.00 -3.45 0.00 0.00 179.45 175.27 1gnj n LYS 439 N -1.49 1.63 -3.18 0.00 5.02 -1.26 -4.85 118.16 114.02 1gnj n LYS 439 Ca 0.04 -0.96 -0.25 0.00 -2.02 0.00 0.00 58.31 55.12 1gnj n LYS 439 Cb 0.16 -1.48 -0.01 0.00 -0.02 0.00 0.00 35.03 33.68 1gnj n LYS 439 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1gnj s HIS 440 N -2.03 3.52 0.47 2.13 3.76 -0.86 -5.07 115.29 117.21 1gnj s HIS 440 Ca 0.37 0.48 -0.19 0.00 -0.15 0.00 0.00 55.06 55.57 1gnj s HIS 440 Cb 0.21 -2.01 -0.09 0.00 1.11 0.00 0.00 32.58 31.80 1gnj s HIS 440 CO 0.35 0.02 0.97 -1.25 -0.85 0.00 0.00 174.74 173.97 1gnj s PRO 441 N -4.42 4.08 0.19 8.40 0.04 -1.26 -4.77 135.00 137.26 1gnj s PRO 441 Ca 0.42 1.04 0.06 0.00 0.04 0.00 0.00 61.00 62.56 1gnj s PRO 441 Cb -0.10 -2.16 0.59 0.00 0.04 0.00 0.00 34.50 32.87 1gnj s PRO 441 CO 0.38 -0.16 0.90 -1.91 0.04 0.00 0.00 177.00 176.26 1gnj n GLU 442 N -1.12 -0.04 0.33 4.56 2.13 -1.26 -0.09 120.64 125.15 1gnj n GLU 442 Ca 0.07 0.83 0.21 0.00 0.66 0.00 0.00 57.16 58.93 1gnj n GLU 442 Cb 0.54 -1.39 1.15 0.00 0.27 0.00 0.00 31.44 32.01 1gnj n GLU 442 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1gnj h ALA 443 N 1.15 1.09 -0.00 4.31 0.00 -1.93 -2.51 119.26 121.37 1gnj h ALA 443 Ca 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.32 1gnj h ALA 443 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1gnj h ALA 443 CO -0.50 -0.05 -0.01 1.63 0.00 0.00 0.00 179.25 180.32 1gnj n LYS 444 N -3.11 -0.14 0.07 0.00 4.01 0.87 -4.14 118.16 115.72 1gnj n LYS 444 Ca -0.03 -0.61 -0.13 0.00 -0.51 0.00 0.00 58.31 57.03 1gnj n LYS 444 Cb 0.12 -1.02 -0.08 0.00 -0.51 0.00 0.00 35.03 33.54 1gnj n LYS 444 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1gnj h ARG 445 N 0.48 -0.13 -0.54 1.97 3.08 -1.34 -2.84 114.38 115.06 1gnj h ARG 445 Ca 0.00 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1gnj h ARG 445 Cb 0.11 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 1gnj h ARG 445 CO 0.00 0.05 0.33 1.98 -1.07 0.00 0.00 179.97 181.27 1gnj h MET 446 N -0.30 0.73 -0.66 0.04 4.05 -1.77 -1.45 114.93 115.57 1gnj h MET 446 Ca -0.01 -0.06 0.01 0.00 -0.28 0.00 0.00 59.70 59.35 1gnj h MET 446 Cb 0.25 -0.16 -0.03 0.00 -0.80 0.00 0.00 31.60 30.86 1gnj h MET 446 CO 0.02 0.52 0.43 -1.35 0.23 0.00 0.00 176.91 176.77 1gnj h PRO 447 N 0.73 0.86 0.22 0.39 0.11 -1.75 -2.08 132.00 130.47 1gnj h PRO 447 Ca 0.20 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1gnj h PRO 447 Cb -0.03 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 30.87 1gnj h PRO 447 CO -0.04 0.57 -0.24 0.00 -0.21 0.00 0.00 178.00 178.08 1gnj h ALA 449 N 0.19 0.93 -0.00 0.00 0.00 -1.18 -2.41 119.26 116.79 1gnj h ALA 449 Ca 0.00 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1gnj h ALA 449 Cb 0.47 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 1gnj h ALA 449 CO -0.07 0.14 -0.21 1.49 0.00 0.00 0.00 179.25 180.61 1gnj h GLU 450 N 0.79 -0.31 -0.47 0.00 4.81 -1.10 0.42 114.58 118.72 1gnj h GLU 450 Ca 0.30 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.64 1gnj h GLU 450 Cb 0.11 0.07 -0.08 0.00 0.63 0.00 0.00 28.75 29.48 1gnj h GLU 450 CO -0.15 -0.21 -0.06 0.22 -0.73 0.00 0.00 179.01 178.09 1gnj h ASP 451 N -0.33 -0.31 0.01 1.04 1.82 -0.89 -1.24 116.42 116.52 1gnj h ASP 451 Ca 0.06 0.13 -0.09 0.00 -0.39 0.00 0.00 57.03 56.74 1gnj h ASP 451 Cb 0.41 0.24 0.01 0.00 0.68 0.00 0.00 39.33 40.66 1gnj h ASP 451 CO -0.19 -0.11 -0.35 1.88 -1.61 0.00 0.00 179.24 178.86 1gnj h TYR 452 N 0.06 0.33 0.00 0.28 0.05 -1.20 -3.30 116.97 113.18 1gnj h TYR 452 Ca 0.23 -0.19 -0.00 0.00 0.05 0.00 0.00 58.73 58.82 1gnj h TYR 452 Cb 0.35 -0.03 -0.00 0.00 1.01 0.00 0.00 36.73 38.06 1gnj h TYR 452 CO -0.35 1.02 -0.00 -0.07 -1.05 0.00 0.00 178.16 177.71 1gnj h LEU 453 N -0.46 0.00 -0.42 3.88 4.07 -0.07 -2.63 115.31 119.68 1gnj h LEU 453 Ca -0.05 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.74 1gnj h LEU 453 Cb 1.12 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.86 1gnj h LEU 453 CO 0.07 0.00 -0.62 0.77 -1.08 0.00 0.00 178.44 177.58 1gnj h SER 454 N 0.00 0.68 0.33 -0.43 4.64 -1.30 -0.97 113.55 116.49 1gnj h SER 454 Ca -0.00 -0.39 -0.24 0.00 -0.47 0.00 0.00 61.79 60.69 1gnj h SER 454 Cb 0.00 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 61.90 1gnj h SER 454 CO 0.00 1.13 -1.00 -0.37 -0.87 0.00 0.00 176.83 175.72 1gnj h VAL 455 N 0.44 1.40 -0.26 0.95 -1.51 -1.62 -1.35 116.25 114.30 1gnj h VAL 455 Ca -0.01 -2.50 -0.02 0.00 -1.23 0.00 0.00 66.70 62.94 1gnj h VAL 455 Cb 1.19 2.49 -0.01 0.00 -2.13 0.00 0.00 31.29 32.83 1gnj h VAL 455 CO 0.12 0.75 0.07 0.58 -1.23 0.00 0.00 177.57 177.86 1gnj h VAL 456 N 0.23 1.20 -0.48 7.19 2.07 -1.49 0.13 116.25 125.09 1gnj h VAL 456 Ca -0.09 -0.66 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 1gnj h VAL 456 Cb 1.65 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.55 1gnj h VAL 456 CO 0.17 0.21 0.13 0.25 0.02 0.00 0.00 177.57 178.36 1gnj h LEU 457 N 0.25 0.73 -0.33 2.57 5.85 -1.20 -1.64 115.31 121.53 1gnj h LEU 457 Ca 0.08 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.54 1gnj h LEU 457 Cb 0.26 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 1gnj h LEU 457 CO -0.00 0.76 0.08 -1.13 -0.34 0.00 0.00 178.44 177.81 1gnj h ASN 458 N 0.66 0.50 -0.13 1.25 -1.24 -1.09 -2.38 115.58 113.15 1gnj h ASN 458 Ca 0.15 -0.23 -0.06 0.00 0.71 0.00 0.00 56.30 56.87 1gnj h ASN 458 Cb 0.31 -0.13 -0.02 0.00 0.73 0.00 0.00 38.32 39.22 1gnj h ASN 458 CO 0.00 0.61 -0.10 1.56 -1.29 0.00 0.00 177.43 178.21 1gnj h GLN 459 N 0.38 0.46 0.00 6.67 1.08 -0.64 -2.15 115.11 120.92 1gnj h GLN 459 Ca 0.10 -0.12 -0.08 0.00 -1.45 0.00 0.00 58.65 57.10 1gnj h GLN 459 Cb 0.30 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.66 1gnj h GLN 459 CO 0.00 0.57 -0.40 1.37 -0.95 0.00 0.00 178.83 179.42 1gnj h LEU 460 N 0.43 0.00 -0.44 1.46 8.10 -1.17 -3.01 115.31 120.69 1gnj h LEU 460 Ca 0.08 0.00 -0.17 0.00 0.11 0.00 0.00 57.88 57.91 1gnj h LEU 460 Cb 0.44 0.00 -0.00 0.00 -0.44 0.00 0.00 40.66 40.66 1gnj h LEU 460 CO 0.02 0.40 -0.53 0.00 -4.11 0.00 0.00 178.44 174.22 1gnj h VAL 462 N 0.54 1.19 -0.34 0.00 2.07 -1.36 0.73 116.25 119.08 1gnj h VAL 462 Ca 0.02 -0.61 0.07 0.00 0.82 0.00 0.00 66.70 67.00 1gnj h VAL 462 Cb 1.10 1.21 -0.08 0.00 -1.52 0.00 0.00 31.29 32.00 1gnj h VAL 462 CO 0.11 0.19 -0.25 -0.07 0.02 0.00 0.00 177.57 177.57 1gnj h LEU 463 N 0.15 -0.84 -2.17 2.57 3.38 -1.50 0.59 115.31 117.49 1gnj h LEU 463 Ca 0.07 0.16 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1gnj h LEU 463 Cb 0.24 0.41 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 1gnj h LEU 463 CO -0.00 -0.28 -0.04 -0.74 0.09 0.00 0.00 178.44 177.47 1gnj h HIS 464 N -0.21 0.00 -0.55 1.13 2.76 -1.22 0.19 115.15 117.24 1gnj h HIS 464 Ca 0.17 0.00 -0.10 0.00 -2.20 0.00 0.00 60.37 58.24 1gnj h HIS 464 Cb 0.48 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.42 1gnj h HIS 464 CO -0.45 0.04 -0.06 1.49 -1.30 0.00 0.00 177.93 177.64 1gnj h GLU 465 N 0.00 0.99 -0.11 5.26 4.81 0.26 0.81 114.58 126.59 1gnj h GLU 465 Ca -0.00 -0.33 -0.17 0.00 -0.13 0.00 0.00 59.36 58.73 1gnj h GLU 465 Cb 0.08 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1gnj h GLU 465 CO 0.00 1.01 -0.64 0.87 -0.73 0.00 0.00 179.01 179.52 1gnj h LYS 466 N 0.89 0.41 -1.57 1.92 6.56 0.10 -3.39 116.57 121.50 1gnj h LYS 466 Ca 0.15 -0.30 -0.46 0.00 -1.06 0.00 0.00 60.65 58.99 1gnj h LYS 466 Cb 0.60 0.05 -0.31 0.00 -0.57 0.00 0.00 32.23 32.00 1gnj h LYS 466 CO 0.04 0.91 -0.89 0.25 -2.06 0.00 0.00 179.45 177.70 1gnj n THR 467 N -3.89 -0.61 -1.59 -0.16 -2.24 -0.06 -5.11 114.28 100.63 1gnj n THR 467 Ca -0.03 -3.05 -0.42 0.00 -2.27 0.00 0.00 64.05 58.27 1gnj n THR 467 Cb 0.65 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 1gnj n THR 467 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1gnj n PRO 468 N 1.94 1.30 0.00 -0.78 -0.04 0.26 -4.66 135.00 133.02 1gnj n PRO 468 Ca 0.20 0.46 0.00 0.00 -0.04 0.00 0.00 63.50 64.13 1gnj n PRO 468 Cb 0.54 -1.93 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 1gnj n PRO 468 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1gnj n VAL 469 N -0.27 0.00 -3.78 0.52 0.31 -1.26 -5.08 118.33 108.76 1gnj n VAL 469 Ca 0.09 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.29 1gnj n VAL 469 Cb 0.37 -0.12 -0.14 0.00 -0.91 0.00 0.00 33.84 33.04 1gnj n VAL 469 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1gnj s SER 470 N -1.25 -0.10 0.29 4.52 0.15 -1.26 -4.94 113.70 111.11 1gnj s SER 470 Ca 0.00 0.25 -0.01 0.00 0.70 0.00 0.00 55.95 56.89 1gnj s SER 470 Cb 0.00 0.18 0.43 0.00 -1.71 0.00 0.00 66.02 64.93 1gnj s SER 470 CO 0.00 -0.10 1.86 -2.24 1.20 0.00 0.00 173.24 173.96 1gnj h ASP 471 N 6.73 0.78 -0.29 5.45 2.03 -1.98 -2.29 116.42 126.85 1gnj h ASP 471 Ca -0.36 -0.11 0.05 0.00 -0.73 0.00 0.00 57.03 55.88 1gnj h ASP 471 Cb 1.16 -0.20 -0.04 0.00 -0.83 0.00 0.00 39.33 39.42 1gnj h ASP 471 CO 0.43 0.72 0.02 0.03 -1.03 0.00 0.00 179.24 179.41 1gnj h ARG 472 N 0.84 0.11 -0.69 4.15 3.08 -1.99 0.27 114.38 120.14 1gnj h ARG 472 Ca 0.19 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.21 1gnj h ARG 472 Cb 0.20 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 1gnj h ARG 472 CO -0.01 0.07 0.31 0.28 -1.07 0.00 0.00 179.97 179.54 1gnj h VAL 473 N 0.11 1.24 -0.33 2.04 2.07 -1.93 -1.77 116.25 117.67 1gnj h VAL 473 Ca 0.14 -0.70 -0.05 0.00 0.82 0.00 0.00 66.70 66.91 1gnj h VAL 473 Cb 0.17 0.42 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 1gnj h VAL 473 CO -0.22 0.29 0.01 0.74 0.02 0.00 0.00 177.57 178.41 1gnj h THR 474 N 0.97 1.19 0.33 2.57 2.02 -0.82 0.33 112.91 119.50 1gnj h THR 474 Ca 0.23 -0.74 -0.02 0.00 0.77 0.00 0.00 66.41 66.66 1gnj h THR 474 Cb 0.16 0.93 0.00 0.00 -1.74 0.00 0.00 68.15 67.51 1gnj h THR 474 CO -0.02 0.25 -0.16 0.50 0.37 0.00 0.00 175.52 176.46 1gnj h LYS 475 N 0.49 -0.43 -0.68 6.66 1.63 0.27 -1.92 116.57 122.58 1gnj h LYS 475 Ca 0.11 0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.94 1gnj h LYS 475 Cb 0.30 0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 32.00 1gnj h LYS 475 CO 0.01 -0.18 0.43 0.00 -3.45 0.00 0.00 179.45 176.25 1gnj n THR 478 N -2.68 0.68 -1.35 0.00 -2.24 -0.73 -5.01 114.28 102.95 1gnj n THR 478 Ca 0.00 -0.84 -0.30 0.00 -2.27 0.00 0.00 64.05 60.64 1gnj n THR 478 Cb 0.20 0.71 0.22 0.00 -2.10 0.00 0.00 70.33 69.36 1gnj n THR 478 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1gnj s GLU 479 N -0.89 -0.48 0.66 -0.78 2.56 -0.69 -5.00 118.70 114.07 1gnj s GLU 479 Ca 0.14 -0.12 -0.15 0.00 0.00 0.00 0.00 54.97 54.84 1gnj s GLU 479 Cb 0.08 -1.69 0.00 0.00 2.00 0.00 0.00 34.13 34.52 1gnj s GLU 479 CO 0.11 -3.21 1.12 -1.54 -0.56 0.00 0.00 175.26 171.18 1gnj s SER 480 N -4.16 5.06 0.54 -1.70 1.04 -1.26 -4.77 113.70 108.43 1gnj s SER 480 Ca 0.71 2.04 0.28 0.00 0.48 0.00 0.00 55.95 59.46 1gnj s SER 480 Cb -0.09 -2.56 1.44 0.00 0.10 0.00 0.00 66.02 64.91 1gnj s SER 480 CO 0.55 -1.67 1.95 0.17 0.98 0.00 0.00 173.24 175.23 1gnj h LEU 481 N 0.06 0.00 0.00 2.42 -0.00 -1.97 0.27 115.31 116.09 1gnj h LEU 481 Ca -0.47 0.00 -0.10 0.00 -0.00 0.00 0.00 57.88 57.31 1gnj h LEU 481 Cb 1.25 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.90 1gnj h LEU 481 CO 0.54 0.00 -0.55 0.58 -0.00 0.00 0.00 178.44 179.01 1gnj h VAL 482 N 0.00 0.73 -0.00 0.15 2.07 -1.93 -3.34 116.25 113.93 1gnj h VAL 482 Ca 0.32 -2.05 0.00 0.00 0.82 0.00 0.00 66.70 65.79 1gnj h VAL 482 Cb 1.30 2.33 0.00 0.00 -1.52 0.00 0.00 31.29 33.40 1gnj h VAL 482 CO -0.00 0.41 -0.83 0.59 0.02 0.00 0.00 177.57 177.76 1gnj n ASN 483 N -3.17 1.14 0.00 0.57 3.02 -0.02 -4.66 115.26 112.13 1gnj n ASN 483 Ca 0.01 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.49 1gnj n ASN 483 Cb 0.72 0.89 0.00 0.00 -0.61 0.00 0.00 39.78 40.78 1gnj n ASN 483 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 1gnj n ARG 484 N -1.17 0.00 -0.17 3.52 0.63 -0.56 -0.04 116.66 118.87 1gnj n ARG 484 Ca 0.05 0.75 -0.02 0.00 -0.92 0.00 0.00 57.85 57.70 1gnj n ARG 484 Cb 0.33 -1.42 0.07 0.00 0.45 0.00 0.00 32.46 31.89 1gnj n ARG 484 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 1gnj h ARG 485 N 0.00 0.36 -0.95 -0.14 1.12 -1.84 -0.93 114.38 112.00 1gnj h ARG 485 Ca 0.00 -0.02 0.05 0.00 -1.11 0.00 0.00 59.98 58.90 1gnj h ARG 485 Cb 0.00 -0.08 -0.06 0.00 -0.01 0.00 0.00 29.97 29.82 1gnj h ARG 485 CO 0.00 0.24 0.62 -1.35 -3.11 0.00 0.00 179.97 176.37 1gnj h PRO 486 N 0.37 1.12 -0.45 0.20 0.11 -1.79 0.68 132.00 132.24 1gnj h PRO 486 Ca 0.25 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.30 1gnj h PRO 486 Cb 0.28 -0.25 -0.02 0.00 0.11 0.00 0.00 31.00 31.11 1gnj h PRO 486 CO -0.26 0.74 0.29 0.00 -0.21 0.00 0.00 178.00 178.56 1gnj h PHE 488 N 0.61 0.96 0.00 0.00 0.04 -0.53 -2.61 116.94 115.40 1gnj h PHE 488 Ca 0.16 -0.18 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 1gnj h PHE 488 Cb -0.04 -0.25 -0.00 0.00 2.20 0.00 0.00 35.95 37.86 1gnj h PHE 488 CO -0.04 0.91 -0.14 0.77 -0.60 0.00 0.00 178.31 179.21 1gnj h SER 489 N 0.79 0.00 0.61 2.17 0.02 -0.45 -2.55 113.55 114.14 1gnj h SER 489 Ca 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1gnj h SER 489 Cb 0.60 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.14 1gnj h SER 489 CO 0.04 0.14 -0.08 0.00 -1.14 0.00 0.00 176.83 175.79 1gnj n ALA 490 N -2.41 2.63 -1.90 3.77 0.00 -0.61 -4.85 120.51 117.13 1gnj n ALA 490 Ca -0.02 -0.19 -0.42 0.00 0.00 0.00 0.00 53.44 52.81 1gnj n ALA 490 Cb 0.23 -1.40 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 1gnj n ALA 490 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1gnj s LEU 491 N -2.69 4.37 0.42 0.00 1.43 -0.96 -4.99 118.68 116.26 1gnj s LEU 491 Ca 0.23 2.49 0.08 0.00 -1.03 0.00 0.00 54.13 55.90 1gnj s LEU 491 Cb 0.20 -3.56 -0.02 0.00 0.03 0.00 0.00 46.19 42.84 1gnj s LEU 491 CO 0.51 -0.91 0.38 -1.83 0.23 0.00 0.00 176.35 174.73 1gnj s GLU 492 N 2.94 2.52 0.22 1.70 -1.05 -1.26 -4.98 118.70 118.79 1gnj s GLU 492 Ca 0.75 -1.56 -0.31 0.00 -0.15 0.00 0.00 54.97 53.71 1gnj s GLU 492 Cb -0.40 -2.37 -0.15 0.00 -0.44 0.00 0.00 34.13 30.78 1gnj s GLU 492 CO 0.33 -0.22 1.08 0.28 0.95 0.00 0.00 175.26 177.69 1gnj n VAL 493 N -1.56 1.34 -2.65 1.83 0.31 -1.26 -4.71 118.33 111.63 1gnj n VAL 493 Ca 0.03 -0.34 -0.42 0.00 -0.01 0.00 0.00 64.34 63.61 1gnj n VAL 493 Cb 0.62 -0.88 -0.03 0.00 -0.91 0.00 0.00 33.84 32.64 1gnj n VAL 493 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1gnj s ASP 494 N -0.24 6.41 0.09 4.52 -1.08 -1.10 -4.89 116.67 120.37 1gnj s ASP 494 Ca 0.67 -0.04 -0.04 0.00 -0.52 0.00 0.00 52.55 52.63 1gnj s ASP 494 Cb -0.79 -2.52 -0.25 0.00 -1.46 0.00 0.00 42.92 37.90 1gnj s ASP 494 CO 0.55 -1.42 1.17 -0.33 0.52 0.00 0.00 175.17 175.66 1gnj h GLU 495 N 9.50 0.27 -0.64 4.34 4.39 -1.91 -3.33 114.58 127.20 1gnj h GLU 495 Ca -0.25 -0.44 0.05 0.00 0.34 0.00 0.00 59.36 59.06 1gnj h GLU 495 Cb 1.06 0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 29.82 1gnj h GLU 495 CO 1.16 1.19 0.36 1.15 -1.16 0.00 0.00 179.01 181.71 1gnj h THR 496 N 0.09 0.98 -0.92 1.13 2.02 -2.01 -3.45 112.91 110.74 1gnj h THR 496 Ca -0.12 -0.23 -0.56 0.00 0.77 0.00 0.00 66.41 66.27 1gnj h THR 496 Cb 1.90 0.25 0.10 0.00 -1.74 0.00 0.00 68.15 68.66 1gnj h THR 496 CO 0.19 0.12 -0.50 0.00 0.37 0.00 0.00 175.52 175.71 1gnj n TYR 497 N -4.79 -0.60 -3.95 3.16 9.36 -1.25 -4.99 117.16 114.09 1gnj n TYR 497 Ca 0.07 0.78 -0.35 0.00 3.32 0.00 0.00 57.90 61.73 1gnj n TYR 497 Cb 0.16 -1.63 -0.14 0.00 -0.63 0.00 0.00 39.34 37.09 1gnj n TYR 497 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1gnj s VAL 498 N -0.92 2.95 0.23 2.97 1.01 -1.26 -5.09 120.40 120.28 1gnj s VAL 498 Ca 0.53 -0.92 -0.30 0.00 0.00 0.00 0.00 61.98 61.30 1gnj s VAL 498 Cb -0.75 -2.46 -0.15 0.00 0.00 0.00 0.00 36.38 33.02 1gnj s VAL 498 CO 0.48 0.25 0.95 -0.81 0.00 0.00 0.00 175.10 175.98 1gnj n PRO 499 N 4.69 0.99 -1.91 2.72 -0.04 -1.26 -4.91 135.00 135.29 1gnj n PRO 499 Ca -0.17 0.35 -0.41 0.00 -0.04 0.00 0.00 63.50 63.23 1gnj n PRO 499 Cb 0.48 -1.68 -0.01 0.00 -0.04 0.00 0.00 33.50 32.24 1gnj n PRO 499 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1gnj s LYS 500 N -1.07 4.20 0.36 0.54 -0.14 -0.36 -4.93 119.74 118.33 1gnj s LYS 500 Ca 0.65 2.44 -0.27 0.00 -1.36 0.00 0.00 55.97 57.43 1gnj s LYS 500 Cb -0.80 -3.03 -0.09 0.00 -1.68 0.00 0.00 37.83 32.22 1gnj s LYS 500 CO 0.57 -0.45 1.24 -2.00 -0.76 0.00 0.00 175.35 173.95 1gnj s GLU 501 N -1.40 4.23 0.29 1.68 2.12 -1.26 -4.53 118.70 119.83 1gnj s GLU 501 Ca 0.55 2.05 -0.29 0.00 0.36 0.00 0.00 54.97 57.65 1gnj s GLU 501 Cb -0.44 -2.92 -0.13 0.00 0.26 0.00 0.00 34.13 30.89 1gnj s GLU 501 CO 0.54 -0.23 1.15 0.34 -0.54 0.00 0.00 175.26 176.52 1gnj n PHE 502 N 0.52 1.70 -3.69 5.30 7.35 -1.26 -4.99 117.46 122.39 1gnj n PHE 502 Ca 0.02 0.63 -0.27 0.00 -0.76 0.00 0.00 57.45 57.06 1gnj n PHE 502 Cb 0.44 -2.33 -0.16 0.00 0.35 0.00 0.00 39.48 37.78 1gnj n PHE 502 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1gnj s ASN 503 N -0.36 2.89 0.31 -2.13 3.84 -1.26 -5.03 114.94 113.20 1gnj s ASN 503 Ca 0.59 -0.86 0.06 0.00 0.21 0.00 0.00 52.86 52.87 1gnj s ASN 503 Cb -0.66 -0.51 0.73 0.00 -0.55 0.00 0.00 41.25 40.26 1gnj s ASN 503 CO 0.59 -0.33 1.80 0.00 -2.79 0.00 0.00 177.10 176.37 1gnj h ALA 504 N 8.29 1.69 -0.21 1.71 0.00 -1.97 -2.41 119.26 126.36 1gnj h ALA 504 Ca -0.16 0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1gnj h ALA 504 Cb 1.11 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.76 1gnj h ALA 504 CO 0.34 -0.03 -0.03 1.05 0.00 0.00 0.00 179.25 180.59 1gnj h GLU 505 N 0.79 0.03 -1.03 0.00 -0.00 -1.97 -2.49 114.58 109.91 1gnj h GLU 505 Ca 0.55 -0.00 0.29 0.00 -0.00 0.00 0.00 59.36 60.19 1gnj h GLU 505 Cb 0.83 -0.01 -0.05 0.00 -0.00 0.00 0.00 28.75 29.51 1gnj h GLU 505 CO -0.33 0.02 0.72 1.15 -0.00 0.00 0.00 179.01 180.57 1gnj h THR 506 N 0.03 0.51 -0.63 -1.06 2.02 -1.87 -1.00 112.91 110.90 1gnj h THR 506 Ca 0.10 -0.04 -0.38 0.00 0.77 0.00 0.00 66.41 66.86 1gnj h THR 506 Cb 0.14 0.38 -0.22 0.00 -1.74 0.00 0.00 68.15 66.71 1gnj h THR 506 CO -0.19 0.02 0.08 0.49 0.37 0.00 0.00 175.52 176.28 1gnj n PHE 507 N -4.33 2.04 -4.45 3.16 3.72 -0.94 -4.92 117.46 111.74 1gnj n PHE 507 Ca 0.22 -2.00 -0.34 0.00 -0.05 0.00 0.00 57.45 55.29 1gnj n PHE 507 Cb 1.02 -0.71 -0.12 0.00 -0.94 0.00 0.00 39.48 38.74 1gnj n PHE 507 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1gnj s THR 508 N -3.75 3.91 -0.04 4.37 2.01 -0.38 -4.97 115.64 116.79 1gnj s THR 508 Ca 0.51 -0.37 0.02 0.00 0.31 0.00 0.00 61.69 62.16 1gnj s THR 508 Cb 0.44 -2.68 0.01 0.00 0.01 0.00 0.00 72.50 70.28 1gnj s THR 508 CO 0.02 0.53 -0.09 -0.36 -0.69 0.00 0.00 174.62 174.03 1gnj s PHE 509 N -0.03 1.03 0.47 4.92 0.40 -1.26 -5.06 117.98 118.44 1gnj s PHE 509 Ca 0.01 -0.30 0.07 0.00 -0.60 0.00 0.00 56.93 56.12 1gnj s PHE 509 Cb -0.13 -0.77 0.01 0.00 0.51 0.00 0.00 43.02 42.64 1gnj s PHE 509 CO 0.03 -0.16 0.43 -1.01 0.70 0.00 0.00 175.22 175.20 1gnj s HIS 510 N 0.47 2.28 -1.36 0.36 3.76 -1.26 -4.72 115.29 114.81 1gnj s HIS 510 Ca -0.08 -0.61 0.11 0.00 -0.15 0.00 0.00 55.06 54.33 1gnj s HIS 510 Cb -0.12 -2.11 0.53 0.00 1.11 0.00 0.00 32.58 32.00 1gnj s HIS 510 CO 0.01 -0.33 1.26 0.00 -0.85 0.00 0.00 174.74 174.83 1gnj n ALA 511 N -1.68 1.64 0.28 -1.40 0.00 -1.26 -3.07 120.51 115.02 1gnj n ALA 511 Ca 0.03 -0.05 0.02 0.00 0.00 0.00 0.00 53.44 53.45 1gnj n ALA 511 Cb 0.62 -1.17 0.14 0.00 0.00 0.00 0.00 19.45 19.04 1gnj n ALA 511 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1gnj n ASP 512 N -1.32 0.00 -0.16 0.00 5.75 -1.26 -0.42 116.55 119.13 1gnj n ASP 512 Ca 0.05 -0.03 0.11 0.00 -0.01 0.00 0.00 54.79 54.91 1gnj n ASP 512 Cb 0.09 -0.10 -0.01 0.00 -1.03 0.00 0.00 41.12 40.08 1gnj n ASP 512 CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 1gnj n ILE 513 N -1.10 0.00 0.02 2.12 -6.64 -1.18 -3.23 119.36 109.35 1gnj n ILE 513 Ca 0.03 -0.08 -0.10 0.00 -1.77 0.00 0.00 62.75 60.83 1gnj n ILE 513 Cb 0.02 0.94 -0.13 0.00 -1.44 0.00 0.00 39.64 39.03 1gnj n ILE 513 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1gnj h THR 515 N 0.02 0.51 -4.16 0.00 1.03 -1.69 -3.47 112.91 105.15 1gnj h THR 515 Ca -0.20 -1.83 -0.51 0.00 -0.01 0.00 0.00 66.41 63.86 1gnj h THR 515 Cb 1.94 2.10 0.18 0.00 -1.07 0.00 0.00 68.15 71.30 1gnj h THR 515 CO 0.11 0.29 0.23 -0.76 -0.01 0.00 0.00 175.52 175.38 1gnj s LEU 516 N -6.03 2.63 0.46 0.00 1.43 -1.20 -5.03 118.68 110.94 1gnj s LEU 516 Ca 0.01 1.96 -0.04 0.00 -1.03 0.00 0.00 54.13 55.03 1gnj s LEU 516 Cb 0.08 -4.37 -0.03 0.00 0.03 0.00 0.00 46.19 41.90 1gnj s LEU 516 CO 0.77 -2.90 0.74 -0.94 0.23 0.00 0.00 176.35 174.25 1gnj s SER 517 N -2.92 6.18 0.02 2.29 1.04 -1.26 -4.76 113.70 114.30 1gnj s SER 517 Ca 0.65 0.78 -0.03 0.00 0.48 0.00 0.00 55.95 57.83 1gnj s SER 517 Cb -0.21 -2.12 -0.01 0.00 0.10 0.00 0.00 66.02 63.79 1gnj s SER 517 CO 0.58 -0.57 0.91 -0.62 0.98 0.00 0.00 173.24 174.52 1gnj n GLU 518 N -2.19 -0.05 -0.30 4.02 -0.58 -1.26 0.35 120.64 120.63 1gnj n GLU 518 Ca -0.00 0.91 0.31 0.00 -0.42 0.00 0.00 57.16 57.96 1gnj n GLU 518 Cb 0.56 -1.36 0.68 0.00 -0.57 0.00 0.00 31.44 30.75 1gnj n GLU 518 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 1gnj h LYS 519 N 0.00 0.10 0.21 3.49 1.79 -1.99 0.80 116.57 120.96 1gnj h LYS 519 Ca 0.02 -0.01 -0.29 0.00 -2.18 0.00 0.00 60.65 58.19 1gnj h LYS 519 Cb 0.04 -0.02 0.03 0.00 -1.58 0.00 0.00 32.23 30.70 1gnj h LYS 519 CO -0.10 0.07 -1.29 0.93 -1.08 0.00 0.00 179.45 177.98 1gnj h GLU 520 N 0.11 0.44 0.03 3.15 4.39 -0.49 -2.87 114.58 119.34 1gnj h GLU 520 Ca 0.56 -0.75 -0.00 0.00 0.34 0.00 0.00 59.36 59.51 1gnj h GLU 520 Cb 1.99 0.28 0.00 0.00 -0.10 0.00 0.00 28.75 30.92 1gnj h GLU 520 CO -0.09 1.36 -0.02 0.00 -1.16 0.00 0.00 179.01 179.10 1gnj h ARG 521 N -0.05 -0.04 0.28 2.33 3.08 0.16 -2.07 114.38 118.07 1gnj h ARG 521 Ca -0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.82 1gnj h ARG 521 Cb 1.98 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 32.00 1gnj h ARG 521 CO 0.22 0.10 -0.47 1.96 -1.07 0.00 0.00 179.97 180.71 1gnj h GLN 522 N -0.17 -0.78 -1.00 0.04 4.20 -1.05 0.51 115.11 116.86 1gnj h GLN 522 Ca -0.00 0.05 0.18 0.00 0.06 0.00 0.00 58.65 58.94 1gnj h GLN 522 Cb 0.16 0.18 -0.10 0.00 0.30 0.00 0.00 27.48 28.02 1gnj h GLN 522 CO 0.01 -0.52 0.62 0.82 -0.67 0.00 0.00 178.83 179.08 1gnj h ILE 523 N -0.81 0.74 -0.36 2.54 2.04 -1.48 0.69 117.51 120.87 1gnj h ILE 523 Ca -0.02 -0.26 -0.09 0.00 1.00 0.00 0.00 64.86 65.49 1gnj h ILE 523 Cb 0.77 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1gnj h ILE 523 CO -0.17 0.14 -0.11 0.11 0.00 0.00 0.00 178.15 178.11 1gnj h LYS 524 N 0.77 0.71 -0.38 2.37 1.57 -0.68 0.10 116.57 121.03 1gnj h LYS 524 Ca 0.56 -0.28 -0.03 0.00 -1.87 0.00 0.00 60.65 59.02 1gnj h LYS 524 Cb 0.86 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.12 1gnj h LYS 524 CO -0.34 0.88 0.13 0.87 -0.57 0.00 0.00 179.45 180.41 1gnj h LYS 525 N 0.50 0.58 -0.11 3.15 1.57 0.13 -2.18 116.57 120.20 1gnj h LYS 525 Ca 0.09 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1gnj h LYS 525 Cb 0.63 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.85 1gnj h LYS 525 CO 0.04 0.58 -0.20 1.96 -0.57 0.00 0.00 179.45 181.27 1gnj h GLN 526 N 0.46 0.19 -0.36 3.15 4.20 0.37 -0.68 115.11 122.44 1gnj h GLN 526 Ca 0.12 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.63 1gnj h GLN 526 Cb 0.24 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1gnj h GLN 526 CO -0.01 0.39 -0.37 1.15 -0.67 0.00 0.00 178.83 179.32 1gnj h THR 527 N 0.18 1.28 -0.35 -0.54 2.02 -0.73 -2.05 112.91 112.71 1gnj h THR 527 Ca 0.03 -1.54 -0.09 0.00 0.77 0.00 0.00 66.41 65.58 1gnj h THR 527 Cb 0.46 1.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.29 1gnj h THR 527 CO 0.03 0.51 -0.15 0.00 0.37 0.00 0.00 175.52 176.28 1gnj h ALA 528 N 0.75 1.08 -0.04 6.16 0.00 -0.91 -2.76 119.26 123.54 1gnj h ALA 528 Ca 0.06 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1gnj h ALA 528 Cb 0.96 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1gnj h ALA 528 CO 0.09 0.56 0.03 1.25 0.00 0.00 0.00 179.25 181.18 1gnj h LEU 529 N 0.58 0.05 -0.41 0.00 5.85 -0.81 0.33 115.31 120.90 1gnj h LEU 529 Ca 0.10 -0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.83 1gnj h LEU 529 Cb 0.59 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.56 1gnj h LEU 529 CO 0.04 0.06 0.17 0.58 -0.34 0.00 0.00 178.44 178.95 1gnj h VAL 530 N 0.04 0.92 -0.45 1.05 2.07 -1.25 -1.41 116.25 117.22 1gnj h VAL 530 Ca 0.02 -0.12 -0.01 0.00 0.82 0.00 0.00 66.70 67.41 1gnj h VAL 530 Cb 0.02 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1gnj h VAL 530 CO -0.00 0.06 0.25 -0.33 0.02 0.00 0.00 177.57 177.57 1gnj h GLU 531 N 0.35 0.62 -0.17 1.57 4.39 -1.22 0.68 114.58 120.80 1gnj h GLU 531 Ca 0.18 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 1gnj h GLU 531 Cb 0.13 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1gnj h GLU 531 CO -0.16 0.46 0.07 1.25 -1.16 0.00 0.00 179.01 179.47 1gnj h LEU 532 N 0.63 0.23 -0.75 1.33 5.85 0.07 -1.99 115.31 120.68 1gnj h LEU 532 Ca 0.16 -0.16 -0.09 0.00 0.84 0.00 0.00 57.88 58.64 1gnj h LEU 532 Cb 0.02 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1gnj h LEU 532 CO -0.03 0.32 0.02 0.58 -0.34 0.00 0.00 178.44 178.99 1gnj h VAL 533 N 0.13 1.26 0.00 1.05 2.07 -0.52 -0.77 116.25 119.46 1gnj h VAL 533 Ca 0.06 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 66.49 1gnj h VAL 533 Cb 0.16 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1gnj h VAL 533 CO -0.01 0.39 0.00 0.11 0.02 0.00 0.00 177.57 178.09 1gnj h LYS 534 N 0.90 0.00 0.01 1.57 1.57 -0.69 -0.76 116.57 119.17 1gnj h LYS 534 Ca 0.17 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.59 1gnj h LYS 534 Cb 0.50 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.75 1gnj h LYS 534 CO 0.02 0.00 -2.19 1.58 -0.57 0.00 0.00 179.45 178.29 1gnj n HIS 535 N -2.80 0.38 -3.26 -1.35 -0.00 -0.77 -1.22 115.22 106.20 1gnj n HIS 535 Ca -0.00 0.12 -0.25 0.00 0.46 0.00 0.00 57.72 58.05 1gnj n HIS 535 Cb 0.20 -1.06 -0.07 0.00 -0.12 0.00 0.00 29.99 28.93 1gnj n HIS 535 CO 0.00 0.00 0.00 1.63 0.46 0.00 0.00 176.34 178.43 1gnj n LYS 536 N -2.98 1.39 0.19 1.57 4.76 -0.34 -4.62 118.16 118.13 1gnj n LYS 536 Ca -0.31 -3.76 0.14 0.00 -2.87 0.00 0.00 58.31 51.51 1gnj n LYS 536 Cb 1.09 -1.61 0.67 0.00 -1.84 0.00 0.00 35.03 33.34 1gnj n LYS 536 CO 0.00 0.00 0.00 -1.00 -1.37 0.00 0.00 177.40 175.03 1gnj h PRO 537 N 4.00 0.00 -0.12 1.97 0.13 -1.39 -2.59 132.00 133.99 1gnj h PRO 537 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1gnj h PRO 537 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1gnj h PRO 537 CO 0.60 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.00 1gnj n LYS 538 N -2.47 2.10 -2.04 0.86 4.76 -1.26 -4.94 118.16 115.16 1gnj n LYS 538 Ca -0.00 -1.62 -0.41 0.00 -2.87 0.00 0.00 58.31 53.41 1gnj n LYS 538 Cb 0.13 -1.47 -0.02 0.00 -1.84 0.00 0.00 35.03 31.84 1gnj n LYS 538 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1gnj s ALA 539 N -1.86 3.53 0.94 7.82 0.00 -0.98 -5.00 121.76 126.21 1gnj s ALA 539 Ca 0.34 1.33 -0.12 0.00 0.00 0.00 0.00 51.96 53.51 1gnj s ALA 539 Cb 0.20 -3.52 0.16 0.00 0.00 0.00 0.00 23.12 19.96 1gnj s ALA 539 CO 0.31 -0.74 1.11 0.99 0.00 0.00 0.00 175.76 177.43 1gnj s THR 540 N -0.95 2.13 -0.29 0.00 2.01 -1.26 -4.85 115.64 112.43 1gnj s THR 540 Ca 0.51 0.04 0.27 0.00 0.31 0.00 0.00 61.69 62.83 1gnj s THR 540 Cb -0.41 -2.66 0.31 0.00 0.01 0.00 0.00 72.50 69.75 1gnj s THR 540 CO 0.53 -0.05 1.81 0.07 -0.69 0.00 0.00 174.62 176.29 1gnj h LYS 541 N -1.66 0.00 0.00 4.92 -0.00 -1.98 -1.96 116.57 115.89 1gnj h LYS 541 Ca -0.52 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.13 1gnj h LYS 541 Cb 1.33 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.56 1gnj h LYS 541 CO 0.59 0.00 -0.02 0.93 -0.00 0.00 0.00 179.45 180.96 1gnj h GLU 542 N 0.00 0.00 -0.77 0.07 4.39 -1.99 -2.41 114.58 113.87 1gnj h GLU 542 Ca 0.00 0.00 0.18 0.00 0.34 0.00 0.00 59.36 59.88 1gnj h GLU 542 Cb 0.50 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.03 1gnj h GLU 542 CO 0.00 0.00 0.13 1.96 -1.16 0.00 0.00 179.01 179.94 1gnj h GLN 543 N -0.69 0.19 0.45 2.33 4.20 -1.92 0.98 115.11 120.67 1gnj h GLN 543 Ca 0.00 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 1gnj h GLN 543 Cb 0.02 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1gnj h GLN 543 CO 0.00 0.13 -0.22 1.25 -0.67 0.00 0.00 178.83 179.32 1gnj h LEU 544 N 0.20 -0.52 -1.61 1.46 5.85 -1.49 -1.97 115.31 117.23 1gnj h LEU 544 Ca 0.45 0.01 0.09 0.00 0.84 0.00 0.00 57.88 59.27 1gnj h LEU 544 Cb 0.81 0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.94 1gnj h LEU 544 CO -0.59 -0.36 0.40 0.50 -0.34 0.00 0.00 178.44 178.04 1gnj h LYS 545 N -0.62 0.43 0.36 1.25 3.64 -0.70 -0.17 116.57 120.77 1gnj h LYS 545 Ca -0.06 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1gnj h LYS 545 Cb 0.47 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1gnj h LYS 545 CO 0.10 0.29 -0.27 0.00 -2.27 0.00 0.00 179.45 177.30 1gnj h ALA 546 N 1.69 -0.63 0.23 5.00 0.00 -0.29 0.26 119.26 125.53 1gnj h ALA 546 Ca 0.27 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1gnj h ALA 546 Cb 0.48 0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1gnj h ALA 546 CO -0.08 -0.87 -0.17 0.28 0.00 0.00 0.00 179.25 178.41 1gnj h VAL 547 N -0.63 0.64 -1.02 0.00 2.07 -0.59 -1.13 116.25 115.60 1gnj h VAL 547 Ca -0.03 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.74 1gnj h VAL 547 Cb 0.54 0.64 -0.10 0.00 -1.52 0.00 0.00 31.29 30.86 1gnj h VAL 547 CO 0.00 0.00 0.64 0.24 0.02 0.00 0.00 177.57 178.47 1gnj h MET 548 N -0.40 0.47 -0.20 1.57 2.07 -0.87 0.24 114.93 117.81 1gnj h MET 548 Ca -0.02 -0.03 -0.07 0.00 -2.07 0.00 0.00 59.70 57.51 1gnj h MET 548 Cb 0.35 -0.11 -0.00 0.00 -1.87 0.00 0.00 31.60 29.97 1gnj h MET 548 CO 0.00 0.31 -0.15 -0.44 1.07 0.00 0.00 176.91 177.70 1gnj h ASP 549 N 0.48 0.47 -0.43 1.22 5.19 -0.30 -1.35 116.42 121.71 1gnj h ASP 549 Ca 0.60 -0.45 0.01 0.00 -0.62 0.00 0.00 57.03 56.57 1gnj h ASP 549 Cb 1.35 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 40.70 1gnj h ASP 549 CO -0.34 0.83 0.29 0.44 -3.12 0.00 0.00 179.24 177.33 1gnj h ASP 550 N 0.13 0.47 0.46 6.45 3.32 0.56 0.53 116.42 128.35 1gnj h ASP 550 Ca 0.04 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.97 1gnj h ASP 550 Cb 0.68 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 40.10 1gnj h ASP 550 CO 0.04 0.34 -0.48 0.15 -1.72 0.00 0.00 179.24 177.57 1gnj h PHE 551 N 0.56 0.02 0.54 4.55 3.57 -0.48 -2.04 116.94 123.66 1gnj h PHE 551 Ca 0.16 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.64 1gnj h PHE 551 Cb -0.03 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.70 1gnj h PHE 551 CO -0.00 0.49 -0.38 0.00 -2.23 0.00 0.00 178.31 176.19 1gnj h ALA 552 N 1.51 -0.92 0.78 2.41 0.00 0.27 -2.43 119.26 120.89 1gnj h ALA 552 Ca -0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 1gnj h ALA 552 Cb 0.85 0.50 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1gnj h ALA 552 CO 0.06 -1.04 -0.46 0.00 0.00 0.00 0.00 179.25 177.81 1gnj h ALA 553 N -0.55 -1.27 -0.57 0.00 0.00 -1.46 -3.15 119.26 112.27 1gnj h ALA 553 Ca -0.06 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.67 1gnj h ALA 553 Cb 0.74 0.57 -0.07 0.00 0.00 0.00 0.00 17.79 19.03 1gnj h ALA 553 CO 0.03 -1.22 -0.30 0.34 0.00 0.00 0.00 179.25 178.10 1gnj n PHE 554 N -5.40 -0.17 0.01 0.00 -0.00 -0.77 0.31 117.46 111.45 1gnj n PHE 554 Ca -0.14 0.70 -0.12 0.00 -0.00 0.00 0.00 57.45 57.90 1gnj n PHE 554 Cb 0.48 -0.59 -0.07 0.00 -0.00 0.00 0.00 39.48 39.29 1gnj n PHE 554 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.76 177.04 1gnj h VAL 555 N 0.00 0.00 0.48 -2.13 2.07 -1.40 -2.44 116.25 112.83 1gnj h VAL 555 Ca 0.12 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.63 1gnj h VAL 555 Cb 0.26 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.01 1gnj h VAL 555 CO -0.54 0.00 -0.45 -0.33 0.02 0.00 0.00 177.57 176.27 1gnj h GLU 556 N -0.47 -0.89 0.00 1.57 5.08 -0.11 0.20 114.58 119.96 1gnj h GLU 556 Ca 0.02 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1gnj h GLU 556 Cb 0.52 0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1gnj h GLU 556 CO -0.31 -0.60 0.00 1.17 -1.00 0.00 0.00 179.01 178.28 1gnj n LYS 557 N -5.53 0.00 0.00 2.33 3.00 0.11 -1.20 118.16 116.86 1gnj n LYS 557 Ca -0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.20 1gnj n LYS 557 Cb 0.43 -1.18 0.00 0.00 0.00 0.00 0.00 35.03 34.29 1gnj n LYS 557 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1gnj n LYS 560 N -4.57 0.98 -3.99 0.00 4.81 -0.62 -4.84 118.16 109.93 1gnj n LYS 560 Ca -0.17 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 56.97 1gnj n LYS 560 Cb 0.49 -1.05 -0.05 0.00 0.02 0.00 0.00 35.03 34.43 1gnj n LYS 560 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1gnj s ALA 561 N -0.08 3.75 -0.50 3.14 0.00 -1.24 -4.96 121.76 121.87 1gnj s ALA 561 Ca 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 51.96 51.02 1gnj s ALA 561 Cb 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 23.12 21.51 1gnj s ALA 561 CO 0.00 0.78 0.73 -0.25 0.00 0.00 0.00 175.76 177.02 1gnj n ASP 562 N 0.41 0.00 -3.37 0.00 9.92 -1.26 -4.25 116.55 118.00 1gnj n ASP 562 Ca -0.07 0.24 0.02 0.00 -0.53 0.00 0.00 54.79 54.44 1gnj n ASP 562 Cb 0.51 -0.24 -0.04 0.00 -0.64 0.00 0.00 41.12 40.71 1gnj n ASP 562 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1gnj s ASP 563 N -2.45 -0.39 0.00 -2.24 2.15 -1.26 -5.16 116.67 107.32 1gnj s ASP 563 Ca 0.00 0.54 0.00 0.00 0.43 0.00 0.00 52.55 53.52 1gnj s ASP 563 Cb 0.00 1.41 0.00 0.00 -0.30 0.00 0.00 42.92 44.03 1gnj s ASP 563 CO 0.00 -0.08 0.00 2.29 -0.17 0.00 0.00 175.17 177.21 1gnj n LYS 564 N 4.63 3.14 0.00 4.34 2.85 -1.26 -3.57 118.16 128.28 1gnj n LYS 564 Ca -0.10 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.16 1gnj n LYS 564 Cb 0.54 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.92 1gnj n LYS 564 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1gnj n GLU 565 N 0.00 0.00 0.22 -1.58 -0.58 -1.26 -2.52 120.64 114.92 1gnj n GLU 565 Ca 0.00 0.00 -0.16 0.00 -0.42 0.00 0.00 57.16 56.58 1gnj n GLU 565 Cb 0.00 0.00 -0.09 0.00 -0.57 0.00 0.00 31.44 30.78 1gnj n GLU 565 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1gnj h THR 566 N 0.00 0.12 -0.60 2.62 2.02 -1.98 -1.34 112.91 113.74 1gnj h THR 566 Ca 0.00 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.30 1gnj h THR 566 Cb 0.00 0.12 -0.10 0.00 -1.74 0.00 0.00 68.15 66.43 1gnj h THR 566 CO 0.00 0.00 -0.03 0.00 0.37 0.00 0.00 175.52 175.86 1gnj n PHE 568 N -5.30 0.00 -0.10 0.00 3.01 -1.02 -1.22 117.46 112.83 1gnj n PHE 568 Ca 0.08 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.40 1gnj n PHE 568 Cb 0.34 -0.33 -0.10 0.00 -0.01 0.00 0.00 39.48 39.38 1gnj n PHE 568 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1gnj n ALA 569 N -1.33 1.56 0.02 4.37 0.00 0.11 -3.65 120.51 121.58 1gnj n ALA 569 Ca 0.07 -0.90 -0.02 0.00 0.00 0.00 0.00 53.44 52.59 1gnj n ALA 569 Cb 0.14 0.01 -0.01 0.00 0.00 0.00 0.00 19.45 19.59 1gnj n ALA 569 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 1gnj h GLU 570 N 0.00 -0.12 -0.66 0.00 4.11 -0.74 -3.08 114.58 114.08 1gnj h GLU 570 Ca -0.46 0.01 0.07 0.00 0.07 0.00 0.00 59.36 59.05 1gnj h GLU 570 Cb 1.74 0.03 -0.06 0.00 0.50 0.00 0.00 28.75 30.95 1gnj h GLU 570 CO -0.06 -0.08 0.33 0.93 0.07 0.00 0.00 179.01 180.20 1gnj h GLU 571 N -0.69 0.58 -0.90 1.06 4.39 -1.37 -2.05 114.58 115.60 1gnj h GLU 571 Ca -0.01 -0.03 0.17 0.00 0.34 0.00 0.00 59.36 59.82 1gnj h GLU 571 Cb 0.10 -0.13 -0.10 0.00 -0.10 0.00 0.00 28.75 28.51 1gnj h GLU 571 CO 0.02 0.38 0.48 0.78 -1.16 0.00 0.00 179.01 179.51 1gnj h GLY 572 N 0.60 1.52 1.04 -3.84 0.00 -1.63 0.21 103.07 100.96 1gnj h GLY 572 Ca 0.31 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 47.29 1gnj h GLY 572 CO -0.23 -0.08 0.04 0.50 0.00 0.00 0.00 176.54 176.77 1gnj h LYS 573 N 0.62 0.98 -0.28 4.80 6.56 -1.29 -2.62 116.57 125.34 1gnj h LYS 573 Ca 0.51 -0.29 0.01 0.00 -1.06 0.00 0.00 60.65 59.82 1gnj h LYS 573 Cb 0.79 -0.10 -0.02 0.00 -0.57 0.00 0.00 32.23 32.33 1gnj h LYS 573 CO -0.40 0.96 0.16 0.87 -2.06 0.00 0.00 179.45 178.98 1gnj h LYS 574 N 0.86 0.32 0.38 3.15 1.57 -0.37 -2.20 116.57 120.29 1gnj h LYS 574 Ca 0.17 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1gnj h LYS 574 Cb 0.49 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1gnj h LYS 574 CO 0.02 0.21 -0.35 1.25 -0.57 0.00 0.00 179.45 180.01 1gnj h LEU 575 N 0.33 -0.94 -0.92 2.94 5.85 -0.60 0.60 115.31 122.56 1gnj h LEU 575 Ca 0.11 0.08 0.14 0.00 0.84 0.00 0.00 57.88 59.05 1gnj h LEU 575 Cb 0.00 0.31 -0.09 0.00 0.37 0.00 0.00 40.66 41.26 1gnj h LEU 575 CO -0.06 -0.50 0.53 0.58 -0.34 0.00 0.00 178.44 178.66 1gnj h VAL 576 N -0.75 0.82 0.25 1.05 2.07 -1.42 0.16 116.25 118.43 1gnj h VAL 576 Ca -0.03 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.21 1gnj h VAL 576 Cb 0.67 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1gnj h VAL 576 CO -0.04 0.14 -0.12 0.00 0.02 0.00 0.00 177.57 177.57 1gnj h ALA 577 N 1.55 -0.33 0.26 1.67 0.00 -1.00 0.17 119.26 121.58 1gnj h ALA 577 Ca 0.48 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1gnj h ALA 577 Cb 0.59 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1gnj h ALA 577 CO -0.32 -0.56 -0.28 0.00 0.00 0.00 0.00 179.25 178.09 1gnj h ALA 578 N 0.10 -0.96 -0.53 0.00 0.00 -0.29 -2.32 119.26 115.26 1gnj h ALA 578 Ca -0.03 -0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.87 1gnj h ALA 578 Cb 0.42 0.54 -0.11 0.00 0.00 0.00 0.00 17.79 18.65 1gnj h ALA 578 CO 0.06 -0.98 -0.35 0.77 0.00 0.00 0.00 179.25 178.74 1gnj h SER 579 N -0.55 -1.21 -0.99 0.00 0.02 -0.74 0.20 113.55 110.28 1gnj h SER 579 Ca -0.03 0.22 0.28 0.00 -0.84 0.00 0.00 61.79 61.42 1gnj h SER 579 Cb 0.48 0.58 -0.14 0.00 0.14 0.00 0.00 62.40 63.46 1gnj h SER 579 CO -0.05 -0.32 0.55 1.56 -1.14 0.00 0.00 176.83 177.44 1gnj h GLN 580 N -0.20 0.42 -0.09 3.45 7.50 -0.50 -1.17 115.11 124.51 1gnj h GLN 580 Ca 0.20 -0.03 -0.04 0.00 0.50 0.00 0.00 58.65 59.29 1gnj h GLN 580 Cb 0.55 -0.10 -0.00 0.00 0.05 0.00 0.00 27.48 27.99 1gnj h GLN 580 CO -0.64 0.28 -0.10 0.00 -1.50 0.00 0.00 178.83 176.87 1gnj h ALA 581 N 1.79 0.14 0.00 3.87 0.00 -0.08 -3.04 119.26 121.94 1gnj h ALA 581 Ca 0.67 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1gnj h ALA 581 Cb 1.41 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1gnj h ALA 581 CO -0.55 -0.03 0.00 0.00 0.00 0.00 0.00 179.25 178.68 1gnj n ALA 582 N -2.40 1.88 -1.86 0.00 0.00 -0.47 -2.36 120.51 115.31 1gnj n ALA 582 Ca -0.07 -0.06 0.04 0.00 0.00 0.00 0.00 53.44 53.36 1gnj n ALA 582 Cb 0.33 -1.15 0.07 0.00 0.00 0.00 0.00 19.45 18.70 1gnj n ALA 582 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1gnj n LEU 583 N -0.92 1.19 0.00 0.00 4.77 -1.02 -5.03 117.00 115.99 1gnj n LEU 583 Ca 0.07 -2.17 0.00 0.00 -0.03 0.00 0.00 56.01 53.88 1gnj n LEU 583 Cb 0.03 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 1gnj n LEU 583 CO 0.05 0.59 0.00 0.61 -1.33 0.00 0.00 177.39 177.31