#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nji h VAL 2 N 0.00 0.00 -3.44 1.08 2.07 -2.03 -3.29 116.25 110.63 1nji h VAL 2 Ca 0.00 0.00 -0.61 0.00 0.82 0.00 0.00 66.70 66.91 1nji h VAL 2 Cb 0.00 0.39 -0.39 0.00 -1.52 0.00 0.00 31.29 29.77 1nji h VAL 2 CO 0.00 0.00 -0.76 -0.22 0.02 0.00 0.00 177.57 176.61 1nji s LEU 3 N -4.81 2.95 0.61 2.57 2.96 -1.26 -5.13 118.68 116.57 1nji s LEU 3 Ca -0.02 -1.60 -0.06 0.00 -0.22 0.00 0.00 54.13 52.23 1nji s LEU 3 Cb 0.05 -1.14 0.02 0.00 0.50 0.00 0.00 46.19 45.62 1nji s LEU 3 CO 0.16 -0.35 0.91 -1.00 -1.32 0.00 0.00 176.35 174.75 1nji s HIS 4 N 1.37 3.17 0.19 5.38 3.76 -1.24 -4.99 115.29 122.94 1nji s HIS 4 Ca 0.05 0.57 -0.10 0.00 -0.15 0.00 0.00 55.06 55.43 1nji s HIS 4 Cb -0.18 -2.81 0.11 0.00 1.11 0.00 0.00 32.58 30.81 1nji s HIS 4 CO -0.14 -0.92 1.73 0.28 -0.85 0.00 0.00 174.74 174.84 1nji h VAL 5 N -0.23 1.25 -0.48 -0.90 2.07 -2.00 -2.64 116.25 113.33 1nji h VAL 5 Ca -0.45 -0.86 0.02 0.00 0.82 0.00 0.00 66.70 66.23 1nji h VAL 5 Cb 1.27 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 1nji h VAL 5 CO 0.60 0.34 0.28 1.56 0.02 0.00 0.00 177.57 180.37 1nji h GLN 6 N 1.00 0.54 -0.14 1.57 4.20 -1.99 -1.68 115.11 118.61 1nji h GLN 6 Ca 0.22 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.90 1nji h GLN 6 Cb 0.29 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.94 1nji h GLN 6 CO -0.01 0.36 0.08 0.93 -0.67 0.00 0.00 178.83 179.52 1nji h GLU 7 N 0.56 0.19 -0.05 1.46 5.08 -1.91 -0.33 114.58 119.58 1nji h GLU 7 Ca 0.19 -0.01 -0.23 0.00 -1.00 0.00 0.00 59.36 58.31 1nji h GLU 7 Cb 0.03 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.24 1nji h GLU 7 CO -0.09 0.14 -0.90 0.82 -1.00 0.00 0.00 179.01 177.98 1nji h ILE 8 N 0.19 1.34 0.00 3.13 2.04 -0.98 -3.12 117.51 120.11 1nji h ILE 8 Ca 0.05 -2.23 -0.05 0.00 1.00 0.00 0.00 64.86 63.63 1nji h ILE 8 Cb 0.01 2.25 -0.01 0.00 -0.74 0.00 0.00 36.82 38.33 1nji h ILE 8 CO -0.01 0.68 -0.22 0.03 0.00 0.00 0.00 178.15 178.63 1nji h ARG 9 N 0.35 0.00 -0.01 2.37 3.08 -0.66 -2.67 114.38 116.84 1nji h ARG 9 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1nji h ARG 9 Cb 1.52 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.57 1nji h ARG 9 CO 0.17 0.22 0.00 -0.25 -1.07 0.00 0.00 179.97 179.04 1nji n ASP 10 N -3.28 0.46 -4.92 7.04 8.00 -0.20 -4.81 116.55 118.84 1nji n ASP 10 Ca 0.01 -1.22 -0.26 0.00 0.71 0.00 0.00 54.79 54.03 1nji n ASP 10 Cb 0.49 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.57 1nji n ASP 10 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1nji s MET 11 N -1.99 3.55 0.32 -1.24 -1.94 -1.01 -5.06 119.30 111.93 1nji s MET 11 Ca 0.42 -0.10 -0.06 0.00 -1.71 0.00 0.00 55.69 54.24 1nji s MET 11 Cb 0.20 -2.59 -0.05 0.00 2.01 0.00 0.00 34.83 34.40 1nji s MET 11 CO 0.33 0.08 0.62 -0.08 -0.01 0.00 0.00 175.02 175.96 1nji s THR 12 N -2.34 4.96 0.43 2.05 -1.32 -1.26 -4.88 115.64 113.27 1nji s THR 12 Ca 0.43 0.21 0.27 0.00 -1.21 0.00 0.00 61.69 61.39 1nji s THR 12 Cb -0.10 -3.73 0.46 0.00 -1.51 0.00 0.00 72.50 67.61 1nji s THR 12 CO 0.36 -0.38 1.67 -0.65 -2.21 0.00 0.00 174.62 173.41 1nji h PRO 13 N 1.54 0.17 0.00 7.08 0.11 -1.96 0.69 132.00 139.63 1nji h PRO 13 Ca -0.48 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.52 1nji h PRO 13 Cb 1.19 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1nji h PRO 13 CO 0.65 0.11 -0.49 0.00 -0.21 0.00 0.00 178.00 178.06 1nji h ALA 14 N 1.60 0.92 0.00 -0.75 0.00 -1.92 -2.86 119.26 116.26 1nji h ALA 14 Ca 0.75 -0.45 -0.18 0.00 0.00 0.00 0.00 54.91 55.03 1nji h ALA 14 Cb 2.26 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.94 1nji h ALA 14 CO -0.37 0.62 -0.85 0.93 0.00 0.00 0.00 179.25 179.57 1nji h GLU 15 N 0.00 0.00 -0.09 0.00 5.08 0.01 -2.23 114.58 117.34 1nji h GLU 15 Ca -0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 1nji h GLU 15 Cb 1.05 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 1nji h GLU 15 CO 0.06 0.85 -0.05 0.00 -1.00 0.00 0.00 179.01 178.87 1nji h ARG 16 N 0.00 0.20 -0.86 2.33 3.08 -1.28 0.19 114.38 118.04 1nji h ARG 16 Ca -0.01 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 1nji h ARG 16 Cb 1.58 -0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.58 1nji h ARG 16 CO 0.11 0.57 0.47 0.93 -1.07 0.00 0.00 179.97 180.99 1nji h GLU 17 N -0.17 1.20 -0.55 0.04 5.08 -1.53 1.06 114.58 119.71 1nji h GLU 17 Ca 0.02 -0.14 -0.10 0.00 -1.00 0.00 0.00 59.36 58.14 1nji h GLU 17 Cb 0.52 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 1nji h GLU 17 CO 0.02 0.87 -0.05 0.00 -1.00 0.00 0.00 179.01 178.85 1nji h ALA 18 N 1.32 0.74 -0.06 3.43 0.00 -1.30 -0.96 119.26 122.43 1nji h ALA 18 Ca 0.30 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 1nji h ALA 18 Cb 0.02 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1nji h ALA 18 CO -0.05 0.61 -0.55 1.49 0.00 0.00 0.00 179.25 180.75 1nji h GLU 19 N 0.88 0.17 0.52 0.00 4.57 0.25 -2.28 114.58 118.69 1nji h GLU 19 Ca 0.15 -0.10 -0.03 0.00 -1.18 0.00 0.00 59.36 58.20 1nji h GLU 19 Cb 0.60 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.21 1nji h GLU 19 CO 0.04 0.67 -0.25 1.25 -1.18 0.00 0.00 179.01 179.54 1nji h LEU 20 N 0.13 -0.59 -2.13 1.64 5.85 0.15 -1.16 115.31 119.18 1nji h LEU 20 Ca -0.00 0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.79 1nji h LEU 20 Cb 1.01 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.18 1nji h LEU 20 CO 0.08 -0.30 0.30 0.44 -0.34 0.00 0.00 178.44 178.63 1nji h ASP 21 N -0.95 0.00 0.02 1.25 3.32 -1.22 0.30 116.42 119.14 1nji h ASP 21 Ca -0.07 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.82 1nji h ASP 21 Cb 0.54 0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.10 1nji h ASP 21 CO 0.12 0.00 -0.65 0.44 -1.72 0.00 0.00 179.24 177.43 1nji h ASP 22 N 0.00 0.53 -0.29 6.45 3.32 -1.22 -2.87 116.42 122.34 1nji h ASP 22 Ca 0.08 -0.79 -0.03 0.00 0.02 0.00 0.00 57.03 56.31 1nji h ASP 22 Cb 0.69 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.06 1nji h ASP 22 CO -0.00 1.26 0.07 -0.07 -1.72 0.00 0.00 179.24 178.78 1nji h LEU 23 N -0.13 0.44 -0.88 1.55 3.38 0.29 -2.20 115.31 117.75 1nji h LEU 23 Ca -0.09 -0.23 0.16 0.00 0.09 0.00 0.00 57.88 57.82 1nji h LEU 23 Cb 1.38 -0.12 -0.10 0.00 0.09 0.00 0.00 40.66 41.91 1nji h LEU 23 CO 0.13 0.55 0.46 0.11 0.09 0.00 0.00 178.44 179.78 1nji h LYS 24 N 0.30 0.61 -0.62 1.13 1.57 -1.25 0.79 116.57 119.10 1nji h LYS 24 Ca 0.09 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.76 1nji h LYS 24 Cb 0.28 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1nji h LYS 24 CO 0.00 0.40 0.11 1.15 -0.57 0.00 0.00 179.45 180.54 1nji h THR 25 N 0.63 1.26 -0.69 -0.16 2.02 -1.24 0.10 112.91 114.83 1nji h THR 25 Ca 0.49 -1.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.63 1nji h THR 25 Cb 0.74 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.82 1nji h THR 25 CO -0.38 0.37 0.24 -0.08 0.37 0.00 0.00 175.52 176.03 1nji h GLU 26 N 0.94 1.05 0.59 6.66 4.81 -0.37 -0.42 114.58 127.83 1nji h GLU 26 Ca 0.19 -0.20 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1nji h GLU 26 Cb 0.42 -0.16 0.01 0.00 0.63 0.00 0.00 28.75 29.64 1nji h GLU 26 CO 0.01 0.88 -0.28 1.25 -0.73 0.00 0.00 179.01 180.14 1nji h LEU 27 N 1.01 -0.67 -0.70 1.64 5.85 -0.58 -0.82 115.31 121.04 1nji h LEU 27 Ca 0.23 -0.02 0.12 0.00 0.84 0.00 0.00 57.88 59.05 1nji h LEU 27 Cb 0.25 0.17 -0.08 0.00 0.37 0.00 0.00 40.66 41.38 1nji h LEU 27 CO -0.01 -0.40 0.29 0.25 -0.34 0.00 0.00 178.44 178.23 1nji h LEU 28 N -0.90 0.31 -1.37 2.25 5.85 -0.58 0.25 115.31 121.12 1nji h LEU 28 Ca -0.08 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 1nji h LEU 28 Cb 0.64 0.05 -0.00 0.00 0.37 0.00 0.00 40.66 41.72 1nji h LEU 28 CO 0.13 0.16 -0.13 0.78 -0.34 0.00 0.00 178.44 179.04 1nji h ASN 29 N 0.48 0.00 -0.05 1.25 2.35 -0.95 -0.83 115.58 117.82 1nji h ASN 29 Ca 0.37 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 56.00 1nji h ASN 29 Cb 0.49 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.86 1nji h ASN 29 CO -0.34 0.13 -0.42 0.00 -1.65 0.00 0.00 177.43 175.15 1nji h ALA 30 N 1.87 0.12 -0.43 -0.83 0.00 0.91 -2.26 119.26 118.64 1nji h ALA 30 Ca -0.00 -0.49 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 1nji h ALA 30 Cb 0.60 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1nji h ALA 30 CO 0.02 0.26 0.06 0.00 0.00 0.00 0.00 179.25 179.58 1nji h ARG 31 N -0.12 0.67 0.12 0.00 3.08 -0.84 0.11 114.38 117.40 1nji h ARG 31 Ca -0.04 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 1nji h ARG 31 Cb 1.09 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.04 1nji h ARG 31 CO 0.08 0.64 -0.06 0.00 -1.07 0.00 0.00 179.97 179.57 1nji h ALA 32 N 1.43 -0.16 -0.59 0.04 0.00 -1.12 0.74 119.26 119.59 1nji h ALA 32 Ca 0.14 -0.08 0.08 0.00 0.00 0.00 0.00 54.91 55.05 1nji h ALA 32 Cb 0.31 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1nji h ALA 32 CO 0.00 -0.54 0.40 0.28 0.00 0.00 0.00 179.25 179.39 1nji h VAL 33 N -0.26 0.94 -0.07 0.00 2.07 -0.96 -0.74 116.25 117.24 1nji h VAL 33 Ca -0.02 -0.17 -0.19 0.00 0.82 0.00 0.00 66.70 67.15 1nji h VAL 33 Cb 0.21 0.41 0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1nji h VAL 33 CO 0.03 0.09 -0.70 -0.61 0.02 0.00 0.00 177.57 176.40 1nji h GLN 34 N 0.49 0.60 0.00 1.57 4.15 -0.10 0.30 115.11 122.12 1nji h GLN 34 Ca 0.27 -0.55 -0.01 0.00 0.77 0.00 0.00 58.65 59.13 1nji h GLN 34 Cb 0.41 0.13 -0.00 0.00 0.21 0.00 0.00 27.48 28.24 1nji h GLN 34 CO -0.08 1.17 -0.04 0.00 -1.93 0.00 0.00 178.83 177.95 1nji h ALA 35 N 0.44 1.47 -0.44 3.38 0.00 0.18 -0.31 119.26 123.98 1nji h ALA 35 Ca -0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1nji h ALA 35 Cb 1.36 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1nji h ALA 35 CO 0.14 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.44 1nji n ALA 36 N -2.32 3.36 -1.52 0.00 0.00 -0.41 -4.87 120.51 114.75 1nji n ALA 36 Ca -0.03 -1.34 -0.18 0.00 0.00 0.00 0.00 53.44 51.89 1nji n ALA 36 Cb 0.13 -1.07 -0.08 0.00 0.00 0.00 0.00 19.45 18.43 1nji n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nji n GLY 37 N 0.60 1.71 3.71 0.00 0.00 -0.13 -4.89 105.19 106.18 1nji n GLY 37 Ca 0.20 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1nji n GLY 37 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1nji s GLY 38 N -2.70 1.36 0.22 -0.02 0.00 0.10 -4.92 107.32 101.37 1nji s GLY 38 Ca 0.00 1.45 0.22 0.00 0.00 0.00 0.00 44.72 46.39 1nji s GLY 38 CO 0.00 2.93 1.10 0.00 0.00 0.00 0.00 173.10 177.13 1nji h ALA 39 N 7.66 0.56 0.00 3.20 0.00 -1.90 -3.39 119.26 125.39 1nji h ALA 39 Ca -0.44 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1nji h ALA 39 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1nji h ALA 39 CO 0.94 0.05 0.00 -0.35 0.00 0.00 0.00 179.25 179.89 1nji n PRO 40 N -2.74 0.09 -1.05 0.00 -0.04 -1.26 -4.75 135.00 125.25 1nji n PRO 40 Ca 0.00 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.17 1nji n PRO 40 Cb 0.56 -1.30 0.22 0.00 -0.04 0.00 0.00 33.50 32.94 1nji n PRO 40 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1nji s GLU 41 N 0.21 -0.80 -0.43 0.54 2.02 -1.26 -5.03 118.70 113.94 1nji s GLU 41 Ca 0.00 0.16 0.06 0.00 0.02 0.00 0.00 54.97 55.21 1nji s GLU 41 Cb 0.00 -1.62 0.32 0.00 0.10 0.00 0.00 34.13 32.93 1nji s GLU 41 CO 0.00 -3.48 1.18 0.09 0.02 0.00 0.00 175.26 173.07 1nji n ASN 42 N -4.64 -2.12 0.00 -0.19 3.02 -1.26 -5.05 115.26 105.02 1nji n ASN 42 Ca 0.10 -3.31 0.00 0.00 -0.03 0.00 0.00 54.58 51.33 1nji n ASN 42 Cb 0.59 1.76 0.00 0.00 -0.61 0.00 0.00 39.78 41.51 1nji n ASN 42 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1nji n PRO 43 N 0.34 0.00 0.26 3.52 -0.02 -1.26 -0.02 135.00 137.82 1nji n PRO 43 Ca 0.03 0.00 0.14 0.00 -2.02 0.00 0.00 63.50 61.65 1nji n PRO 43 Cb 0.72 0.00 0.83 0.00 -0.02 0.00 0.00 33.50 35.02 1nji n PRO 43 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1nji h GLY 44 N 0.00 0.00 0.52 -1.23 0.00 -2.00 -3.07 103.07 97.30 1nji h GLY 44 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 47.33 47.03 1nji h GLY 44 CO 0.00 0.00 -1.56 3.21 0.00 0.00 0.00 176.54 178.19 1nji h ARG 45 N 0.00 0.23 -0.02 4.80 3.08 -0.87 -2.64 114.38 118.96 1nji h ARG 45 Ca 0.03 -0.39 0.00 0.00 0.07 0.00 0.00 59.98 59.70 1nji h ARG 45 Cb 0.15 0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 1nji h ARG 45 CO -0.00 1.19 0.09 0.97 -1.07 0.00 0.00 179.97 181.14 1nji h ILE 46 N -0.28 0.08 0.11 2.04 2.10 -1.71 0.86 117.51 120.71 1nji h ILE 46 Ca -0.34 0.00 -0.33 0.00 1.08 0.00 0.00 64.86 65.27 1nji h ILE 46 Cb 1.79 0.92 -0.02 0.00 -1.09 0.00 0.00 36.82 38.42 1nji h ILE 46 CO 0.04 0.00 -1.75 0.50 -1.08 0.00 0.00 178.15 175.86 1nji h LYS 47 N 0.00 0.23 -0.29 2.19 3.64 -1.63 -3.31 116.57 117.38 1nji h LYS 47 Ca 0.01 -0.39 -0.14 0.00 -1.27 0.00 0.00 60.65 58.85 1nji h LYS 47 Cb 0.18 0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1nji h LYS 47 CO -0.00 1.06 -0.40 0.93 -2.27 0.00 0.00 179.45 178.76 1nji h GLU 48 N 0.06 0.71 -0.52 1.90 4.39 -0.19 -2.91 114.58 118.02 1nji h GLU 48 Ca -0.32 -0.37 0.06 0.00 0.34 0.00 0.00 59.36 59.06 1nji h GLU 48 Cb 2.03 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 30.66 1nji h GLU 48 CO 0.12 0.98 0.35 -0.07 -1.16 0.00 0.00 179.01 179.24 1nji h LEU 49 N 0.58 0.43 -0.12 1.33 3.38 0.42 0.29 115.31 121.61 1nji h LEU 49 Ca 0.05 -0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.84 1nji h LEU 49 Cb 0.94 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.61 1nji h LEU 49 CO 0.09 0.28 -0.60 0.03 0.09 0.00 0.00 178.44 178.33 1nji h ARG 50 N 0.49 0.63 -0.23 1.13 3.08 -1.61 -2.34 114.38 115.52 1nji h ARG 50 Ca 0.22 -0.51 -0.17 0.00 0.07 0.00 0.00 59.98 59.59 1nji h ARG 50 Cb 0.26 0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.41 1nji h ARG 50 CO -0.06 1.13 -0.54 0.87 -1.07 0.00 0.00 179.97 180.30 1nji h LYS 51 N 0.28 0.70 -0.63 0.04 1.57 -1.18 -1.85 116.57 115.50 1nji h LYS 51 Ca -0.04 -0.44 -0.02 0.00 -1.87 0.00 0.00 60.65 58.28 1nji h LYS 51 Cb 1.24 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.57 1nji h LYS 51 CO 0.13 1.06 0.33 0.00 -0.57 0.00 0.00 179.45 180.40 1nji h ALA 52 N 0.85 0.81 -0.76 3.86 0.00 -0.50 -0.40 119.26 123.12 1nji h ALA 52 Ca 0.01 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1nji h ALA 52 Cb 1.12 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 1nji h ALA 52 CO 0.11 0.35 0.37 0.82 0.00 0.00 0.00 179.25 180.90 1nji h ILE 53 N 0.86 1.24 0.01 0.00 2.04 -1.25 -1.77 117.51 118.64 1nji h ILE 53 Ca 0.22 -0.66 -0.00 0.00 1.00 0.00 0.00 64.86 65.42 1nji h ILE 53 Cb 0.07 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.41 1nji h ILE 53 CO -0.03 0.28 -0.01 0.00 0.00 0.00 0.00 178.15 178.39 1nji h ALA 54 N 1.33 -0.01 -0.14 1.87 0.00 -0.64 -1.79 119.26 119.88 1nji h ALA 54 Ca 0.26 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.13 1nji h ALA 54 Cb 0.10 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 1nji h ALA 54 CO -0.03 -0.42 -0.27 0.00 0.00 0.00 0.00 179.25 178.52 1nji h ARG 55 N -0.18 -0.32 -0.40 0.00 3.08 -0.74 0.29 114.38 116.10 1nji h ARG 55 Ca -0.00 0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.15 1nji h ARG 55 Cb 0.18 0.07 -0.07 0.00 0.08 0.00 0.00 29.97 30.24 1nji h ARG 55 CO 0.00 -0.22 -0.01 0.82 -1.07 0.00 0.00 179.97 179.50 1nji h ILE 56 N -0.34 0.69 -0.96 2.04 2.04 -1.28 0.23 117.51 119.93 1nji h ILE 56 Ca 0.10 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.94 1nji h ILE 56 Cb 0.49 0.58 -0.05 0.00 -0.74 0.00 0.00 36.82 37.11 1nji h ILE 56 CO -0.33 0.02 0.63 0.11 0.00 0.00 0.00 178.15 178.57 1nji h LYS 57 N 0.09 1.27 -0.47 2.37 1.57 -0.39 0.19 116.57 121.20 1nji h LYS 57 Ca 0.20 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.85 1nji h LYS 57 Cb 0.28 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1nji h LYS 57 CO -0.34 0.85 0.12 1.15 -0.57 0.00 0.00 179.45 180.66 1nji h THR 58 N 1.31 1.24 -0.44 -0.16 2.02 0.80 -2.05 112.91 115.63 1nji h THR 58 Ca 0.35 -0.82 -0.08 0.00 0.77 0.00 0.00 66.41 66.63 1nji h THR 58 Cb -0.14 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.13 1nji h THR 58 CO -0.07 0.29 -0.05 0.40 0.37 0.00 0.00 175.52 176.46 1nji h ILE 59 N 0.64 1.27 -0.92 3.11 1.08 0.01 -0.62 117.51 122.08 1nji h ILE 59 Ca 0.15 -1.12 0.12 0.00 -0.39 0.00 0.00 64.86 63.62 1nji h ILE 59 Cb 0.32 1.11 -0.07 0.00 -3.07 0.00 0.00 36.82 35.11 1nji h ILE 59 CO 0.00 0.38 0.59 1.56 -0.69 0.00 0.00 178.15 179.99 1nji h GLN 60 N 0.64 0.82 -0.06 2.37 4.20 -0.49 0.12 115.11 122.70 1nji h GLN 60 Ca 0.12 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 1nji h GLN 60 Cb 0.56 -0.19 -0.00 0.00 0.30 0.00 0.00 27.48 28.15 1nji h GLN 60 CO 0.03 0.54 -0.07 0.78 -0.67 0.00 0.00 178.83 179.44 1nji h GLY 61 N 0.85 0.16 0.84 3.46 0.00 -0.97 0.75 103.07 108.16 1nji h GLY 61 Ca 0.45 -0.18 0.02 0.00 0.00 0.00 0.00 47.33 47.62 1nji h GLY 61 CO -0.21 0.16 0.10 0.83 0.00 0.00 0.00 176.54 177.42 1nji h GLU 62 N -0.31 0.22 0.00 4.80 5.08 0.12 -2.83 114.58 121.66 1nji h GLU 62 Ca 0.01 -0.01 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1nji h GLU 62 Cb 0.60 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.79 1nji h GLU 62 CO 0.02 0.14 -0.35 0.93 -1.00 0.00 0.00 179.01 178.75 1nji h GLU 63 N 0.22 0.00 0.00 2.33 4.39 -0.90 -3.46 114.58 117.16 1nji h GLU 63 Ca 0.10 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1nji h GLU 63 Cb 0.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1nji h GLU 63 CO -0.09 0.35 0.00 0.41 -1.16 0.00 0.00 179.01 178.52 1nji n GLY 64 N -0.05 1.20 0.00 -3.84 0.00 -0.81 -5.09 105.19 96.60 1nji n GLY 64 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1nji n GLY 64 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54