#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 3.05 0.26 0.03 2.47 -1.26 -4.93 119.74 119.36 2k53 s LYS 2 Ca 0.00 -1.25 -0.29 0.00 -1.56 0.00 0.00 55.97 52.86 2k53 s LYS 2 Cb 0.00 -4.24 -0.09 0.00 -1.46 0.00 0.00 37.83 32.04 2k53 s LYS 2 CO 0.00 -1.50 1.24 0.42 0.16 0.00 0.00 175.35 175.67 2k53 s ILE 3 N 2.69 3.17 0.19 5.43 -1.09 -1.26 -5.05 121.20 125.27 2k53 s ILE 3 Ca 0.12 1.08 0.11 0.00 -2.23 0.00 0.00 60.65 59.72 2k53 s ILE 3 Cb -0.23 -3.69 -0.04 0.00 -1.58 0.00 0.00 42.46 36.91 2k53 s ILE 3 CO 0.07 0.22 -0.22 0.42 -1.23 0.00 0.00 174.94 174.20 2k53 s THR 4 N -0.62 2.19 0.45 2.92 -4.23 -1.26 -4.90 115.64 110.18 2k53 s THR 4 Ca 0.51 -2.01 0.19 0.00 -1.18 0.00 0.00 61.69 59.20 2k53 s THR 4 Cb -0.36 -2.04 0.38 0.00 1.34 0.00 0.00 72.50 71.82 2k53 s THR 4 CO 0.43 -0.19 1.91 0.07 -0.54 0.00 0.00 174.62 176.31 2k53 h LYS 5 N 3.19 0.30 0.00 3.99 2.10 -1.97 -0.61 116.57 123.57 2k53 h LYS 5 Ca -0.45 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.18 2k53 h LYS 5 Cb 1.21 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 32.47 2k53 h LYS 5 CO 0.49 0.20 0.00 -0.40 -2.00 0.00 0.00 179.45 177.74 2k53 n ASP 6 N -4.45 0.00 -4.79 7.07 5.75 -1.26 -0.47 116.55 118.40 2k53 n ASP 6 Ca 0.15 -0.43 -0.34 0.00 -0.01 0.00 0.00 54.79 54.16 2k53 n ASP 6 Cb 0.62 -0.17 -0.02 0.00 -1.03 0.00 0.00 41.12 40.52 2k53 n ASP 6 CO 0.00 0.00 0.00 -0.04 -0.11 0.00 0.00 177.20 177.05 2k53 s MET 7 N -2.34 3.59 0.03 0.11 -1.94 -0.24 -4.70 119.30 113.82 2k53 s MET 7 Ca 0.33 1.41 -0.30 0.00 -1.71 0.00 0.00 55.69 55.42 2k53 s MET 7 Cb 0.19 -2.06 -0.04 0.00 2.01 0.00 0.00 34.83 34.93 2k53 s MET 7 CO 0.38 -0.61 0.98 0.42 -0.01 0.00 0.00 175.02 176.18 2k53 s ILE 8 N -2.00 4.76 0.12 2.53 -1.09 -1.26 -0.50 121.20 123.75 2k53 s ILE 8 Ca 0.68 2.04 -0.23 0.00 -2.23 0.00 0.00 60.65 60.91 2k53 s ILE 8 Cb -0.18 -4.31 -0.06 0.00 -1.58 0.00 0.00 42.46 36.33 2k53 s ILE 8 CO 0.25 0.19 1.68 0.40 -1.23 0.00 0.00 174.94 176.23 2k53 h ILE 9 N 4.62 0.68 -1.00 2.92 2.04 -1.59 -0.64 117.51 124.55 2k53 h ILE 9 Ca -0.41 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.53 2k53 h ILE 9 Cb 1.22 0.68 -0.07 0.00 -0.74 0.00 0.00 36.82 37.91 2k53 h ILE 9 CO 0.74 0.00 0.64 0.00 0.00 0.00 0.00 178.15 179.53 2k53 h ALA 10 N 0.84 1.43 -0.51 1.87 0.00 -1.47 -0.34 119.26 121.09 2k53 h ALA 10 Ca 0.06 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 2k53 h ALA 10 Cb 0.26 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2k53 h ALA 10 CO -0.16 0.37 0.17 0.22 0.00 0.00 0.00 179.25 179.85 2k53 h ASP 11 N 1.11 0.73 -0.79 0.00 3.58 -1.61 0.71 116.42 120.14 2k53 h ASP 11 Ca 0.45 -0.20 -0.01 0.00 0.42 0.00 0.00 57.03 57.70 2k53 h ASP 11 Cb 0.27 -0.19 -0.04 0.00 1.72 0.00 0.00 39.33 41.10 2k53 h ASP 11 CO -0.20 0.73 0.47 0.58 -2.88 0.00 0.00 179.24 177.93 2k53 h VAL 12 N 0.69 1.23 -0.54 2.25 2.07 -0.49 -1.91 116.25 119.54 2k53 h VAL 12 Ca 0.17 -0.52 -0.01 0.00 0.82 0.00 0.00 66.70 67.15 2k53 h VAL 12 Cb 0.25 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 30.13 2k53 h VAL 12 CO -0.01 0.24 0.28 -0.07 0.02 0.00 0.00 177.57 178.03 2k53 h LEU 13 N 1.09 0.67 -1.72 2.57 3.38 -0.62 -1.41 115.31 119.28 2k53 h LEU 13 Ca 0.28 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.18 2k53 h LEU 13 Cb -0.02 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.56 2k53 h LEU 13 CO -0.05 0.56 -0.08 1.56 0.09 0.00 0.00 178.44 180.52 2k53 h GLN 14 N 0.76 0.00 0.25 1.13 4.20 -0.11 -2.93 115.11 118.41 2k53 h GLN 14 Ca 0.19 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.89 2k53 h GLN 14 Cb 0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 2k53 h GLN 14 CO -0.03 0.08 -0.12 0.52 -0.67 0.00 0.00 178.83 178.61 2k53 h MET 15 N 0.00 -0.33 -2.97 1.46 2.86 -0.70 -3.47 114.93 111.79 2k53 h MET 15 Ca -0.00 0.02 -0.20 0.00 -2.06 0.00 0.00 59.70 57.46 2k53 h MET 15 Cb 0.45 0.07 -0.30 0.00 0.06 0.00 0.00 31.60 31.88 2k53 h MET 15 CO 0.01 -0.12 -0.49 0.34 1.06 0.00 0.00 176.91 177.72 2k53 s ASP 16 N -5.22 -0.12 0.43 1.22 2.15 -0.81 -5.03 116.67 109.29 2k53 s ASP 16 Ca -0.07 0.56 0.30 0.00 0.43 0.00 0.00 52.55 53.76 2k53 s ASP 16 Cb 0.00 0.50 1.26 0.00 -0.30 0.00 0.00 42.92 44.38 2k53 s ASP 16 CO 0.25 -0.19 1.88 0.03 -0.17 0.00 0.00 175.17 176.97 2k53 h ARG 17 N 7.47 0.00 0.00 4.34 2.47 -1.80 -2.84 114.38 124.02 2k53 h ARG 17 Ca -0.34 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 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 0.31 0.00 0.00 0.41 0.56 0.00 0.00 179.97 181.25 2k53 n GLY 18 N -0.09 -0.70 0.19 0.04 0.00 -1.26 -1.31 105.19 102.06 2k53 n GLY 18 Ca 0.01 -0.05 0.09 0.00 0.00 0.00 0.00 46.02 46.08 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 0.20 -0.05 2.61 1.35 -1.85 -3.37 112.91 111.81 2k53 h THR 19 Ca 0.00 -1.29 0.02 0.00 -0.55 0.00 0.00 66.41 64.59 2k53 h THR 19 Cb 0.12 2.03 -0.03 0.00 -1.73 0.00 0.00 68.15 68.54 2k53 h THR 19 CO 0.00 0.11 -0.09 0.00 -0.25 0.00 0.00 175.52 175.29 2k53 h ALA 20 N 1.87 -0.06 -0.07 6.62 0.00 -1.42 -0.83 119.26 125.38 2k53 h ALA 20 Ca -0.01 0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.95 2k53 h ALA 20 Cb 1.10 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2k53 h ALA 20 CO 0.02 -0.57 0.08 -1.00 0.00 0.00 0.00 179.25 177.77 2k53 h PRO 21 N -0.13 0.00 -0.08 0.00 0.13 -1.76 -0.37 132.00 129.79 2k53 h PRO 21 Ca 0.05 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.08 2k53 h PRO 21 Cb 0.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.34 2k53 h PRO 21 CO -0.13 0.00 -0.35 0.82 -0.23 0.00 0.00 178.00 178.12 2k53 h ILE 22 N 0.00 1.41 0.04 -3.56 2.04 -1.42 0.18 117.51 116.19 2k53 h ILE 22 Ca 0.03 -1.73 0.02 0.00 1.00 0.00 0.00 64.86 64.18 2k53 h ILE 22 Cb 0.18 2.29 -0.02 0.00 -0.74 0.00 0.00 36.82 38.53 2k53 h ILE 22 CO -0.00 0.50 -0.14 -0.26 0.00 0.00 0.00 178.15 178.25 2k53 h PHE 23 N -0.10 -0.36 -0.74 1.37 0.04 -0.43 -2.28 116.94 114.44 2k53 h PHE 23 Ca -0.02 0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.77 2k53 h PHE 23 Cb 0.99 0.15 -0.04 0.00 2.20 0.00 0.00 35.95 39.26 2k53 h PHE 23 CO 0.13 -0.21 0.49 0.82 -0.60 0.00 0.00 178.31 178.94 2k53 h ILE 24 N -0.25 1.18 -0.63 -0.55 2.04 -1.13 -0.47 117.51 117.70 2k53 h ILE 24 Ca 0.04 -0.34 0.11 0.00 1.00 0.00 0.00 64.86 65.66 2k53 h ILE 24 Cb 0.29 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.43 2k53 h ILE 24 CO -0.11 0.18 0.42 -1.13 0.00 0.00 0.00 178.15 177.51 2k53 h ASN 25 N 0.99 0.36 0.17 1.72 -1.24 -0.23 0.05 115.58 117.40 2k53 h ASN 25 Ca 0.28 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.30 2k53 h ASN 25 Cb -0.09 -0.06 0.00 0.00 0.73 0.00 0.00 38.32 38.90 2k53 h ASN 25 CO -0.06 0.21 -0.24 0.59 -1.29 0.00 0.00 177.43 176.64 2k53 n ASN 26 N -4.47 1.24 0.00 1.15 3.02 -0.55 -4.94 115.26 110.72 2k53 n ASN 26 Ca 0.11 -1.07 0.00 0.00 -0.03 0.00 0.00 54.58 53.59 2k53 n ASN 26 Cb 0.41 0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.73 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 1.32 1.17 2.08 7.41 0.00 0.01 -4.87 105.19 112.31 2k53 n GLY 27 Ca 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 2k53 n GLY 27 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2k53 n MET 28 N -1.57 -1.69 -3.65 1.61 2.81 -0.30 -4.95 117.12 109.38 2k53 n MET 28 Ca 0.00 -1.07 -0.29 0.00 -1.81 0.00 0.00 57.70 54.53 2k53 n MET 28 Cb 0.00 -0.88 -0.04 0.00 -0.71 0.00 0.00 33.22 31.59 2k53 n MET 28 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 2k53 s HIS 29 N -2.33 3.48 0.91 2.03 3.76 -1.26 -4.58 115.29 117.30 2k53 s HIS 29 Ca 0.42 0.46 -0.12 0.00 -0.15 0.00 0.00 55.06 55.66 2k53 s HIS 29 Cb -0.03 -1.94 0.14 0.00 1.11 0.00 0.00 32.58 31.86 2k53 s HIS 29 CO 0.31 0.38 1.11 0.00 -0.85 0.00 0.00 174.74 175.69 2k53 s LEU 31 N -6.12 3.38 0.00 0.00 1.98 -1.26 -4.11 118.68 112.54 2k53 s LEU 31 Ca 0.64 0.90 0.00 0.00 -2.89 0.00 0.00 54.13 52.78 2k53 s LEU 31 Cb -0.16 -2.56 0.00 0.00 0.66 0.00 0.00 46.19 44.13 2k53 s LEU 31 CO 0.55 -2.70 0.00 0.61 -1.89 0.00 0.00 176.35 172.92 2k53 n GLY 32 N 5.90 -2.33 3.64 7.98 0.00 -1.26 -5.12 105.19 114.00 2k53 n GLY 32 Ca 0.32 0.75 -0.43 0.00 0.00 0.00 0.00 46.02 46.66 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 11.24 0.00 -0.74 0.00 0.13 -1.99 -2.27 132.00 138.38 2k53 h PRO 34 Ca -0.40 0.00 0.09 0.00 -0.87 0.00 0.00 66.00 64.83 2k53 h PRO 34 Cb 1.19 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.25 2k53 h PRO 34 CO 0.97 0.00 0.39 0.66 -0.23 0.00 0.00 178.00 179.79 2k53 h SER 35 N 0.00 0.52 0.53 1.44 4.64 -2.00 0.46 113.55 119.14 2k53 h SER 35 Ca 0.06 0.06 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2k53 h SER 35 Cb 0.31 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2k53 h SER 35 CO -0.00 0.30 -0.37 -0.24 -0.87 0.00 0.00 176.83 175.64 2k53 n SER 36 N -4.83 0.49 -0.12 4.97 2.88 -0.86 -3.88 113.62 112.27 2k53 n SER 36 Ca 0.12 -0.24 -0.26 0.00 -1.33 0.00 0.00 58.87 57.16 2k53 n SER 36 Cb 0.27 0.11 -0.11 0.00 -0.75 0.00 0.00 64.21 63.73 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 -1.36 0.58 -0.03 -1.46 2.81 -0.72 -4.59 117.12 112.35 2k53 n MET 37 Ca 0.07 0.42 -0.07 0.00 -1.81 0.00 0.00 57.70 56.31 2k53 n MET 37 Cb 0.33 -1.63 0.11 0.00 -0.71 0.00 0.00 33.22 31.32 2k53 n MET 37 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 2k53 h GLY 38 N -0.96 0.67 -0.91 3.03 0.00 -1.11 -1.21 103.07 102.58 2k53 h GLY 38 Ca -0.52 -0.64 -0.47 0.00 0.00 0.00 0.00 47.33 45.70 2k53 h GLY 38 CO -0.31 0.58 0.29 -0.54 0.00 0.00 0.00 176.54 176.56 2k53 s GLU 39 N -4.35 1.38 0.72 4.80 0.41 -1.25 -4.76 118.70 115.65 2k53 s GLU 39 Ca -0.08 0.50 -0.11 0.00 -0.41 0.00 0.00 54.97 54.87 2k53 s GLU 39 Cb 0.13 -1.85 0.02 0.00 -1.78 0.00 0.00 34.13 30.65 2k53 s GLU 39 CO 0.83 -2.08 1.09 -1.54 -0.49 0.00 0.00 175.26 173.07 2k53 s SER 40 N -3.84 5.31 0.15 -0.19 1.04 -1.26 -2.45 113.70 112.44 2k53 s SER 40 Ca 0.63 1.20 -0.18 0.00 0.48 0.00 0.00 55.95 58.08 2k53 s SER 40 Cb -0.15 -2.00 0.03 0.00 0.10 0.00 0.00 66.02 63.99 2k53 s SER 40 CO 0.55 -1.44 1.72 0.40 0.98 0.00 0.00 173.24 175.45 2k53 h ILE 41 N -0.72 0.83 -0.61 -1.02 2.04 -0.58 -1.28 117.51 116.17 2k53 h ILE 41 Ca -0.45 -0.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.33 2k53 h ILE 41 Cb 1.25 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 37.99 2k53 h ILE 41 CO 0.63 0.02 0.25 1.05 0.00 0.00 0.00 178.15 180.10 2k53 h GLU 42 N 0.13 0.88 0.64 2.37 4.11 -1.04 -0.25 114.58 121.43 2k53 h GLU 42 Ca 0.14 -0.14 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2k53 h GLU 42 Cb 0.16 -0.16 0.01 0.00 0.50 0.00 0.00 28.75 29.26 2k53 h GLU 42 CO -0.20 0.72 -0.31 0.22 0.07 0.00 0.00 179.01 179.51 2k53 h ASP 43 N 0.87 -0.73 -0.88 3.06 3.58 -1.73 -2.03 116.42 118.57 2k53 h ASP 43 Ca 0.21 -0.01 0.13 0.00 0.42 0.00 0.00 57.03 57.78 2k53 h ASP 43 Cb 0.16 0.19 -0.07 0.00 1.72 0.00 0.00 39.33 41.34 2k53 h ASP 43 CO -0.02 -0.36 0.57 0.00 -2.88 0.00 0.00 179.24 176.55 2k53 h ALA 44 N -1.06 1.77 -0.18 -0.78 0.00 -1.21 0.20 119.26 118.00 2k53 h ALA 44 Ca -0.09 0.01 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2k53 h ALA 44 Cb 0.69 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.30 2k53 h ALA 44 CO 0.14 0.01 -0.01 0.00 0.00 0.00 0.00 179.25 179.39 2k53 h ALA 46 N 1.16 1.43 0.32 0.00 0.00 -0.27 0.79 119.26 122.68 2k53 h ALA 46 Ca 0.09 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2k53 h ALA 46 Cb 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2k53 h ALA 46 CO -0.15 0.29 -0.15 0.28 0.00 0.00 0.00 179.25 179.52 2k53 h VAL 47 N 0.00 0.68 0.00 0.00 2.07 -0.48 -3.30 116.25 115.22 2k53 h VAL 47 Ca -0.00 -0.56 0.00 0.00 0.82 0.00 0.00 66.70 66.96 2k53 h VAL 47 Cb 0.47 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 2k53 h VAL 47 CO 0.03 0.11 -0.63 -0.74 0.02 0.00 0.00 177.57 176.36 2k53 h HIS 48 N -0.75 0.00 -1.37 1.57 2.76 -1.25 -3.49 115.15 112.62 2k53 h HIS 48 Ca -0.04 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 2k53 h HIS 48 Cb 0.50 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.46 2k53 h HIS 48 CO 0.02 0.00 0.00 0.41 -1.30 0.00 0.00 177.93 177.06 2k53 n GLY 49 N 1.20 0.61 3.65 5.26 0.00 0.23 -5.09 105.19 111.05 2k53 n GLY 49 Ca 0.02 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 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 -2.31 3.71 -0.62 -0.61 1.01 0.10 -5.00 121.20 117.47 2k53 s ILE 50 Ca 0.00 -1.33 -0.25 0.00 0.00 0.00 0.00 60.65 59.07 2k53 s ILE 50 Cb 0.00 -2.83 0.05 0.00 0.01 0.00 0.00 42.46 39.69 2k53 s ILE 50 CO 0.00 -0.04 1.05 -0.62 0.00 0.00 0.00 174.94 175.33 2k53 s ASP 51 N -2.72 6.27 0.37 3.58 2.15 -1.26 -4.51 116.67 120.55 2k53 s ASP 51 Ca 0.26 -0.49 0.06 0.00 0.43 0.00 0.00 52.55 52.81 2k53 s ASP 51 Cb -0.10 -2.47 0.73 0.00 -0.30 0.00 0.00 42.92 40.78 2k53 s ASP 51 CO 0.18 -1.44 1.96 0.00 -0.17 0.00 0.00 175.17 175.70 2k53 h ALA 52 N 9.56 1.53 -0.54 3.66 0.00 -1.94 -2.22 119.26 129.31 2k53 h ALA 52 Ca -0.27 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.54 2k53 h ALA 52 Cb 1.07 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.67 2k53 h ALA 52 CO 1.17 0.36 0.32 0.22 0.00 0.00 0.00 179.25 181.31 2k53 h ASP 53 N 0.51 0.52 -0.06 0.00 3.58 -1.99 0.80 116.42 119.78 2k53 h ASP 53 Ca 0.12 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.57 2k53 h ASP 53 Cb 0.15 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.09 2k53 h ASP 53 CO -0.01 0.36 -0.00 0.11 -2.88 0.00 0.00 179.24 176.82 2k53 h LYS 54 N 0.64 0.10 0.17 0.28 1.57 -1.90 -2.82 116.57 114.61 2k53 h LYS 54 Ca 0.22 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2k53 h LYS 54 Cb 0.03 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 2k53 h LYS 54 CO -0.10 0.39 -0.16 1.25 -0.57 0.00 0.00 179.45 180.26 2k53 h LEU 55 N -0.20 -0.42 -1.01 2.94 5.85 -1.16 -1.46 115.31 119.85 2k53 h LEU 55 Ca 0.02 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.81 2k53 h LEU 55 Cb 0.35 0.14 -0.06 0.00 0.37 0.00 0.00 40.66 41.46 2k53 h LEU 55 CO 0.00 -0.24 0.66 0.58 -0.34 0.00 0.00 178.44 179.10 2k53 h VAL 56 N -0.36 1.17 -0.50 1.05 2.07 -0.93 0.00 116.25 118.76 2k53 h VAL 56 Ca -0.00 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2k53 h VAL 56 Cb 0.33 -0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 29.87 2k53 h VAL 56 CO -0.03 0.23 0.31 0.11 0.02 0.00 0.00 177.57 178.21 2k53 h LYS 57 N 1.27 0.67 -0.46 1.57 1.57 -1.22 -0.46 116.57 119.50 2k53 h LYS 57 Ca 0.40 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 59.10 2k53 h LYS 57 Cb 0.01 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 2k53 h LYS 57 CO -0.13 0.47 0.13 0.93 -0.57 0.00 0.00 179.45 180.28 2k53 h GLU 58 N 0.67 0.68 0.11 3.15 5.08 -0.29 -0.41 114.58 123.57 2k53 h GLU 58 Ca 0.18 -0.12 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2k53 h GLU 58 Cb -0.04 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.10 2k53 h GLU 58 CO -0.04 0.60 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.45 2k53 h LEU 59 N 0.67 -0.13 -0.09 1.33 3.38 -0.61 -1.91 115.31 117.95 2k53 h LEU 59 Ca 0.15 -0.17 0.02 0.00 0.09 0.00 0.00 57.88 57.97 2k53 h LEU 59 Cb 0.22 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2k53 h LEU 59 CO -0.01 0.10 -0.02 0.78 0.09 0.00 0.00 178.44 179.39 2k53 h ASN 60 N -0.36 -0.07 -0.65 -0.43 2.35 -0.88 -2.36 115.58 113.18 2k53 h ASN 60 Ca -0.02 0.03 0.13 0.00 -0.55 0.00 0.00 56.30 55.89 2k53 h ASN 60 Cb 0.29 0.05 -0.10 0.00 0.05 0.00 0.00 38.32 38.61 2k53 h ASN 60 CO 0.03 -0.02 0.11 -0.33 -1.65 0.00 0.00 177.43 175.56 2k53 h GLU 61 N 0.01 0.21 -0.16 0.81 5.08 -1.10 -2.11 114.58 117.33 2k53 h GLU 61 Ca 0.04 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.44 2k53 h GLU 61 Cb 0.06 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.21 2k53 h GLU 61 CO -0.09 0.14 -0.15 -0.92 -1.00 0.00 0.00 179.01 176.99 2k53 h TYR 62 N 0.22 -0.38 -0.96 4.33 3.20 -0.85 0.32 116.97 122.86 2k53 h TYR 62 Ca 0.35 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.30 2k53 h TYR 62 Cb 0.56 0.19 -0.06 0.00 1.54 0.00 0.00 36.73 38.96 2k53 h TYR 62 CO -0.29 -0.22 0.62 0.74 -1.64 0.00 0.00 178.16 177.38 2k53 h PHE 63 N -0.17 1.14 -0.33 -3.82 0.04 -0.97 -0.78 116.94 112.05 2k53 h PHE 63 Ca 0.10 0.03 -0.13 0.00 2.80 0.00 0.00 57.97 60.78 2k53 h PHE 63 Cb 0.32 -0.37 -0.01 0.00 2.20 0.00 0.00 35.95 38.09 2k53 h PHE 63 CO -0.28 0.60 -0.31 0.93 -0.60 0.00 0.00 178.31 178.65 2k53 h GLU 64 N 1.12 0.71 -0.66 1.51 5.08 -0.73 -3.07 114.58 118.54 2k53 h GLU 64 Ca 0.41 -0.32 -0.00 0.00 -1.00 0.00 0.00 59.36 58.45 2k53 h GLU 64 Cb 0.16 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 2k53 h GLU 64 CO -0.16 0.93 0.41 0.87 -1.00 0.00 0.00 179.01 180.07 2k53 h LYS 65 N 0.60 0.89 0.02 2.33 1.79 0.97 -2.39 116.57 120.78 2k53 h LYS 65 Ca 0.07 -0.07 0.02 0.00 -2.18 0.00 0.00 60.65 58.49 2k53 h LYS 65 Cb 0.83 -0.19 -0.03 0.00 -1.58 0.00 0.00 32.23 31.25 2k53 h LYS 65 CO 0.07 0.61 -0.18 0.87 -1.08 0.00 0.00 179.45 179.75 2k53 h LYS 66 N 0.91 -0.29 0.00 3.15 1.57 -1.12 -0.79 116.57 119.99 2k53 h LYS 66 Ca 0.24 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 59.04 2k53 h LYS 66 Cb -0.06 0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2k53 h LYS 66 CO -0.05 -0.19 0.00 0.39 -0.57 0.00 0.00 179.45 179.03 2k53 n GLU 67 N -5.31 0.04 -0.06 3.15 1.02 -0.94 -0.17 120.64 118.37 2k53 n GLU 67 Ca -0.05 0.42 -0.19 0.00 -0.02 0.00 0.00 57.16 57.31 2k53 n GLU 67 Cb 0.22 -1.60 -0.13 0.00 -0.02 0.00 0.00 31.44 29.92 2k53 n GLU 67 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2k53 h VAL 68 N 0.00 1.23 0.21 2.62 2.07 -0.84 -3.41 116.25 118.13 2k53 h VAL 68 Ca 0.00 -2.29 -0.01 0.00 0.82 0.00 0.00 66.70 65.22 2k53 h VAL 68 Cb 0.13 2.73 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 2k53 h VAL 68 CO 0.00 0.51 -0.10 -0.07 0.02 0.00 0.00 177.57 177.93 2k53 h LEU 69 N -0.81 -0.24 0.00 2.57 3.38 -0.43 -3.52 115.31 116.26 2k53 h LEU 69 Ca -0.23 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.47 2k53 h LEU 69 Cb 1.34 0.06 0.00 0.00 0.09 0.00 0.00 40.66 42.15 2k53 h LEU 69 CO -0.07 0.27 0.00 -0.62 0.09 0.00 0.00 178.44 178.11