#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 3.27 0.34 0.03 2.47 -1.26 -4.91 119.74 119.68 2k53 s LYS 2 Ca 0.00 -1.97 -0.28 0.00 -1.56 0.00 0.00 55.97 52.16 2k53 s LYS 2 Cb 0.00 -4.38 -0.10 0.00 -1.46 0.00 0.00 37.83 31.89 2k53 s LYS 2 CO 0.00 -1.36 1.30 0.42 0.16 0.00 0.00 175.35 175.87 2k53 s ILE 3 N 1.21 2.73 0.27 5.43 -1.09 -1.26 -5.05 121.20 123.43 2k53 s ILE 3 Ca 0.11 0.73 0.11 0.00 -2.23 0.00 0.00 60.65 59.37 2k53 s ILE 3 Cb -0.20 -3.46 -0.05 0.00 -1.58 0.00 0.00 42.46 37.17 2k53 s ILE 3 CO -0.02 0.17 -0.18 0.42 -1.23 0.00 0.00 174.94 174.10 2k53 s THR 4 N -1.16 2.27 -0.14 2.92 -4.23 -1.26 -4.86 115.64 109.18 2k53 s THR 4 Ca 0.50 -2.35 0.28 0.00 -1.18 0.00 0.00 61.69 58.94 2k53 s THR 4 Cb -0.39 -2.26 0.30 0.00 1.34 0.00 0.00 72.50 71.48 2k53 s THR 4 CO 0.52 -0.43 1.84 0.07 -0.54 0.00 0.00 174.62 176.08 2k53 h LYS 5 N 2.32 0.00 0.00 3.99 2.10 -1.96 -2.24 116.57 120.78 2k53 h LYS 5 Ca -0.40 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.25 2k53 h LYS 5 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 2k53 h LYS 5 CO 0.61 0.00 0.00 0.22 -2.00 0.00 0.00 179.45 178.28 2k53 h ASP 6 N 0.00 0.00 -4.17 7.07 3.58 -1.95 -0.76 116.42 120.19 2k53 h ASP 6 Ca 0.00 0.00 -0.51 0.00 0.42 0.00 0.00 57.03 56.94 2k53 h ASP 6 Cb 0.27 0.00 0.10 0.00 1.72 0.00 0.00 39.33 41.42 2k53 h ASP 6 CO 0.00 0.00 0.39 -0.04 -2.88 0.00 0.00 179.24 176.71 2k53 s MET 7 N -3.33 2.87 -0.05 0.28 -1.94 -0.84 -4.66 119.30 111.63 2k53 s MET 7 Ca 0.06 1.47 -0.25 0.00 -1.71 0.00 0.00 55.69 55.26 2k53 s MET 7 Cb 0.06 -1.95 -0.04 0.00 2.01 0.00 0.00 34.83 34.92 2k53 s MET 7 CO 0.63 -1.21 0.76 0.42 -0.01 0.00 0.00 175.02 175.61 2k53 s ILE 8 N -2.18 5.01 0.15 2.53 -1.09 -1.26 -0.87 121.20 123.49 2k53 s ILE 8 Ca 0.69 1.57 -0.23 0.00 -2.23 0.00 0.00 60.65 60.45 2k53 s ILE 8 Cb -0.22 -4.10 0.03 0.00 -1.58 0.00 0.00 42.46 36.59 2k53 s ILE 8 CO 0.39 0.23 1.62 0.40 -1.23 0.00 0.00 174.94 176.35 2k53 h ILE 9 N 4.77 0.35 -0.30 2.92 2.04 -1.79 -0.02 117.51 125.48 2k53 h ILE 9 Ca -0.41 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.45 2k53 h ILE 9 Cb 1.20 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 2k53 h ILE 9 CO 0.75 0.00 0.17 0.00 0.00 0.00 0.00 178.15 179.07 2k53 h ALA 10 N 0.76 1.74 -0.38 1.87 0.00 -1.84 -1.15 119.26 120.25 2k53 h ALA 10 Ca 0.14 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 2k53 h ALA 10 Cb 0.49 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 2k53 h ALA 10 CO -0.41 0.23 -0.37 0.22 0.00 0.00 0.00 179.25 178.92 2k53 h ASP 11 N 0.41 0.99 -0.98 0.00 3.58 -1.46 -2.16 116.42 116.80 2k53 h ASP 11 Ca 0.11 -0.46 0.00 0.00 0.42 0.00 0.00 57.03 57.10 2k53 h ASP 11 Cb 0.00 -0.28 -0.05 0.00 1.72 0.00 0.00 39.33 40.73 2k53 h ASP 11 CO -0.02 1.25 0.61 0.58 -2.88 0.00 0.00 179.24 178.78 2k53 h VAL 12 N 0.74 1.26 -0.23 2.25 2.07 -0.33 -1.48 116.25 120.53 2k53 h VAL 12 Ca 0.06 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.06 2k53 h VAL 12 Cb 0.96 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 2k53 h VAL 12 CO 0.09 0.26 0.15 -0.07 0.02 0.00 0.00 177.57 178.03 2k53 h LEU 13 N 1.33 0.26 -1.15 2.57 3.38 -1.00 -1.39 115.31 119.32 2k53 h LEU 13 Ca 0.35 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 58.23 2k53 h LEU 13 Cb -0.10 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 2k53 h LEU 13 CO -0.07 0.19 -0.32 1.56 0.09 0.00 0.00 178.44 179.89 2k53 h GLN 14 N 0.31 0.18 0.35 1.13 1.08 -0.62 -2.69 115.11 114.85 2k53 h GLN 14 Ca 0.08 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.20 2k53 h GLN 14 Cb -0.03 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.39 2k53 h GLN 14 CO -0.02 0.49 -0.17 0.52 -0.95 0.00 0.00 178.83 178.70 2k53 h MET 15 N 0.16 -0.45 -2.62 1.46 2.86 -0.95 -3.44 114.93 111.94 2k53 h MET 15 Ca 0.02 0.03 -0.13 0.00 -2.06 0.00 0.00 59.70 57.56 2k53 h MET 15 Cb 0.65 0.10 -0.29 0.00 0.06 0.00 0.00 31.60 32.12 2k53 h MET 15 CO 0.05 -0.15 -0.40 0.34 1.06 0.00 0.00 176.91 177.81 2k53 s ASP 16 N -4.98 -0.15 0.64 1.22 -1.08 -0.98 -5.02 116.67 106.32 2k53 s ASP 16 Ca -0.14 0.88 0.40 0.00 -0.52 0.00 0.00 52.55 53.17 2k53 s ASP 16 Cb 0.02 1.10 2.25 0.00 -1.46 0.00 0.00 42.92 44.84 2k53 s ASP 16 CO 0.55 -0.23 2.34 0.03 0.52 0.00 0.00 175.17 178.38 2k53 h ARG 17 N 8.03 0.00 0.00 4.34 2.47 -1.76 -2.02 114.38 125.45 2k53 h ARG 17 Ca -0.19 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.53 2k53 h ARG 17 Cb 1.12 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.44 2k53 h ARG 17 CO 0.15 0.00 0.00 0.41 0.56 0.00 0.00 179.97 181.09 2k53 n GLY 18 N -1.14 -0.56 0.12 0.04 0.00 -1.26 -1.76 105.19 100.64 2k53 n GLY 18 Ca -0.03 -0.06 0.13 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 -0.15 2.61 1.35 -1.71 -3.37 112.91 111.64 2k53 h THR 19 Ca 0.00 -0.62 0.04 0.00 -0.55 0.00 0.00 66.41 65.28 2k53 h THR 19 Cb 0.07 1.51 -0.04 0.00 -1.73 0.00 0.00 68.15 67.95 2k53 h THR 19 CO 0.00 0.00 -0.13 0.00 -0.25 0.00 0.00 175.52 175.14 2k53 h ALA 20 N 2.38 -0.02 -0.40 6.62 0.00 -1.57 -1.62 119.26 124.64 2k53 h ALA 20 Ca 0.00 0.06 0.12 0.00 0.00 0.00 0.00 54.91 55.08 2k53 h ALA 20 Cb 0.81 0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 2k53 h ALA 20 CO 0.00 -0.57 0.31 -1.00 0.00 0.00 0.00 179.25 177.99 2k53 h PRO 21 N -0.14 0.00 -0.19 0.00 0.13 -1.81 0.06 132.00 130.04 2k53 h PRO 21 Ca 0.10 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.16 2k53 h PRO 21 Cb 0.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.41 2k53 h PRO 21 CO -0.23 0.00 -0.14 0.82 -0.23 0.00 0.00 178.00 178.22 2k53 h ILE 22 N 0.00 1.32 -0.35 -3.56 2.04 -1.54 0.16 117.51 115.58 2k53 h ILE 22 Ca 0.19 -1.26 -0.01 0.00 1.00 0.00 0.00 64.86 64.78 2k53 h ILE 22 Cb 0.80 1.73 -0.02 0.00 -0.74 0.00 0.00 36.82 38.60 2k53 h ILE 22 CO -0.00 0.38 0.17 -0.26 0.00 0.00 0.00 178.15 178.44 2k53 h PHE 23 N 0.11 0.51 -0.75 1.37 0.04 -0.86 -2.85 116.94 114.51 2k53 h PHE 23 Ca 0.04 -0.03 0.02 0.00 2.80 0.00 0.00 57.97 60.81 2k53 h PHE 23 Cb 0.66 -0.16 -0.04 0.00 2.20 0.00 0.00 35.95 38.61 2k53 h PHE 23 CO 0.07 0.44 0.48 0.82 -0.60 0.00 0.00 178.31 179.52 2k53 h ILE 24 N 0.43 1.13 -0.46 -0.55 2.04 -0.97 -1.09 117.51 118.05 2k53 h ILE 24 Ca 0.12 -0.33 0.09 0.00 1.00 0.00 0.00 64.86 65.75 2k53 h ILE 24 Cb 0.12 0.10 -0.09 0.00 -0.74 0.00 0.00 36.82 36.21 2k53 h ILE 24 CO -0.02 0.17 -0.12 -1.13 0.00 0.00 0.00 178.15 177.06 2k53 h ASN 25 N 0.95 -0.44 0.33 1.72 -1.24 -0.49 -0.17 115.58 116.25 2k53 h ASN 25 Ca 0.29 0.14 0.00 0.00 0.71 0.00 0.00 56.30 57.44 2k53 h ASN 25 Cb -0.02 0.29 0.00 0.00 0.73 0.00 0.00 38.32 39.31 2k53 h ASN 25 CO -0.10 -0.15 0.00 0.59 -1.29 0.00 0.00 177.43 176.48 2k53 n ASN 26 N -5.34 0.00 0.00 1.15 3.02 -1.04 -4.86 115.26 108.19 2k53 n ASN 26 Ca 0.04 -0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 2k53 n ASN 26 Cb 0.25 -0.22 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 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 0.64 1.29 3.77 7.41 0.00 -0.07 -4.81 105.19 113.42 2k53 n GLY 27 Ca 0.13 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.20 4.11 -0.33 1.61 -1.94 -0.44 -4.98 119.30 117.13 2k53 s MET 28 Ca 0.00 1.99 -0.01 0.00 -1.71 0.00 0.00 55.69 55.95 2k53 s MET 28 Cb 0.00 -2.79 0.11 0.00 2.01 0.00 0.00 34.83 34.16 2k53 s MET 28 CO 0.00 -0.32 0.14 -1.58 -0.01 0.00 0.00 175.02 173.25 2k53 s HIS 29 N -1.31 1.23 -1.17 -0.03 2.46 -1.26 -4.47 115.29 110.75 2k53 s HIS 29 Ca 0.55 -1.57 -0.19 0.00 0.47 0.00 0.00 55.06 54.32 2k53 s HIS 29 Cb -0.34 -1.41 -0.04 0.00 -0.13 0.00 0.00 32.58 30.66 2k53 s HIS 29 CO 0.44 -0.85 1.98 0.00 -2.47 0.00 0.00 174.74 173.84 2k53 s LEU 31 N 3.91 -0.22 0.00 0.00 1.98 -1.26 -5.06 118.68 118.03 2k53 s LEU 31 Ca 0.55 0.11 0.00 0.00 -2.89 0.00 0.00 54.13 51.90 2k53 s LEU 31 Cb 0.09 1.17 0.00 0.00 0.66 0.00 0.00 46.19 48.11 2k53 s LEU 31 CO 0.05 -0.04 0.00 0.61 -1.89 0.00 0.00 176.35 175.08 2k53 n GLY 32 N 5.39 1.47 3.10 7.98 0.00 -1.26 -5.09 105.19 116.79 2k53 n GLY 32 Ca -0.04 -0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 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 7.53 0.00 -0.08 0.00 0.11 -2.00 -2.96 132.00 134.60 2k53 h PRO 34 Ca -0.34 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.79 2k53 h PRO 34 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.28 2k53 h PRO 34 CO 0.54 0.12 0.11 1.03 -0.21 0.00 0.00 178.00 179.59 2k53 h SER 35 N 0.00 0.00 -0.08 -2.05 0.87 -1.99 -1.95 113.55 108.34 2k53 h SER 35 Ca -0.00 0.00 0.02 0.00 -1.23 0.00 0.00 61.79 60.58 2k53 h SER 35 Cb 0.25 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.21 2k53 h SER 35 CO 0.02 0.00 0.17 0.28 -0.53 0.00 0.00 176.83 176.77 2k53 h SER 36 N 0.00 0.00 1.00 6.23 0.02 -1.89 0.34 113.55 119.25 2k53 h SER 36 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 2k53 h SER 36 Cb 0.26 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.80 2k53 h SER 36 CO -0.00 0.00 -0.94 0.24 -1.14 0.00 0.00 176.83 174.99 2k53 h MET 37 N 0.00 0.00 0.00 3.45 2.86 -1.61 -3.37 114.93 116.26 2k53 h MET 37 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2k53 h MET 37 Cb 0.38 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.04 2k53 h MET 37 CO -0.00 0.00 -1.32 0.41 1.06 0.00 0.00 176.91 177.06 2k53 n GLY 38 N 1.20 -1.05 3.99 8.32 0.00 0.97 -3.45 105.19 115.17 2k53 n GLY 38 Ca 0.00 -0.52 -0.19 0.00 0.00 0.00 0.00 46.02 45.31 2k53 n GLY 38 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k53 s GLU 39 N -3.22 2.92 0.78 1.61 -1.05 0.06 -4.97 118.70 114.84 2k53 s GLU 39 Ca 0.02 -1.02 -0.11 0.00 -0.15 0.00 0.00 54.97 53.70 2k53 s GLU 39 Cb 0.15 -2.73 0.06 0.00 -0.44 0.00 0.00 34.13 31.17 2k53 s GLU 39 CO 0.86 -0.20 1.10 -1.54 0.95 0.00 0.00 175.26 176.43 2k53 s SER 40 N -4.28 4.65 0.13 0.83 1.04 -1.26 -3.28 113.70 111.54 2k53 s SER 40 Ca 0.51 1.29 -0.20 0.00 0.48 0.00 0.00 55.95 58.02 2k53 s SER 40 Cb -0.10 -2.03 -0.01 0.00 0.10 0.00 0.00 66.02 63.98 2k53 s SER 40 CO 0.33 -1.87 1.69 0.40 0.98 0.00 0.00 173.24 174.78 2k53 h ILE 41 N -1.02 0.70 -0.42 -1.02 2.04 -0.48 -0.32 117.51 116.99 2k53 h ILE 41 Ca -0.47 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.30 2k53 h ILE 41 Cb 1.26 0.70 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 2k53 h ILE 41 CO 0.60 0.00 -0.13 1.05 0.00 0.00 0.00 178.15 179.67 2k53 h GLU 42 N -0.07 0.76 -0.00 2.37 4.11 -1.45 0.13 114.58 120.44 2k53 h GLU 42 Ca 0.11 -0.26 -0.00 0.00 0.07 0.00 0.00 59.36 59.28 2k53 h GLU 42 Cb 0.23 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2k53 h GLU 42 CO -0.24 0.86 0.00 0.22 0.07 0.00 0.00 179.01 179.91 2k53 h ASP 43 N 0.69 0.00 -0.64 3.06 1.82 -1.74 -2.36 116.42 117.25 2k53 h ASP 43 Ca 0.11 -0.24 -0.02 0.00 -0.39 0.00 0.00 57.03 56.50 2k53 h ASP 43 Cb 0.61 -0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.59 2k53 h ASP 43 CO 0.04 0.24 0.33 0.00 -1.61 0.00 0.00 179.24 178.24 2k53 h ALA 44 N 0.76 0.82 -0.21 -0.78 0.00 -0.96 -2.80 119.26 116.08 2k53 h ALA 44 Ca 0.00 -0.12 0.06 0.00 0.00 0.00 0.00 54.91 54.85 2k53 h ALA 44 Cb 0.24 -0.25 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 2k53 h ALA 44 CO 0.00 0.36 -0.23 0.00 0.00 0.00 0.00 179.25 179.38 2k53 h ALA 46 N 0.79 1.68 -0.76 0.00 0.00 -1.24 0.60 119.26 120.34 2k53 h ALA 46 Ca 0.13 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2k53 h ALA 46 Cb 0.44 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 2k53 h ALA 46 CO -0.36 0.13 0.50 0.28 0.00 0.00 0.00 179.25 179.81 2k53 h VAL 47 N 0.83 1.19 -0.03 0.00 2.07 -1.13 -2.67 116.25 116.51 2k53 h VAL 47 Ca 0.41 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2k53 h VAL 47 Cb 0.46 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 2k53 h VAL 47 CO -0.18 0.19 -0.02 1.57 0.02 0.00 0.00 177.57 179.15 2k53 n HIS 48 N -4.56 0.00 -0.95 1.57 -0.00 -0.74 -4.95 115.22 105.60 2k53 n HIS 48 Ca 0.07 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.25 2k53 n HIS 48 Cb 0.02 -0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.89 2k53 n HIS 48 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2k53 n GLY 49 N 1.31 0.49 3.80 1.57 0.00 0.13 -5.04 105.19 107.47 2k53 n GLY 49 Ca 0.15 -0.28 -0.33 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.00 3.83 -0.36 -0.61 1.01 0.16 -4.92 121.20 118.31 2k53 s ILE 50 Ca 0.00 0.87 -0.16 0.00 0.00 0.00 0.00 60.65 61.36 2k53 s ILE 50 Cb 0.00 -3.39 -0.00 0.00 0.01 0.00 0.00 42.46 39.07 2k53 s ILE 50 CO 0.00 -0.51 0.37 -0.62 0.00 0.00 0.00 174.94 174.18 2k53 s ASP 51 N -2.80 6.17 0.30 3.58 2.15 -1.26 -4.05 116.67 120.77 2k53 s ASP 51 Ca 0.63 -0.38 0.06 0.00 0.43 0.00 0.00 52.55 53.30 2k53 s ASP 51 Cb -0.16 -2.20 0.48 0.00 -0.30 0.00 0.00 42.92 40.75 2k53 s ASP 51 CO 0.37 -0.40 1.72 0.00 -0.17 0.00 0.00 175.17 176.70 2k53 h ALA 52 N 8.54 1.15 -0.98 3.66 0.00 -1.91 -2.93 119.26 126.79 2k53 h ALA 52 Ca -0.29 -0.38 0.04 0.00 0.00 0.00 0.00 54.91 54.28 2k53 h ALA 52 Cb 1.14 -0.09 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 2k53 h ALA 52 CO 0.72 0.56 0.64 0.22 0.00 0.00 0.00 179.25 181.39 2k53 h ASP 53 N 0.23 1.06 -0.02 0.00 3.58 -1.99 0.79 116.42 120.07 2k53 h ASP 53 Ca 0.02 -0.01 -0.01 0.00 0.42 0.00 0.00 57.03 57.46 2k53 h ASP 53 Cb 0.76 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.57 2k53 h ASP 53 CO 0.06 0.72 -0.03 0.11 -2.88 0.00 0.00 179.24 177.22 2k53 h LYS 54 N 1.23 0.05 -0.29 0.28 1.57 -1.99 -3.28 116.57 114.14 2k53 h LYS 54 Ca 0.40 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 59.16 2k53 h LYS 54 Cb 0.02 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2k53 h LYS 54 CO -0.13 0.56 0.17 1.25 -0.57 0.00 0.00 179.45 180.74 2k53 h LEU 55 N -0.46 0.29 -1.00 2.94 5.85 -1.25 -2.63 115.31 119.04 2k53 h LEU 55 Ca 0.00 0.00 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 2k53 h LEU 55 Cb 0.56 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2k53 h LEU 55 CO 0.01 0.21 0.42 0.58 -0.34 0.00 0.00 178.44 179.31 2k53 h VAL 56 N 0.36 1.24 -0.41 1.05 2.07 -1.00 -1.15 116.25 118.40 2k53 h VAL 56 Ca 0.11 -0.63 -0.01 0.00 0.82 0.00 0.00 66.70 67.00 2k53 h VAL 56 Cb -0.01 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 2k53 h VAL 56 CO -0.05 0.28 0.21 0.11 0.02 0.00 0.00 177.57 178.14 2k53 h LYS 57 N 1.12 0.58 -0.81 1.57 1.57 -1.56 -0.60 116.57 118.45 2k53 h LYS 57 Ca 0.28 -0.08 0.09 0.00 -1.87 0.00 0.00 60.65 59.07 2k53 h LYS 57 Cb 0.06 -0.11 -0.07 0.00 0.08 0.00 0.00 32.23 32.19 2k53 h LYS 57 CO -0.04 0.49 0.47 0.93 -0.57 0.00 0.00 179.45 180.72 2k53 h GLU 58 N 0.53 0.77 0.31 3.15 5.08 -1.07 -1.22 114.58 122.12 2k53 h GLU 58 Ca 0.14 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2k53 h GLU 58 Cb 0.08 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2k53 h GLU 58 CO -0.02 0.51 -0.15 -0.07 -1.00 0.00 0.00 179.01 178.28 2k53 h LEU 59 N 0.80 -0.35 -0.22 1.33 3.38 -0.77 -2.50 115.31 116.98 2k53 h LEU 59 Ca 0.38 -0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.34 2k53 h LEU 59 Cb 0.32 0.09 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 2k53 h LEU 59 CO -0.23 -0.15 -0.08 0.78 0.09 0.00 0.00 178.44 178.84 2k53 h ASN 60 N -0.53 -0.28 -0.84 -0.43 2.35 -0.85 -2.06 115.58 112.94 2k53 h ASN 60 Ca -0.04 0.08 0.12 0.00 -0.55 0.00 0.00 56.30 55.90 2k53 h ASN 60 Cb 0.39 0.17 -0.08 0.00 0.05 0.00 0.00 38.32 38.85 2k53 h ASN 60 CO 0.07 -0.11 0.47 -0.33 -1.65 0.00 0.00 177.43 175.88 2k53 h GLU 61 N -0.05 0.72 -0.13 0.81 5.08 -1.25 -2.57 114.58 117.20 2k53 h GLU 61 Ca 0.11 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 2k53 h GLU 61 Cb 0.21 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2k53 h GLU 61 CO -0.25 0.48 0.02 -0.92 -1.00 0.00 0.00 179.01 177.34 2k53 h TYR 62 N 0.74 0.04 -0.70 4.33 3.20 -0.91 0.25 116.97 123.92 2k53 h TYR 62 Ca 0.43 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.32 2k53 h TYR 62 Cb 0.48 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.71 2k53 h TYR 62 CO -0.07 0.01 0.46 0.74 -1.64 0.00 0.00 178.16 177.67 2k53 h PHE 63 N 0.08 0.85 -0.12 -3.82 0.04 -1.11 0.14 116.94 113.00 2k53 h PHE 63 Ca 0.06 0.02 -0.14 0.00 2.80 0.00 0.00 57.97 60.70 2k53 h PHE 63 Cb 0.05 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 37.90 2k53 h PHE 63 CO -0.12 0.52 -0.55 0.93 -0.60 0.00 0.00 178.31 178.49 2k53 h GLU 64 N 0.91 0.36 0.00 1.51 5.08 -1.11 -2.97 114.58 118.35 2k53 h GLU 64 Ca 0.27 -0.22 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2k53 h GLU 64 Cb -0.04 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2k53 h GLU 64 CO -0.07 0.81 -0.23 0.87 -1.00 0.00 0.00 179.01 179.40 2k53 h LYS 65 N 0.28 0.00 -0.70 2.33 1.79 0.13 -2.90 116.57 117.49 2k53 h LYS 65 Ca 0.00 0.00 0.13 0.00 -2.18 0.00 0.00 60.65 58.61 2k53 h LYS 65 Cb 1.05 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.61 2k53 h LYS 65 CO 0.09 0.23 0.23 0.87 -1.08 0.00 0.00 179.45 179.80 2k53 h LYS 66 N 0.00 0.36 0.00 3.15 1.57 -0.64 0.20 116.57 121.21 2k53 h LYS 66 Ca -0.00 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2k53 h LYS 66 Cb 0.43 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 2k53 h LYS 66 CO 0.03 0.24 -0.05 0.93 -0.57 0.00 0.00 179.45 180.03 2k53 h GLU 67 N 0.37 0.00 0.00 3.15 5.08 -1.63 -1.89 114.58 119.66 2k53 h GLU 67 Ca 0.38 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.66 2k53 h GLU 67 Cb 0.57 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 2k53 h GLU 67 CO -0.41 0.05 -0.57 0.28 -1.00 0.00 0.00 179.01 177.36 2k53 h VAL 68 N 0.00 0.62 0.59 3.13 2.07 -0.88 -3.42 116.25 118.37 2k53 h VAL 68 Ca -0.00 -1.63 -0.03 0.00 0.82 0.00 0.00 66.70 65.86 2k53 h VAL 68 Cb 0.34 1.34 0.01 0.00 -1.52 0.00 0.00 31.29 31.46 2k53 h VAL 68 CO 0.01 0.21 -0.29 -0.07 0.02 0.00 0.00 177.57 177.45 2k53 h LEU 69 N -1.00 -0.68 0.00 2.57 3.38 -0.74 -3.52 115.31 115.32 2k53 h LEU 69 Ca -0.11 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2k53 h LEU 69 Cb 0.76 0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2k53 h LEU 69 CO -0.07 -0.29 0.00 -0.62 0.09 0.00 0.00 178.44 177.55