#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 3.18 0.30 0.03 2.47 -1.26 -4.96 119.74 119.51 2k53 s LYS 2 Ca 0.00 0.75 -0.29 0.00 -1.56 0.00 0.00 55.97 54.86 2k53 s LYS 2 Cb 0.00 -4.19 -0.12 0.00 -1.46 0.00 0.00 37.83 32.06 2k53 s LYS 2 CO 0.00 -2.07 1.41 -0.89 0.16 0.00 0.00 175.35 173.96 2k53 n ILE 3 N 7.08 1.48 -4.37 5.43 2.08 -1.26 -5.02 119.36 124.78 2k53 n ILE 3 Ca 0.17 -0.37 -0.26 0.00 0.56 0.00 0.00 62.75 62.85 2k53 n ILE 3 Cb 0.49 -1.66 -0.10 0.00 -0.75 0.00 0.00 39.64 37.62 2k53 n ILE 3 CO 0.00 0.00 0.00 0.42 0.56 0.00 0.00 176.55 177.53 2k53 s THR 4 N -0.56 2.78 -0.59 1.39 -4.23 -1.26 -4.90 115.64 108.26 2k53 s THR 4 Ca 0.61 -1.98 0.21 0.00 -1.18 0.00 0.00 61.69 59.35 2k53 s THR 4 Cb -0.57 -2.40 0.21 0.00 1.34 0.00 0.00 72.50 71.08 2k53 s THR 4 CO 0.56 -0.21 1.63 2.29 -0.54 0.00 0.00 174.62 178.35 2k53 n LYS 5 N -0.14 0.14 0.19 3.99 2.85 -1.26 -1.81 118.16 122.12 2k53 n LYS 5 Ca -0.10 0.40 0.08 0.00 -1.05 0.00 0.00 58.31 57.64 2k53 n LYS 5 Cb 0.57 -1.78 0.14 0.00 -0.65 0.00 0.00 35.03 33.31 2k53 n LYS 5 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 2k53 h ASP 6 N 0.00 0.00 -4.18 -5.58 3.58 -1.95 0.69 116.42 108.99 2k53 h ASP 6 Ca 0.00 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 2k53 h ASP 6 Cb 0.30 0.00 0.14 0.00 1.72 0.00 0.00 39.33 41.49 2k53 h ASP 6 CO 0.00 0.24 0.39 -0.04 -2.88 0.00 0.00 179.24 176.95 2k53 s MET 7 N -3.15 2.40 0.20 0.28 -1.94 -0.75 -4.52 119.30 111.81 2k53 s MET 7 Ca 0.05 1.66 -0.27 0.00 -1.71 0.00 0.00 55.69 55.42 2k53 s MET 7 Cb 0.07 -1.87 -0.08 0.00 2.01 0.00 0.00 34.83 34.95 2k53 s MET 7 CO 0.70 -1.62 0.85 0.42 -0.01 0.00 0.00 175.02 175.36 2k53 s ILE 8 N -2.05 4.24 0.11 2.53 -1.09 -1.26 -0.71 121.20 122.97 2k53 s ILE 8 Ca 0.73 1.88 -0.29 0.00 -2.23 0.00 0.00 60.65 60.74 2k53 s ILE 8 Cb -0.27 -4.23 -0.10 0.00 -1.58 0.00 0.00 42.46 36.29 2k53 s ILE 8 CO 0.43 0.51 1.62 0.40 -1.23 0.00 0.00 174.94 176.67 2k53 h ILE 9 N 3.27 0.35 -0.62 2.92 2.04 -1.52 -1.89 117.51 122.06 2k53 h ILE 9 Ca -0.46 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.43 2k53 h ILE 9 Cb 1.20 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 2k53 h ILE 9 CO 0.67 0.00 0.41 0.00 0.00 0.00 0.00 178.15 179.23 2k53 h ALA 10 N 0.05 1.67 -0.65 1.87 0.00 -1.55 -1.28 119.26 119.37 2k53 h ALA 10 Ca 0.01 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2k53 h ALA 10 Cb 0.57 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2k53 h ALA 10 CO -0.13 0.26 0.40 0.22 0.00 0.00 0.00 179.25 180.00 2k53 h ASP 11 N 0.72 0.66 -0.47 0.00 3.58 -1.66 0.23 116.42 119.49 2k53 h ASP 11 Ca 0.25 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.66 2k53 h ASP 11 Cb 0.09 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 2k53 h ASP 11 CO -0.07 0.45 0.14 0.58 -2.88 0.00 0.00 179.24 177.46 2k53 h VAL 12 N 0.79 1.23 0.00 2.25 2.07 -0.58 -2.84 116.25 119.17 2k53 h VAL 12 Ca 0.26 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 2k53 h VAL 12 Cb 0.03 0.85 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 2k53 h VAL 12 CO -0.11 0.28 -0.09 -0.07 0.02 0.00 0.00 177.57 177.60 2k53 h LEU 13 N 0.62 0.00 -1.85 2.57 3.38 -0.47 -1.17 115.31 118.38 2k53 h LEU 13 Ca 0.15 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.09 2k53 h LEU 13 Cb 0.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.03 2k53 h LEU 13 CO -0.00 0.09 -0.13 1.56 0.09 0.00 0.00 178.44 180.05 2k53 h GLN 14 N 0.00 0.00 0.01 1.13 1.08 -0.31 -3.21 115.11 113.82 2k53 h GLN 14 Ca -0.00 0.00 -0.20 0.00 -1.45 0.00 0.00 58.65 57.00 2k53 h GLN 14 Cb 0.18 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.59 2k53 h GLN 14 CO 0.01 0.13 -1.07 0.52 -0.95 0.00 0.00 178.83 177.47 2k53 h MET 15 N 0.00 0.03 -2.76 1.46 2.86 -1.26 -3.47 114.93 111.78 2k53 h MET 15 Ca -0.00 -0.05 -0.19 0.00 -2.06 0.00 0.00 59.70 57.40 2k53 h MET 15 Cb 0.26 0.02 -0.31 0.00 0.06 0.00 0.00 31.60 31.62 2k53 h MET 15 CO 0.02 1.02 -0.49 0.34 1.06 0.00 0.00 176.91 178.86 2k53 s ASP 16 N -6.76 0.21 0.00 1.22 -1.08 -0.89 -5.02 116.67 104.35 2k53 s ASP 16 Ca -0.26 0.68 0.23 0.00 -0.52 0.00 0.00 52.55 52.68 2k53 s ASP 16 Cb 0.04 0.86 1.05 0.00 -1.46 0.00 0.00 42.92 43.41 2k53 s ASP 16 CO 0.63 -0.24 1.74 0.54 0.52 0.00 0.00 175.17 178.36 2k53 n ARG 17 N 5.36 0.13 0.00 4.34 5.12 -1.24 -2.75 116.66 127.62 2k53 n ARG 17 Ca -0.07 0.09 0.09 0.00 -1.93 0.00 0.00 57.85 56.03 2k53 n ARG 17 Cb 0.50 -1.50 0.41 0.00 -1.16 0.00 0.00 32.46 30.70 2k53 n ARG 17 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k53 n GLY 18 N 0.78 -1.01 0.17 -0.13 0.00 -1.26 -2.16 105.19 101.57 2k53 n GLY 18 Ca 0.08 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.03 2.61 1.35 -1.89 -3.37 112.91 111.58 2k53 h THR 19 Ca 0.00 -0.80 0.03 0.00 -0.55 0.00 0.00 66.41 65.08 2k53 h THR 19 Cb 0.25 1.75 -0.03 0.00 -1.73 0.00 0.00 68.15 68.39 2k53 h THR 19 CO 0.00 0.00 -0.15 0.00 -0.25 0.00 0.00 175.52 175.12 2k53 h ALA 20 N 2.20 -0.15 -0.04 6.62 0.00 -1.67 -0.63 119.26 125.59 2k53 h ALA 20 Ca 0.00 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2k53 h ALA 20 Cb 0.90 0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.96 2k53 h ALA 20 CO 0.00 -0.63 0.03 -1.00 0.00 0.00 0.00 179.25 177.65 2k53 h PRO 21 N -0.23 0.00 -0.15 0.00 0.13 -1.79 -0.77 132.00 129.19 2k53 h PRO 21 Ca 0.06 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.14 2k53 h PRO 21 Cb 0.31 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.44 2k53 h PRO 21 CO -0.17 0.00 -0.09 0.82 -0.23 0.00 0.00 178.00 178.33 2k53 h ILE 22 N 0.00 1.32 -0.25 -3.56 2.04 -1.43 0.24 117.51 115.87 2k53 h ILE 22 Ca 0.02 -1.16 0.04 0.00 1.00 0.00 0.00 64.86 64.75 2k53 h ILE 22 Cb 0.08 1.76 -0.03 0.00 -0.74 0.00 0.00 36.82 37.89 2k53 h ILE 22 CO -0.00 0.34 0.03 -0.26 0.00 0.00 0.00 178.15 178.26 2k53 h PHE 23 N -0.01 0.05 -0.57 1.37 0.04 -0.57 -2.53 116.94 114.73 2k53 h PHE 23 Ca 0.03 0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 2k53 h PHE 23 Cb 0.58 0.02 -0.03 0.00 2.20 0.00 0.00 35.95 38.72 2k53 h PHE 23 CO 0.07 -0.00 0.30 0.82 -0.60 0.00 0.00 178.31 178.90 2k53 h ILE 24 N 0.12 1.18 -0.49 -0.55 2.04 -1.08 -0.58 117.51 118.14 2k53 h ILE 24 Ca 0.12 -0.47 0.07 0.00 1.00 0.00 0.00 64.86 65.58 2k53 h ILE 24 Cb 0.13 0.43 -0.03 0.00 -0.74 0.00 0.00 36.82 36.61 2k53 h ILE 24 CO -0.17 0.20 0.33 -1.13 0.00 0.00 0.00 178.15 177.39 2k53 h ASN 25 N 0.79 0.33 0.15 1.72 -1.24 -0.09 -0.73 115.58 116.52 2k53 h ASN 25 Ca 0.20 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.21 2k53 h ASN 25 Cb 0.04 -0.07 0.00 0.00 0.73 0.00 0.00 38.32 39.03 2k53 h ASN 25 CO -0.03 0.21 -0.28 0.59 -1.29 0.00 0.00 177.43 176.63 2k53 n ASN 26 N -4.47 1.33 0.00 1.15 3.02 -0.77 -4.94 115.26 110.58 2k53 n ASN 26 Ca 0.07 -1.11 0.00 0.00 -0.03 0.00 0.00 54.58 53.51 2k53 n ASN 26 Cb 0.29 0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 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 1.34 1.72 3.70 7.41 0.00 -0.28 -4.74 105.19 114.35 2k53 n GLY 27 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.03 1.32 -0.22 1.61 -1.94 -0.30 -4.90 119.30 114.84 2k53 s MET 28 Ca 0.00 1.35 -0.02 0.00 -1.71 0.00 0.00 55.69 55.31 2k53 s MET 28 Cb 0.00 -1.78 0.07 0.00 2.01 0.00 0.00 34.83 35.13 2k53 s MET 28 CO 0.00 -2.36 0.03 -1.01 -0.01 0.00 0.00 175.02 171.68 2k53 s HIS 29 N -2.74 1.37 0.30 -0.03 3.76 -1.26 -3.82 115.29 112.87 2k53 s HIS 29 Ca 0.65 -1.16 0.10 0.00 -0.15 0.00 0.00 55.06 54.50 2k53 s HIS 29 Cb -0.21 -1.23 0.48 0.00 1.11 0.00 0.00 32.58 32.73 2k53 s HIS 29 CO 0.58 -0.69 1.69 0.00 -0.85 0.00 0.00 174.74 175.47 2k53 s LEU 31 N -7.95 4.47 0.00 0.00 1.98 -1.26 -4.90 118.68 111.02 2k53 s LEU 31 Ca -0.03 -1.42 0.00 0.00 -2.89 0.00 0.00 54.13 49.79 2k53 s LEU 31 Cb 0.13 -1.82 0.00 0.00 0.66 0.00 0.00 46.19 45.16 2k53 s LEU 31 CO 0.76 -0.37 0.00 0.61 -1.89 0.00 0.00 176.35 175.45 2k53 n GLY 32 N 4.71 -1.43 3.63 7.98 0.00 -1.26 -5.10 105.19 113.72 2k53 n GLY 32 Ca -0.10 0.59 -0.43 0.00 0.00 0.00 0.00 46.02 46.08 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 8.48 0.73 0.00 0.00 0.13 -1.97 -1.49 132.00 137.89 2k53 h PRO 34 Ca -0.22 -0.04 -0.01 0.00 -0.87 0.00 0.00 66.00 64.85 2k53 h PRO 34 Cb 1.07 -0.16 -0.00 0.00 0.13 0.00 0.00 31.00 32.04 2k53 h PRO 34 CO 1.04 0.48 -0.04 1.03 -0.23 0.00 0.00 178.00 180.28 2k53 h SER 35 N 0.75 0.00 -0.61 1.44 0.87 -2.00 -2.38 113.55 111.62 2k53 h SER 35 Ca 0.46 0.00 0.17 0.00 -1.23 0.00 0.00 61.79 61.19 2k53 h SER 35 Cb 0.56 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.49 2k53 h SER 35 CO -0.31 0.04 0.44 0.28 -0.53 0.00 0.00 176.83 176.74 2k53 h SER 36 N 0.00 0.06 -0.29 6.23 0.02 -1.65 0.67 113.55 118.59 2k53 h SER 36 Ca -0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 2k53 h SER 36 Cb 0.08 -0.01 -0.02 0.00 0.14 0.00 0.00 62.40 62.60 2k53 h SER 36 CO 0.01 0.03 -0.13 0.24 -1.14 0.00 0.00 176.83 175.84 2k53 h MET 37 N 0.06 0.71 -0.32 3.45 2.86 -1.58 -3.12 114.93 116.99 2k53 h MET 37 Ca 0.29 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2k53 h MET 37 Cb 1.09 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.69 2k53 h MET 37 CO -0.02 0.81 0.00 0.41 1.06 0.00 0.00 176.91 179.17 2k53 n GLY 38 N -0.46 1.01 3.85 8.32 0.00 0.20 -1.51 105.19 116.61 2k53 n GLY 38 Ca 0.01 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.59 3.93 0.52 1.61 2.02 -1.05 -4.90 118.70 119.23 2k53 s GLU 39 Ca 0.35 0.43 -0.21 0.00 0.02 0.00 0.00 54.97 55.55 2k53 s GLU 39 Cb 0.19 -2.83 -0.06 0.00 0.10 0.00 0.00 34.13 31.54 2k53 s GLU 39 CO 0.27 0.42 1.22 -1.12 0.02 0.00 0.00 175.26 176.07 2k53 s SER 40 N -1.93 5.71 0.13 -0.19 0.01 -1.26 -1.94 113.70 114.22 2k53 s SER 40 Ca 0.41 2.42 -0.29 0.00 1.31 0.00 0.00 55.95 59.81 2k53 s SER 40 Cb -0.14 -2.61 -0.06 0.00 0.21 0.00 0.00 66.02 63.43 2k53 s SER 40 CO 0.20 -1.24 1.59 0.40 0.41 0.00 0.00 173.24 174.59 2k53 h ILE 41 N 1.51 0.16 -0.49 1.44 2.04 -0.61 0.14 117.51 121.70 2k53 h ILE 41 Ca -0.50 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 2k53 h ILE 41 Cb 1.27 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 37.49 2k53 h ILE 41 CO 0.58 0.00 0.15 1.05 0.00 0.00 0.00 178.15 179.93 2k53 h GLU 42 N -0.50 0.73 0.15 2.37 4.11 -1.16 0.04 114.58 120.32 2k53 h GLU 42 Ca 0.07 -0.12 -0.01 0.00 0.07 0.00 0.00 59.36 59.37 2k53 h GLU 42 Cb 0.62 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.75 2k53 h GLU 42 CO -0.38 0.64 -0.07 0.22 0.07 0.00 0.00 179.01 179.49 2k53 h ASP 43 N 0.71 -0.17 -0.38 3.06 3.58 -1.57 -1.37 116.42 120.28 2k53 h ASP 43 Ca 0.16 -0.21 -0.03 0.00 0.42 0.00 0.00 57.03 57.37 2k53 h ASP 43 Cb 0.22 0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.29 2k53 h ASP 43 CO -0.01 0.12 0.13 0.00 -2.88 0.00 0.00 179.24 176.60 2k53 h ALA 44 N 0.33 1.41 0.37 -0.78 0.00 -0.66 -2.76 119.26 117.17 2k53 h ALA 44 Ca -0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 2k53 h ALA 44 Cb 0.37 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2k53 h ALA 44 CO 0.03 0.44 -0.26 0.00 0.00 0.00 0.00 179.25 179.46 2k53 h ALA 46 N -0.04 1.82 0.21 0.00 0.00 -1.09 0.98 119.26 121.13 2k53 h ALA 46 Ca -0.04 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2k53 h ALA 46 Cb 0.52 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2k53 h ALA 46 CO 0.02 -0.06 -0.11 0.28 0.00 0.00 0.00 179.25 179.38 2k53 h VAL 47 N 0.70 0.77 -0.02 0.00 2.07 -1.23 -3.08 116.25 115.48 2k53 h VAL 47 Ca 0.45 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.97 2k53 h VAL 47 Cb 0.70 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 31.24 2k53 h VAL 47 CO -0.21 0.00 -0.04 1.57 0.02 0.00 0.00 177.57 178.91 2k53 n HIS 48 N -5.22 0.00 -2.74 1.57 -0.00 -0.76 -4.96 115.22 103.11 2k53 n HIS 48 Ca -0.09 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.55 2k53 n HIS 48 Cb 0.15 -0.01 0.04 0.00 -0.00 0.00 0.00 29.99 30.16 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 1.23 0.18 3.88 1.57 0.00 0.31 -5.06 105.19 107.30 2k53 n GLY 49 Ca 0.17 -0.25 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 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 -3.15 5.08 -0.73 -0.61 1.01 0.40 -4.98 121.20 118.22 2k53 s ILE 50 Ca 0.09 -0.58 -0.24 0.00 0.00 0.00 0.00 60.65 59.92 2k53 s ILE 50 Cb -0.04 -3.50 0.06 0.00 0.01 0.00 0.00 42.46 38.99 2k53 s ILE 50 CO 0.31 0.09 1.11 -0.62 0.00 0.00 0.00 174.94 175.82 2k53 s ASP 51 N -2.62 6.23 0.43 3.58 2.15 -1.26 -4.44 116.67 120.73 2k53 s ASP 51 Ca 0.33 -0.94 0.19 0.00 0.43 0.00 0.00 52.55 52.56 2k53 s ASP 51 Cb -0.12 -2.47 0.96 0.00 -0.30 0.00 0.00 42.92 40.99 2k53 s ASP 51 CO 0.26 -1.54 1.89 0.00 -0.17 0.00 0.00 175.17 175.61 2k53 h ALA 52 N 9.67 1.28 -0.20 3.66 0.00 -1.93 -2.46 119.26 129.28 2k53 h ALA 52 Ca -0.22 -0.25 0.05 0.00 0.00 0.00 0.00 54.91 54.49 2k53 h ALA 52 Cb 1.06 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.75 2k53 h ALA 52 CO 1.22 0.35 -0.16 0.22 0.00 0.00 0.00 179.25 180.88 2k53 h ASP 53 N 0.00 -0.52 0.06 0.00 3.58 -2.00 -0.92 116.42 116.62 2k53 h ASP 53 Ca -0.00 0.10 -0.28 0.00 0.42 0.00 0.00 57.03 57.27 2k53 h ASP 53 Cb 0.59 0.26 0.03 0.00 1.72 0.00 0.00 39.33 41.93 2k53 h ASP 53 CO 0.04 -0.20 -1.14 0.11 -2.88 0.00 0.00 179.24 175.16 2k53 h LYS 54 N -0.17 0.66 0.08 0.28 1.57 -1.97 -3.16 116.57 113.86 2k53 h LYS 54 Ca 0.12 -0.79 0.02 0.00 -1.87 0.00 0.00 60.65 58.13 2k53 h LYS 54 Cb 0.35 0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 2k53 h LYS 54 CO -0.30 1.35 -0.22 1.25 -0.57 0.00 0.00 179.45 180.96 2k53 h LEU 55 N 0.32 -0.64 -0.94 2.94 5.85 -1.28 -0.54 115.31 121.02 2k53 h LEU 55 Ca -0.16 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2k53 h LEU 55 Cb 1.80 0.25 -0.04 0.00 0.37 0.00 0.00 40.66 43.04 2k53 h LEU 55 CO 0.22 -0.30 0.54 0.58 -0.34 0.00 0.00 178.44 179.14 2k53 h VAL 56 N -0.40 1.26 -0.41 1.05 2.07 -1.30 -1.44 116.25 117.09 2k53 h VAL 56 Ca 0.04 -0.60 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 2k53 h VAL 56 Cb 0.44 -0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.16 2k53 h VAL 56 CO -0.15 0.28 0.25 0.11 0.02 0.00 0.00 177.57 178.08 2k53 h LYS 57 N 1.29 0.55 -1.00 1.57 1.57 -1.43 -0.38 116.57 118.74 2k53 h LYS 57 Ca 0.33 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 59.07 2k53 h LYS 57 Cb -0.02 -0.12 -0.05 0.00 0.08 0.00 0.00 32.23 32.12 2k53 h LYS 57 CO -0.06 0.40 0.65 0.93 -0.57 0.00 0.00 179.45 180.81 2k53 h GLU 58 N 0.53 1.32 0.23 3.15 5.08 -0.70 -0.12 114.58 124.08 2k53 h GLU 58 Ca 0.15 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2k53 h GLU 58 Cb -0.00 -0.29 -0.00 0.00 0.50 0.00 0.00 28.75 28.95 2k53 h GLU 58 CO -0.03 0.88 -0.14 -0.07 -1.00 0.00 0.00 179.01 178.66 2k53 h LEU 59 N 1.36 -0.35 -0.12 1.33 3.38 -0.85 -1.71 115.31 118.35 2k53 h LEU 59 Ca 0.37 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.38 2k53 h LEU 59 Cb -0.14 0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 2k53 h LEU 59 CO -0.08 -0.23 -0.02 0.78 0.09 0.00 0.00 178.44 178.98 2k53 h ASN 60 N -0.36 -0.10 -0.73 -0.43 2.35 -0.76 -2.04 115.58 113.51 2k53 h ASN 60 Ca -0.02 0.03 0.12 0.00 -0.55 0.00 0.00 56.30 55.89 2k53 h ASN 60 Cb 0.30 0.07 -0.09 0.00 0.05 0.00 0.00 38.32 38.65 2k53 h ASN 60 CO 0.02 -0.03 0.31 -0.33 -1.65 0.00 0.00 177.43 175.74 2k53 h GLU 61 N 0.01 0.47 0.26 0.81 5.08 -0.99 -1.76 114.58 118.45 2k53 h GLU 61 Ca 0.06 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 2k53 h GLU 61 Cb 0.08 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.21 2k53 h GLU 61 CO -0.12 0.31 -0.22 -0.92 -1.00 0.00 0.00 179.01 177.06 2k53 h TYR 62 N 0.48 -0.59 -0.89 4.33 3.20 -0.80 0.86 116.97 123.56 2k53 h TYR 62 Ca 0.38 0.00 0.07 0.00 3.14 0.00 0.00 58.73 62.32 2k53 h TYR 62 Cb 0.53 0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.96 2k53 h TYR 62 CO -0.15 -0.34 0.55 0.74 -1.64 0.00 0.00 178.16 177.32 2k53 h PHE 63 N -0.50 1.02 -0.02 -3.82 0.04 -0.94 -1.12 116.94 111.59 2k53 h PHE 63 Ca -0.01 0.03 -0.13 0.00 2.80 0.00 0.00 57.97 60.65 2k53 h PHE 63 Cb 0.45 -0.33 -0.02 0.00 2.20 0.00 0.00 35.95 38.26 2k53 h PHE 63 CO -0.14 0.50 -0.61 0.93 -0.60 0.00 0.00 178.31 178.39 2k53 h GLU 64 N 0.99 0.06 0.00 1.51 5.08 -1.13 -2.63 114.58 118.47 2k53 h GLU 64 Ca 0.39 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.66 2k53 h GLU 64 Cb 0.20 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2k53 h GLU 64 CO -0.18 0.65 -0.24 0.87 -1.00 0.00 0.00 179.01 179.11 2k53 h LYS 65 N 0.05 0.00 -0.52 2.33 1.79 0.25 -3.01 116.57 117.45 2k53 h LYS 65 Ca -0.01 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.52 2k53 h LYS 65 Cb 1.09 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.68 2k53 h LYS 65 CO 0.08 0.24 0.23 0.87 -1.08 0.00 0.00 179.45 179.79 2k53 h LYS 66 N 0.00 0.43 0.00 3.15 1.57 -0.85 0.47 116.57 121.34 2k53 h LYS 66 Ca -0.00 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.75 2k53 h LYS 66 Cb 0.48 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 2k53 h LYS 66 CO 0.03 0.29 -0.03 0.93 -0.57 0.00 0.00 179.45 180.10 2k53 h GLU 67 N 0.45 0.00 0.11 3.15 5.08 -1.62 0.32 114.58 122.06 2k53 h GLU 67 Ca 0.24 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.45 2k53 h GLU 67 Cb 0.21 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.47 2k53 h GLU 67 CO -0.20 0.03 -0.64 0.28 -1.00 0.00 0.00 179.01 177.47 2k53 h VAL 68 N 0.00 1.56 0.67 3.13 2.07 -1.21 -3.38 116.25 119.09 2k53 h VAL 68 Ca -0.00 -2.46 -0.03 0.00 0.82 0.00 0.00 66.70 65.02 2k53 h VAL 68 Cb 0.23 3.20 0.01 0.00 -1.52 0.00 0.00 31.29 33.20 2k53 h VAL 68 CO 0.00 0.69 -0.32 -0.07 0.02 0.00 0.00 177.57 177.89 2k53 h LEU 69 N -0.47 -0.76 0.00 2.57 3.38 -0.38 -3.52 115.31 116.13 2k53 h LEU 69 Ca -0.11 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2k53 h LEU 69 Cb 1.49 0.20 0.00 0.00 0.09 0.00 0.00 40.66 42.44 2k53 h LEU 69 CO 0.12 -0.37 0.00 -0.62 0.09 0.00 0.00 178.44 177.66