#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k53 s LYS 2 N 0.00 2.79 0.22 0.03 2.47 -1.26 -4.73 119.74 119.27 2k53 s LYS 2 Ca 0.00 0.22 -0.30 0.00 -1.56 0.00 0.00 55.97 54.33 2k53 s LYS 2 Cb 0.00 -4.47 -0.09 0.00 -1.46 0.00 0.00 37.83 31.81 2k53 s LYS 2 CO 0.00 -2.66 0.99 0.42 0.16 0.00 0.00 175.35 174.26 2k53 s ILE 3 N 8.25 3.99 0.13 5.43 -1.09 -1.26 -5.07 121.20 131.59 2k53 s ILE 3 Ca 0.59 1.93 0.07 0.00 -2.23 0.00 0.00 60.65 61.01 2k53 s ILE 3 Cb -0.10 -4.23 -0.04 0.00 -1.58 0.00 0.00 42.46 36.51 2k53 s ILE 3 CO 0.15 0.43 -0.16 0.42 -1.23 0.00 0.00 174.94 174.54 2k53 s THR 4 N -0.93 1.55 -0.18 2.92 -4.23 -1.26 -4.88 115.64 108.63 2k53 s THR 4 Ca 0.43 -1.75 0.26 0.00 -1.18 0.00 0.00 61.69 59.45 2k53 s THR 4 Cb -0.27 -1.63 0.27 0.00 1.34 0.00 0.00 72.50 72.21 2k53 s THR 4 CO 0.34 -0.33 1.79 0.07 -0.54 0.00 0.00 174.62 175.95 2k53 h LYS 5 N 3.52 0.00 0.00 3.99 2.10 -1.97 -1.41 116.57 122.81 2k53 h LYS 5 Ca -0.42 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.18 2k53 h LYS 5 Cb 1.20 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.52 2k53 h LYS 5 CO 0.49 0.00 -0.27 0.22 -2.00 0.00 0.00 179.45 177.89 2k53 h ASP 6 N 0.00 0.00 -4.07 7.07 1.82 -1.95 0.06 116.42 119.36 2k53 h ASP 6 Ca 0.00 0.00 -0.49 0.00 -0.39 0.00 0.00 57.03 56.15 2k53 h ASP 6 Cb 0.18 0.00 0.05 0.00 0.68 0.00 0.00 39.33 40.24 2k53 h ASP 6 CO 0.00 0.27 0.42 -0.04 -1.61 0.00 0.00 179.24 178.28 2k53 s MET 7 N -3.75 3.59 0.09 0.28 -1.94 -0.53 -4.66 119.30 112.37 2k53 s MET 7 Ca -0.00 1.54 -0.30 0.00 -1.71 0.00 0.00 55.69 55.22 2k53 s MET 7 Cb 0.11 -2.10 -0.05 0.00 2.01 0.00 0.00 34.83 34.79 2k53 s MET 7 CO 0.65 -0.64 1.01 0.42 -0.01 0.00 0.00 175.02 176.45 2k53 s ILE 8 N -1.81 4.44 0.24 2.53 -1.09 -1.26 -1.39 121.20 122.86 2k53 s ILE 8 Ca 0.69 1.94 -0.05 0.00 -2.23 0.00 0.00 60.65 61.00 2k53 s ILE 8 Cb -0.22 -4.24 0.21 0.00 -1.58 0.00 0.00 42.46 36.63 2k53 s ILE 8 CO 0.25 0.26 1.84 0.40 -1.23 0.00 0.00 174.94 176.46 2k53 h ILE 9 N 4.20 1.01 -0.79 2.92 2.04 -1.56 -1.94 117.51 123.38 2k53 h ILE 9 Ca -0.43 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.13 2k53 h ILE 9 Cb 1.21 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 2k53 h ILE 9 CO 0.73 0.17 0.50 0.00 0.00 0.00 0.00 178.15 179.55 2k53 h ALA 10 N 1.41 1.00 -0.45 1.87 0.00 -0.78 -2.58 119.26 119.74 2k53 h ALA 10 Ca 0.37 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.24 2k53 h ALA 10 Cb 0.22 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 2k53 h ALA 10 CO -0.19 0.44 0.26 0.22 0.00 0.00 0.00 179.25 179.97 2k53 h ASP 11 N 1.07 0.41 -0.82 0.00 3.58 -1.63 -1.62 116.42 117.41 2k53 h ASP 11 Ca 0.29 0.01 0.06 0.00 0.42 0.00 0.00 57.03 57.81 2k53 h ASP 11 Cb -0.09 -0.08 -0.05 0.00 1.72 0.00 0.00 39.33 40.83 2k53 h ASP 11 CO -0.06 0.29 0.54 0.58 -2.88 0.00 0.00 179.24 177.71 2k53 h VAL 12 N 0.51 1.05 -0.48 2.25 2.07 -1.17 -0.54 116.25 119.93 2k53 h VAL 12 Ca 0.18 -0.31 -0.08 0.00 0.82 0.00 0.00 66.70 67.32 2k53 h VAL 12 Cb 0.03 0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 2k53 h VAL 12 CO -0.09 0.16 -0.01 -0.07 0.02 0.00 0.00 177.57 177.58 2k53 h LEU 13 N 0.90 0.77 -2.08 2.57 3.38 -1.00 -1.26 115.31 118.60 2k53 h LEU 13 Ca 0.35 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 2k53 h LEU 13 Cb 0.22 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 2k53 h LEU 13 CO -0.13 0.85 -0.05 1.56 0.09 0.00 0.00 178.44 180.76 2k53 h GLN 14 N 0.75 0.00 0.00 1.13 4.20 -0.19 -2.99 115.11 118.01 2k53 h GLN 14 Ca 0.14 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.77 2k53 h GLN 14 Cb 0.47 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 2k53 h GLN 14 CO 0.02 0.05 -0.52 0.52 -0.67 0.00 0.00 178.83 178.23 2k53 h MET 15 N 0.00 0.00 -3.01 1.46 2.86 -0.91 -3.48 114.93 111.86 2k53 h MET 15 Ca -0.00 0.00 -0.20 0.00 -2.06 0.00 0.00 59.70 57.44 2k53 h MET 15 Cb 0.30 0.00 -0.30 0.00 0.06 0.00 0.00 31.60 31.66 2k53 h MET 15 CO 0.01 0.78 -0.49 0.34 1.06 0.00 0.00 176.91 178.61 2k53 s ASP 16 N -6.33 -0.19 0.45 1.22 -1.08 -0.52 -5.04 116.67 105.18 2k53 s ASP 16 Ca -0.20 0.53 0.25 0.00 -0.52 0.00 0.00 52.55 52.61 2k53 s ASP 16 Cb 0.01 0.44 0.86 0.00 -1.46 0.00 0.00 42.92 42.77 2k53 s ASP 16 CO 0.53 -0.17 1.80 0.03 0.52 0.00 0.00 175.17 177.87 2k53 h ARG 17 N 7.33 0.00 0.00 4.34 2.47 -1.82 -3.04 114.38 123.67 2k53 h ARG 17 Ca -0.38 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.34 2k53 h ARG 17 Cb 1.15 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.47 2k53 h ARG 17 CO 0.35 0.18 0.00 0.41 0.56 0.00 0.00 179.97 181.47 2k53 n GLY 18 N 0.34 -0.72 0.15 0.04 0.00 -1.26 -2.51 105.19 101.23 2k53 n GLY 18 Ca 0.01 -0.10 0.04 0.00 0.00 0.00 0.00 46.02 45.97 2k53 n GLY 18 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2k53 h THR 19 N 0.00 0.75 -0.14 2.61 1.35 -1.87 -3.37 112.91 112.24 2k53 h THR 19 Ca 0.00 -2.06 0.05 0.00 -0.55 0.00 0.00 66.41 63.85 2k53 h THR 19 Cb 0.08 2.36 -0.05 0.00 -1.73 0.00 0.00 68.15 68.81 2k53 h THR 19 CO 0.00 0.42 -0.19 0.00 -0.25 0.00 0.00 175.52 175.51 2k53 h ALA 20 N 1.56 -0.12 -0.05 6.62 0.00 -1.72 -0.95 119.26 124.59 2k53 h ALA 20 Ca -0.01 0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2k53 h ALA 20 Cb 1.34 0.38 -0.00 0.00 0.00 0.00 0.00 17.79 19.51 2k53 h ALA 20 CO 0.06 -0.64 0.07 -1.00 0.00 0.00 0.00 179.25 177.73 2k53 h PRO 21 N -0.23 0.00 -0.14 0.00 0.13 -1.81 -1.36 132.00 128.58 2k53 h PRO 21 Ca 0.10 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.12 2k53 h PRO 21 Cb 0.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.52 2k53 h PRO 21 CO -0.28 0.00 -0.33 0.82 -0.23 0.00 0.00 178.00 177.98 2k53 h ILE 22 N 0.00 1.36 -0.06 -3.56 2.04 -1.38 0.26 117.51 116.17 2k53 h ILE 22 Ca 0.02 -1.61 0.01 0.00 1.00 0.00 0.00 64.86 64.29 2k53 h ILE 22 Cb 0.16 2.03 -0.01 0.00 -0.74 0.00 0.00 36.82 38.25 2k53 h ILE 22 CO -0.00 0.48 -0.01 -0.26 0.00 0.00 0.00 178.15 178.37 2k53 h PHE 23 N 0.09 -0.01 -0.45 1.37 0.04 -0.81 -2.43 116.94 114.75 2k53 h PHE 23 Ca -0.00 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 2k53 h PHE 23 Cb 0.94 0.02 -0.02 0.00 2.20 0.00 0.00 35.95 39.08 2k53 h PHE 23 CO 0.10 -0.01 0.23 0.82 -0.60 0.00 0.00 178.31 178.84 2k53 h ILE 24 N 0.01 1.15 -0.57 -0.55 2.04 -1.27 -0.98 117.51 117.34 2k53 h ILE 24 Ca 0.03 -0.40 0.06 0.00 1.00 0.00 0.00 64.86 65.55 2k53 h ILE 24 Cb 0.04 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 2k53 h ILE 24 CO -0.05 0.17 0.38 -1.13 0.00 0.00 0.00 178.15 177.51 2k53 h ASN 25 N 0.62 0.47 -0.48 1.72 -1.24 -0.07 -1.63 115.58 114.97 2k53 h ASN 25 Ca 0.16 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.17 2k53 h ASN 25 Cb 0.05 -0.10 0.00 0.00 0.73 0.00 0.00 38.32 39.00 2k53 h ASN 25 CO -0.02 0.31 0.00 0.59 -1.29 0.00 0.00 177.43 177.01 2k53 n ASN 26 N -4.47 3.20 0.00 1.15 3.02 -0.47 -4.90 115.26 112.79 2k53 n ASN 26 Ca 0.08 -2.19 0.00 0.00 -0.03 0.00 0.00 54.58 52.44 2k53 n ASN 26 Cb 0.24 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 38.98 2k53 n ASN 26 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2k53 n GLY 27 N 1.06 0.59 3.71 7.41 0.00 -0.61 -4.80 105.19 112.54 2k53 n GLY 27 Ca 0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2k53 n GLY 27 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2k53 s MET 28 N -0.70 -0.68 -0.30 1.61 -1.94 -0.63 -4.95 119.30 111.71 2k53 s MET 28 Ca 0.00 -0.25 -0.01 0.00 -1.71 0.00 0.00 55.69 53.73 2k53 s MET 28 Cb 0.00 -1.68 0.19 0.00 2.01 0.00 0.00 34.83 35.35 2k53 s MET 28 CO 0.00 -3.32 0.60 -3.38 -0.01 0.00 0.00 175.02 168.90 2k53 s HIS 29 N -3.34 -1.60 0.18 -0.03 -3.43 -1.26 -4.31 115.29 101.50 2k53 s HIS 29 Ca 0.73 1.69 0.28 0.00 -0.80 0.00 0.00 55.06 56.95 2k53 s HIS 29 Cb -0.07 0.55 1.16 0.00 -1.43 0.00 0.00 32.58 32.80 2k53 s HIS 29 CO 0.55 -0.88 1.92 0.00 -2.00 0.00 0.00 174.74 174.33 2k53 s LEU 31 N -6.68 4.12 0.00 0.00 1.98 -1.26 -4.58 118.68 112.26 2k53 s LEU 31 Ca 0.00 0.20 0.00 0.00 -2.89 0.00 0.00 54.13 51.44 2k53 s LEU 31 Cb 0.10 -2.20 0.00 0.00 0.66 0.00 0.00 46.19 44.75 2k53 s LEU 31 CO 0.60 0.03 0.00 0.61 -1.89 0.00 0.00 176.35 175.69 2k53 n GLY 32 N 4.23 3.80 3.23 7.98 0.00 -1.26 -5.09 105.19 118.07 2k53 n GLY 32 Ca -0.13 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 44.99 2k53 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k53 h PRO 34 N 5.61 0.00 0.17 0.00 0.13 -1.95 -3.24 132.00 132.72 2k53 h PRO 34 Ca -0.26 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.88 2k53 h PRO 34 Cb 1.19 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.28 2k53 h PRO 34 CO 0.29 0.00 -0.37 0.66 -0.23 0.00 0.00 178.00 178.35 2k53 h SER 35 N 0.00 -1.06 0.00 1.44 4.64 -1.96 0.11 113.55 116.71 2k53 h SER 35 Ca 0.00 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2k53 h SER 35 Cb 0.37 0.39 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 2k53 h SER 35 CO 0.00 -0.46 0.06 -0.24 -0.87 0.00 0.00 176.83 175.31 2k53 n SER 36 N -5.45 0.00 -0.11 4.97 2.88 -1.22 -1.05 113.62 113.63 2k53 n SER 36 Ca -0.07 0.35 -0.22 0.00 -1.33 0.00 0.00 58.87 57.60 2k53 n SER 36 Cb 0.36 -0.35 -0.09 0.00 -0.75 0.00 0.00 64.21 63.38 2k53 n SER 36 CO 0.00 0.00 0.00 0.23 -1.23 0.00 0.00 175.04 174.04 2k53 n MET 37 N -1.34 0.49 0.00 -1.46 2.81 -0.54 -4.73 117.12 112.35 2k53 n MET 37 Ca 0.00 0.19 0.12 0.00 -1.81 0.00 0.00 57.70 56.21 2k53 n MET 37 Cb 0.06 -1.33 0.32 0.00 -0.71 0.00 0.00 33.22 31.55 2k53 n MET 37 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2k53 n GLY 38 N 1.78 -0.98 3.89 3.03 0.00 0.27 -0.08 105.19 113.10 2k53 n GLY 38 Ca -0.43 -0.37 -0.31 0.00 0.00 0.00 0.00 46.02 44.91 2k53 n GLY 38 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k53 s GLU 39 N -2.78 3.68 0.63 1.61 2.02 -0.22 -4.86 118.70 118.78 2k53 s GLU 39 Ca 0.17 0.03 -0.16 0.00 0.02 0.00 0.00 54.97 55.03 2k53 s GLU 39 Cb 0.18 -2.76 -0.01 0.00 0.10 0.00 0.00 34.13 31.64 2k53 s GLU 39 CO 0.62 0.38 1.13 -1.12 0.02 0.00 0.00 175.26 176.29 2k53 s SER 40 N -2.53 5.19 0.15 -0.19 0.01 -1.26 -2.80 113.70 112.27 2k53 s SER 40 Ca 0.43 2.09 -0.22 0.00 1.31 0.00 0.00 55.95 59.57 2k53 s SER 40 Cb -0.12 -2.56 0.03 0.00 0.21 0.00 0.00 66.02 63.58 2k53 s SER 40 CO 0.24 -1.58 1.64 0.40 0.41 0.00 0.00 173.24 174.36 2k53 h ILE 41 N 0.34 0.45 -0.29 1.44 2.04 -0.79 0.20 117.51 120.90 2k53 h ILE 41 Ca -0.48 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.37 2k53 h ILE 41 Cb 1.26 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 2k53 h ILE 41 CO 0.54 0.00 0.13 1.05 0.00 0.00 0.00 178.15 179.88 2k53 h GLU 42 N -0.21 0.40 0.19 2.37 4.11 -1.29 0.00 114.58 120.15 2k53 h GLU 42 Ca 0.14 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.52 2k53 h GLU 42 Cb 0.42 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2k53 h GLU 42 CO -0.36 0.32 -0.09 0.22 0.07 0.00 0.00 179.01 179.17 2k53 h ASP 43 N 0.40 -0.22 -0.74 3.06 3.58 -1.50 -2.83 116.42 118.17 2k53 h ASP 43 Ca 0.10 -0.06 0.05 0.00 0.42 0.00 0.00 57.03 57.55 2k53 h ASP 43 Cb 0.06 0.06 -0.05 0.00 1.72 0.00 0.00 39.33 41.11 2k53 h ASP 43 CO -0.01 0.27 0.45 0.00 -2.88 0.00 0.00 179.24 177.07 2k53 h ALA 44 N -0.97 1.00 -0.23 -0.78 0.00 -0.67 -2.32 119.26 115.29 2k53 h ALA 44 Ca -0.03 -0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.91 2k53 h ALA 44 Cb 0.26 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2k53 h ALA 44 CO 0.04 0.18 0.03 0.00 0.00 0.00 0.00 179.25 179.50 2k53 h ALA 46 N 1.18 1.57 -0.43 0.00 0.00 -1.20 0.84 119.26 121.22 2k53 h ALA 46 Ca 0.11 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2k53 h ALA 46 Cb 0.12 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2k53 h ALA 46 CO -0.15 0.29 0.25 0.28 0.00 0.00 0.00 179.25 179.92 2k53 h VAL 47 N 0.96 1.14 0.00 0.00 2.07 -0.89 -2.88 116.25 116.65 2k53 h VAL 47 Ca 0.38 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.57 2k53 h VAL 47 Cb 0.25 0.59 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 2k53 h VAL 47 CO -0.15 0.14 -0.52 1.57 0.02 0.00 0.00 177.57 178.64 2k53 n HIS 48 N -4.74 0.04 -2.26 1.57 -0.00 -0.87 -4.96 115.22 103.99 2k53 n HIS 48 Ca 0.01 0.01 0.00 0.00 -0.00 0.00 0.00 57.72 57.74 2k53 n HIS 48 Cb 0.06 -0.28 0.00 0.00 -0.00 0.00 0.00 29.99 29.77 2k53 n HIS 48 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2k53 n GLY 49 N 1.49 0.73 3.90 1.57 0.00 0.26 -5.07 105.19 108.07 2k53 n GLY 49 Ca 0.05 -0.75 -0.30 0.00 0.00 0.00 0.00 46.02 45.02 2k53 n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k53 s ILE 50 N -2.58 5.03 -0.79 -0.61 1.01 0.70 -4.98 121.20 118.98 2k53 s ILE 50 Ca 0.00 0.13 -0.25 0.00 0.00 0.00 0.00 60.65 60.53 2k53 s ILE 50 Cb 0.00 -3.69 0.05 0.00 0.01 0.00 0.00 42.46 38.83 2k53 s ILE 50 CO 0.00 -0.20 1.24 -0.62 0.00 0.00 0.00 174.94 175.36 2k53 s ASP 51 N -2.87 6.26 0.38 3.58 -1.08 -1.26 -4.47 116.67 117.21 2k53 s ASP 51 Ca 0.44 -0.86 0.10 0.00 -0.52 0.00 0.00 52.55 51.72 2k53 s ASP 51 Cb -0.11 -2.52 0.76 0.00 -1.46 0.00 0.00 42.92 39.58 2k53 s ASP 51 CO 0.27 -1.65 1.88 0.00 0.52 0.00 0.00 175.17 176.20 2k53 h ALA 52 N 9.82 1.46 -0.45 3.66 0.00 -1.93 -2.55 119.26 129.27 2k53 h ALA 52 Ca -0.16 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 2k53 h ALA 52 Cb 1.04 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 2k53 h ALA 52 CO 1.28 0.38 0.27 0.22 0.00 0.00 0.00 179.25 181.40 2k53 h ASP 53 N 0.16 0.54 -0.41 0.00 3.58 -1.99 -0.53 116.42 117.78 2k53 h ASP 53 Ca 0.03 -0.06 -0.15 0.00 0.42 0.00 0.00 57.03 57.28 2k53 h ASP 53 Cb 0.47 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 2k53 h ASP 53 CO 0.03 0.44 -0.31 0.11 -2.88 0.00 0.00 179.24 176.62 2k53 h LYS 54 N 0.59 0.93 -0.07 0.28 1.57 -1.94 -2.88 116.57 115.05 2k53 h LYS 54 Ca 0.16 -0.46 0.01 0.00 -1.87 0.00 0.00 60.65 58.49 2k53 h LYS 54 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 2k53 h LYS 54 CO -0.03 1.12 -0.01 1.25 -0.57 0.00 0.00 179.45 181.21 2k53 h LEU 55 N 0.75 -0.04 -1.13 2.94 5.85 -1.21 -2.73 115.31 119.74 2k53 h LEU 55 Ca 0.08 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.87 2k53 h LEU 55 Cb 0.90 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.90 2k53 h LEU 55 CO 0.08 -0.01 0.60 0.58 -0.34 0.00 0.00 178.44 179.35 2k53 h VAL 56 N 0.01 1.07 0.14 1.05 2.07 -1.10 -2.17 116.25 117.33 2k53 h VAL 56 Ca 0.03 -0.36 0.01 0.00 0.82 0.00 0.00 66.70 67.20 2k53 h VAL 56 Cb 0.04 -0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 29.71 2k53 h VAL 56 CO -0.06 0.19 -0.21 0.11 0.02 0.00 0.00 177.57 177.62 2k53 h LYS 57 N 1.05 -0.40 -0.69 1.57 1.57 -1.26 -1.19 116.57 117.22 2k53 h LYS 57 Ca 0.39 0.03 0.03 0.00 -1.87 0.00 0.00 60.65 59.23 2k53 h LYS 57 Cb 0.18 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.55 2k53 h LYS 57 CO -0.15 -0.27 0.46 0.93 -0.57 0.00 0.00 179.45 179.85 2k53 h GLU 58 N -0.42 0.82 -0.05 3.15 5.08 -1.21 -1.01 114.58 120.95 2k53 h GLU 58 Ca 0.02 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2k53 h GLU 58 Cb 0.43 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 2k53 h GLU 58 CO -0.10 0.55 0.02 -0.07 -1.00 0.00 0.00 179.01 178.41 2k53 h LEU 59 N 0.85 0.06 0.19 1.33 3.38 -1.07 -1.88 115.31 118.17 2k53 h LEU 59 Ca 0.27 -0.15 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2k53 h LEU 59 Cb 0.03 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 2k53 h LEU 59 CO -0.07 0.19 -0.13 0.78 0.09 0.00 0.00 178.44 179.30 2k53 h ASN 60 N -0.07 -0.32 -0.92 -0.43 2.35 -0.64 -2.83 115.58 112.72 2k53 h ASN 60 Ca 0.02 0.02 0.12 0.00 -0.55 0.00 0.00 56.30 55.91 2k53 h ASN 60 Cb 0.15 0.10 -0.08 0.00 0.05 0.00 0.00 38.32 38.54 2k53 h ASN 60 CO -0.00 -0.20 0.54 -0.33 -1.65 0.00 0.00 177.43 175.79 2k53 h GLU 61 N -0.31 0.82 -0.05 0.81 5.08 -1.23 -2.13 114.58 117.58 2k53 h GLU 61 Ca -0.01 -0.05 0.03 0.00 -1.00 0.00 0.00 59.36 58.32 2k53 h GLU 61 Cb 0.27 -0.19 -0.03 0.00 0.50 0.00 0.00 28.75 29.30 2k53 h GLU 61 CO 0.01 0.54 -0.13 -0.92 -1.00 0.00 0.00 179.01 177.51 2k53 h TYR 62 N 0.85 -0.33 -0.36 4.33 3.20 -1.10 0.17 116.97 123.72 2k53 h TYR 62 Ca 0.46 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.32 2k53 h TYR 62 Cb 0.50 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.90 2k53 h TYR 62 CO -0.04 -0.19 0.11 0.74 -1.64 0.00 0.00 178.16 177.14 2k53 h PHE 63 N -0.20 0.52 -0.16 -3.82 0.04 -1.26 -1.47 116.94 110.59 2k53 h PHE 63 Ca 0.06 -0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.74 2k53 h PHE 63 Cb 0.28 -0.16 -0.01 0.00 2.20 0.00 0.00 35.95 38.26 2k53 h PHE 63 CO -0.21 0.44 -0.21 0.93 -0.60 0.00 0.00 178.31 178.67 2k53 h GLU 64 N 0.52 0.27 -0.79 1.51 5.08 -0.74 -2.91 114.58 117.52 2k53 h GLU 64 Ca 0.12 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 2k53 h GLU 64 Cb 0.17 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 2k53 h GLU 64 CO -0.01 0.48 0.44 0.87 -1.00 0.00 0.00 179.01 179.79 2k53 h LYS 65 N 0.25 1.09 -0.37 2.33 1.79 0.11 -3.19 116.57 118.59 2k53 h LYS 65 Ca 0.04 -0.12 0.06 0.00 -2.18 0.00 0.00 60.65 58.46 2k53 h LYS 65 Cb 0.51 -0.22 -0.05 0.00 -1.58 0.00 0.00 32.23 30.89 2k53 h LYS 65 CO 0.03 0.79 0.05 0.87 -1.08 0.00 0.00 179.45 180.12 2k53 h LYS 66 N 1.10 0.16 -0.08 3.15 1.57 -1.35 0.58 116.57 121.71 2k53 h LYS 66 Ca 0.28 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.07 2k53 h LYS 66 Cb 0.01 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.28 2k53 h LYS 66 CO -0.05 0.11 0.06 0.93 -0.57 0.00 0.00 179.45 179.93 2k53 h GLU 67 N 0.17 0.00 0.01 3.15 5.08 -1.67 0.07 114.58 121.39 2k53 h GLU 67 Ca 0.18 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.54 2k53 h GLU 67 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2k53 h GLU 67 CO -0.25 0.00 -0.00 0.28 -1.00 0.00 0.00 179.01 178.03 2k53 h VAL 68 N 0.00 1.60 0.47 3.13 2.07 -1.20 -3.39 116.25 118.93 2k53 h VAL 68 Ca 0.04 -1.93 -0.02 0.00 0.82 0.00 0.00 66.70 65.61 2k53 h VAL 68 Cb 0.15 2.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.81 2k53 h VAL 68 CO -0.00 0.49 -0.23 -0.07 0.02 0.00 0.00 177.57 177.79 2k53 h LEU 69 N -0.85 -0.53 0.00 2.57 3.38 -0.58 -3.52 115.31 115.78 2k53 h LEU 69 Ca -0.00 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2k53 h LEU 69 Cb 0.81 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.70 2k53 h LEU 69 CO 0.00 -0.33 0.00 -0.62 0.09 0.00 0.00 178.44 177.58