#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 4.19 0.29 0.03 -0.14 -1.26 -5.02 119.74 117.84 2k53 s LYS 2 Ca 0.00 0.07 -0.29 0.00 -1.36 0.00 0.00 55.97 54.39 2k53 s LYS 2 Cb 0.00 -3.49 -0.10 0.00 -1.68 0.00 0.00 37.83 32.56 2k53 s LYS 2 CO 0.00 0.10 1.21 0.42 -0.76 0.00 0.00 175.35 176.31 2k53 s ILE 3 N 0.90 3.13 0.15 2.17 -1.09 -1.26 -5.05 121.20 120.16 2k53 s ILE 3 Ca 0.16 1.12 0.10 0.00 -2.23 0.00 0.00 60.65 59.80 2k53 s ILE 3 Cb -0.14 -3.71 -0.04 0.00 -1.58 0.00 0.00 42.46 36.99 2k53 s ILE 3 CO 0.05 0.26 -0.22 0.42 -1.23 0.00 0.00 174.94 174.23 2k53 s THR 4 N -1.03 2.00 -0.18 2.92 -4.23 -1.26 -4.89 115.64 108.96 2k53 s THR 4 Ca 0.47 -1.85 0.25 0.00 -1.18 0.00 0.00 61.69 59.39 2k53 s THR 4 Cb -0.36 -1.88 0.26 0.00 1.34 0.00 0.00 72.50 71.86 2k53 s THR 4 CO 0.46 -0.15 1.76 0.07 -0.54 0.00 0.00 174.62 176.22 2k53 h LYS 5 N 3.50 0.00 0.00 3.99 2.10 -1.97 -1.13 116.57 123.05 2k53 h LYS 5 Ca -0.45 0.00 -0.13 0.00 -2.00 0.00 0.00 60.65 58.07 2k53 h LYS 5 Cb 1.20 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.51 2k53 h LYS 5 CO 0.46 0.00 -0.61 0.22 -2.00 0.00 0.00 179.45 177.52 2k53 h ASP 6 N 0.00 0.00 -4.11 7.07 3.58 -1.96 -1.30 116.42 119.69 2k53 h ASP 6 Ca 0.00 0.00 -0.54 0.00 0.42 0.00 0.00 57.03 56.91 2k53 h ASP 6 Cb 0.13 0.00 0.13 0.00 1.72 0.00 0.00 39.33 41.31 2k53 h ASP 6 CO 0.00 0.61 0.48 -0.04 -2.88 0.00 0.00 179.24 177.41 2k53 s MET 7 N -3.60 2.76 0.16 0.28 -1.94 -0.43 -4.54 119.30 112.00 2k53 s MET 7 Ca -0.01 1.88 -0.30 0.00 -1.71 0.00 0.00 55.69 55.55 2k53 s MET 7 Cb 0.13 -1.90 -0.07 0.00 2.01 0.00 0.00 34.83 35.00 2k53 s MET 7 CO 0.76 -1.38 1.01 0.42 -0.01 0.00 0.00 175.02 175.81 2k53 s ILE 8 N -1.59 4.19 0.16 2.53 -1.09 -1.26 -0.97 121.20 123.17 2k53 s ILE 8 Ca 0.78 1.91 -0.16 0.00 -2.23 0.00 0.00 60.65 60.95 2k53 s ILE 8 Cb -0.32 -4.22 0.05 0.00 -1.58 0.00 0.00 42.46 36.39 2k53 s ILE 8 CO 0.36 0.34 1.71 0.40 -1.23 0.00 0.00 174.94 176.52 2k53 h ILE 9 N 3.76 0.75 -0.37 2.92 2.04 -1.57 -0.75 117.51 124.28 2k53 h ILE 9 Ca -0.44 -0.04 0.01 0.00 1.00 0.00 0.00 64.86 65.39 2k53 h ILE 9 Cb 1.21 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 2k53 h ILE 9 CO 0.71 0.02 0.25 0.00 0.00 0.00 0.00 178.15 179.13 2k53 h ALA 10 N 1.31 1.77 -0.46 1.87 0.00 -1.45 -2.37 119.26 119.93 2k53 h ALA 10 Ca 0.18 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 2k53 h ALA 10 Cb 0.24 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2k53 h ALA 10 CO -0.28 0.20 -0.09 0.22 0.00 0.00 0.00 179.25 179.30 2k53 h ASP 11 N 0.47 0.87 -0.91 0.00 3.58 -1.42 -2.36 116.42 116.65 2k53 h ASP 11 Ca 0.14 -0.35 0.00 0.00 0.42 0.00 0.00 57.03 57.24 2k53 h ASP 11 Cb -0.01 -0.24 -0.04 0.00 1.72 0.00 0.00 39.33 40.76 2k53 h ASP 11 CO -0.03 1.02 0.57 0.58 -2.88 0.00 0.00 179.24 178.50 2k53 h VAL 12 N 0.71 1.24 -0.09 2.25 2.07 -0.86 -1.59 116.25 119.98 2k53 h VAL 12 Ca 0.12 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 2k53 h VAL 12 Cb 0.62 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2k53 h VAL 12 CO 0.04 0.24 -0.06 -0.07 0.02 0.00 0.00 177.57 177.75 2k53 h LEU 13 N 1.24 0.11 -1.46 2.57 3.38 -1.18 -1.61 115.31 118.37 2k53 h LEU 13 Ca 0.33 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.23 2k53 h LEU 13 Cb -0.10 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 2k53 h LEU 13 CO -0.07 0.19 -0.26 1.56 0.09 0.00 0.00 178.44 179.96 2k53 h GLN 14 N 0.12 0.00 -0.01 1.13 1.08 -0.76 -2.95 115.11 113.73 2k53 h GLN 14 Ca 0.03 0.00 -0.04 0.00 -1.45 0.00 0.00 58.65 57.19 2k53 h GLN 14 Cb 0.19 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.62 2k53 h GLN 14 CO 0.01 0.26 -0.15 0.52 -0.95 0.00 0.00 178.83 178.51 2k53 h MET 15 N 0.00 0.12 -2.39 1.46 2.86 -1.14 -3.47 114.93 112.37 2k53 h MET 15 Ca -0.00 -0.12 -0.07 0.00 -2.06 0.00 0.00 59.70 57.45 2k53 h MET 15 Cb 0.56 0.03 -0.24 0.00 0.06 0.00 0.00 31.60 32.02 2k53 h MET 15 CO 0.03 0.84 -0.15 0.34 1.06 0.00 0.00 176.91 179.04 2k53 s ASP 16 N -6.17 -0.66 0.35 1.22 -1.08 -0.92 -5.05 116.67 104.37 2k53 s ASP 16 Ca -0.16 1.13 0.15 0.00 -0.52 0.00 0.00 52.55 53.15 2k53 s ASP 16 Cb 0.01 1.04 0.66 0.00 -1.46 0.00 0.00 42.92 43.17 2k53 s ASP 16 CO 0.72 -0.21 1.75 0.03 0.52 0.00 0.00 175.17 177.99 2k53 h ARG 17 N 6.62 0.00 0.00 4.34 2.47 -1.84 -3.04 114.38 122.93 2k53 h ARG 17 Ca -0.32 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.40 2k53 h ARG 17 Cb 1.19 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.51 2k53 h ARG 17 CO 0.22 0.43 0.00 0.41 0.56 0.00 0.00 179.97 181.59 2k53 n GLY 18 N -0.06 -0.50 0.18 0.04 0.00 -1.26 -2.00 105.19 101.58 2k53 n GLY 18 Ca -0.01 -0.08 0.12 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 -0.18 2.61 1.35 -1.88 -3.37 112.91 111.44 2k53 h THR 19 Ca 0.00 -0.92 0.05 0.00 -0.55 0.00 0.00 66.41 64.98 2k53 h THR 19 Cb 0.00 1.79 -0.05 0.00 -1.73 0.00 0.00 68.15 68.16 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 2.08 -0.00 -0.30 6.62 0.00 -1.65 -1.54 119.26 124.47 2k53 h ALA 20 Ca 0.00 0.07 0.06 0.00 0.00 0.00 0.00 54.91 55.04 2k53 h ALA 20 Cb 0.96 0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 2k53 h ALA 20 CO 0.00 -0.57 0.21 -1.00 0.00 0.00 0.00 179.25 177.89 2k53 h PRO 21 N -0.14 0.12 -0.21 0.00 0.13 -1.82 -0.60 132.00 129.48 2k53 h PRO 21 Ca 0.11 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 65.20 2k53 h PRO 21 Cb 0.30 -0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.39 2k53 h PRO 21 CO -0.26 0.08 0.01 0.82 -0.23 0.00 0.00 178.00 178.42 2k53 h ILE 22 N 0.13 1.25 -0.40 -3.56 2.04 -1.51 0.28 117.51 115.73 2k53 h ILE 22 Ca 0.14 -0.85 0.04 0.00 1.00 0.00 0.00 64.86 65.18 2k53 h ILE 22 Cb 0.38 1.39 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 2k53 h ILE 22 CO -0.02 0.26 0.19 -0.26 0.00 0.00 0.00 178.15 178.32 2k53 h PHE 23 N 0.14 0.34 -0.74 1.37 0.04 -0.74 -2.34 116.94 115.01 2k53 h PHE 23 Ca 0.06 0.02 0.05 0.00 2.80 0.00 0.00 57.97 60.90 2k53 h PHE 23 Cb 0.38 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.39 2k53 h PHE 23 CO 0.03 0.17 0.49 0.82 -0.60 0.00 0.00 178.31 179.21 2k53 h ILE 24 N 0.38 1.06 -0.27 -0.55 2.04 -0.86 -0.54 117.51 118.77 2k53 h ILE 24 Ca 0.18 -0.28 -0.02 0.00 1.00 0.00 0.00 64.86 65.74 2k53 h ILE 24 Cb 0.11 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.33 2k53 h ILE 24 CO -0.14 0.15 0.08 -1.13 0.00 0.00 0.00 178.15 177.11 2k53 h ASN 25 N 0.82 0.34 -0.10 1.72 -1.24 0.11 -2.12 115.58 115.12 2k53 h ASN 25 Ca 0.31 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.29 2k53 h ASN 25 Cb 0.17 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 39.14 2k53 h ASN 25 CO -0.10 0.33 0.00 0.59 -1.29 0.00 0.00 177.43 176.96 2k53 n ASN 26 N -4.40 2.31 0.00 1.15 3.02 -0.80 -4.93 115.26 111.60 2k53 n ASN 26 Ca 0.01 -1.77 0.00 0.00 -0.03 0.00 0.00 54.58 52.79 2k53 n ASN 26 Cb 0.15 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 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 1.27 1.33 3.89 7.41 0.00 -0.79 -4.85 105.19 113.45 2k53 n GLY 27 Ca 0.17 0.00 -0.29 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 -0.35 3.67 -0.33 1.61 -1.94 -0.28 -4.97 119.30 116.71 2k53 s MET 28 Ca 0.00 0.33 -0.01 0.00 -1.71 0.00 0.00 55.69 54.30 2k53 s MET 28 Cb 0.00 -2.40 0.13 0.00 2.01 0.00 0.00 34.83 34.57 2k53 s MET 28 CO 0.00 -0.10 0.18 -1.01 -0.01 0.00 0.00 175.02 174.09 2k53 s HIS 29 N -2.51 0.61 -1.04 -0.03 3.76 -1.26 -3.86 115.29 110.95 2k53 s HIS 29 Ca 0.49 -1.39 -0.06 0.00 -0.15 0.00 0.00 55.06 53.96 2k53 s HIS 29 Cb -0.10 -0.92 0.06 0.00 1.11 0.00 0.00 32.58 32.72 2k53 s HIS 29 CO 0.37 -0.83 2.63 0.00 -0.85 0.00 0.00 174.74 176.06 2k53 n LEU 31 N 1.74 5.41 0.00 0.00 7.99 -1.26 -4.65 117.00 126.24 2k53 n LEU 31 Ca 0.59 -2.68 0.00 0.00 -0.01 0.00 0.00 56.01 53.91 2k53 n LEU 31 Cb 0.37 -0.93 0.00 0.00 -0.11 0.00 0.00 43.42 42.75 2k53 n LEU 31 CO 0.57 0.99 0.00 0.61 -1.51 0.00 0.00 177.39 178.05 2k53 n GLY 32 N 0.55 0.57 3.65 -0.72 0.00 -1.26 -5.03 105.19 102.96 2k53 n GLY 32 Ca 0.18 -0.14 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 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 9.15 -0.21 -0.77 0.00 0.11 -1.96 -1.59 132.00 136.73 2k53 h PRO 34 Ca -0.33 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2k53 h PRO 34 Cb 1.14 0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.26 2k53 h PRO 34 CO 0.97 -0.14 0.49 0.77 -0.21 0.00 0.00 178.00 179.88 2k53 h SER 35 N -0.21 0.91 0.49 -2.05 0.02 -1.97 -0.16 113.55 110.58 2k53 h SER 35 Ca 0.19 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2k53 h SER 35 Cb 0.53 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.84 2k53 h SER 35 CO -0.58 0.68 0.00 -0.24 -1.14 0.00 0.00 176.83 175.56 2k53 n SER 36 N -4.52 0.00 -0.02 3.07 2.88 -0.68 -3.05 113.62 111.31 2k53 n SER 36 Ca 0.07 0.39 -0.02 0.00 -1.33 0.00 0.00 58.87 57.99 2k53 n SER 36 Cb 0.04 -0.45 -0.01 0.00 -0.75 0.00 0.00 64.21 63.04 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 -1.45 0.11 -0.03 -1.46 2.81 -0.51 -4.49 117.12 112.10 2k53 n MET 37 Ca 0.05 0.04 0.11 0.00 -1.81 0.00 0.00 57.70 56.09 2k53 n MET 37 Cb 0.17 -0.60 0.55 0.00 -0.71 0.00 0.00 33.22 32.63 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 1.98 -0.45 3.70 3.03 0.00 -0.19 -1.36 105.19 111.90 2k53 n GLY 38 Ca -0.03 -0.27 -0.25 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.93 2.53 0.72 1.61 2.02 -1.17 -4.93 118.70 117.55 2k53 s GLU 39 Ca 0.33 -1.12 -0.14 0.00 0.02 0.00 0.00 54.97 54.07 2k53 s GLU 39 Cb 0.17 -2.39 0.03 0.00 0.10 0.00 0.00 34.13 32.03 2k53 s GLU 39 CO 0.27 0.44 1.13 -1.12 0.02 0.00 0.00 175.26 175.99 2k53 s SER 40 N -3.22 4.62 0.08 -0.19 0.01 -1.26 -2.65 113.70 111.09 2k53 s SER 40 Ca 0.29 2.05 -0.35 0.00 1.31 0.00 0.00 55.95 59.25 2k53 s SER 40 Cb -0.09 -2.55 -0.17 0.00 0.21 0.00 0.00 66.02 63.42 2k53 s SER 40 CO 0.20 -1.96 1.55 0.40 0.41 0.00 0.00 173.24 173.84 2k53 h ILE 41 N -0.42 0.00 -0.53 1.44 2.04 -0.93 0.17 117.51 119.28 2k53 h ILE 41 Ca -0.46 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.38 2k53 h ILE 41 Cb 1.26 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 2k53 h ILE 41 CO 0.52 0.00 0.24 1.05 0.00 0.00 0.00 178.15 179.95 2k53 h GLU 42 N -1.01 0.75 -0.10 2.37 4.11 -1.53 0.41 114.58 119.58 2k53 h GLU 42 Ca -0.06 -0.10 -0.01 0.00 0.07 0.00 0.00 59.36 59.25 2k53 h GLU 42 Cb 0.87 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.98 2k53 h GLU 42 CO -0.05 0.60 0.01 0.22 0.07 0.00 0.00 179.01 179.86 2k53 h ASP 43 N 0.75 0.17 -0.22 3.06 3.58 -1.76 -2.21 116.42 119.78 2k53 h ASP 43 Ca 0.18 -0.27 -0.04 0.00 0.42 0.00 0.00 57.03 57.32 2k53 h ASP 43 Cb 0.11 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 41.10 2k53 h ASP 43 CO -0.02 0.40 0.02 0.00 -2.88 0.00 0.00 179.24 176.76 2k53 h ALA 44 N 0.78 1.43 -0.57 -0.78 0.00 -0.65 -2.67 119.26 116.79 2k53 h ALA 44 Ca 0.03 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.79 2k53 h ALA 44 Cb 0.30 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2k53 h ALA 44 CO 0.00 0.41 0.35 0.00 0.00 0.00 0.00 179.25 180.01 2k53 h ALA 46 N 1.25 2.06 -0.87 0.00 0.00 -1.04 0.29 119.26 120.95 2k53 h ALA 46 Ca 0.23 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.23 2k53 h ALA 46 Cb 0.01 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 17.66 2k53 h ALA 46 CO -0.09 -0.26 0.52 0.28 0.00 0.00 0.00 179.25 179.70 2k53 h VAL 47 N 0.45 0.95 -0.24 0.00 2.07 -1.44 -2.37 116.25 115.67 2k53 h VAL 47 Ca 0.37 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.58 2k53 h VAL 47 Cb 0.78 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.54 2k53 h VAL 47 CO -0.12 0.16 0.00 1.41 0.02 0.00 0.00 177.57 179.04 2k53 n HIS 48 N -4.68 0.69 -1.80 1.57 8.25 -0.72 -4.97 115.22 113.56 2k53 n HIS 48 Ca 0.14 -0.78 -0.19 0.00 -0.26 0.00 0.00 57.72 56.63 2k53 n HIS 48 Cb 0.26 -0.22 -0.06 0.00 1.12 0.00 0.00 29.99 31.09 2k53 n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2k53 n GLY 49 N -0.36 1.14 3.78 -1.41 0.00 0.42 -4.97 105.19 103.80 2k53 n GLY 49 Ca 0.17 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.78 3.33 -0.50 -0.61 1.01 0.74 -4.94 121.20 117.46 2k53 s ILE 50 Ca 0.00 0.82 -0.25 0.00 0.00 0.00 0.00 60.65 61.22 2k53 s ILE 50 Cb 0.00 -3.33 0.03 0.00 0.01 0.00 0.00 42.46 39.18 2k53 s ILE 50 CO 0.00 -0.19 0.93 -0.62 0.00 0.00 0.00 174.94 175.06 2k53 s ASP 51 N -1.87 6.43 0.36 3.58 -1.08 -1.26 -4.48 116.67 118.35 2k53 s ASP 51 Ca 0.71 -0.07 0.19 0.00 -0.52 0.00 0.00 52.55 52.86 2k53 s ASP 51 Cb -0.22 -2.44 0.50 0.00 -1.46 0.00 0.00 42.92 39.30 2k53 s ASP 51 CO 0.26 -1.12 1.65 0.00 0.52 0.00 0.00 175.17 176.47 2k53 h ALA 52 N 9.18 0.88 -0.20 3.66 0.00 -1.92 -2.97 119.26 127.89 2k53 h ALA 52 Ca -0.25 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.31 2k53 h ALA 52 Cb 1.07 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2k53 h ALA 52 CO 1.05 0.48 0.12 0.22 0.00 0.00 0.00 179.25 181.12 2k53 h ASP 53 N 0.00 0.25 -0.18 0.00 3.58 -2.00 -0.31 116.42 117.76 2k53 h ASP 53 Ca -0.00 -0.05 -0.21 0.00 0.42 0.00 0.00 57.03 57.18 2k53 h ASP 53 Cb 1.05 -0.06 0.01 0.00 1.72 0.00 0.00 39.33 42.04 2k53 h ASP 53 CO 0.05 0.22 -0.71 0.11 -2.88 0.00 0.00 179.24 176.04 2k53 h LYS 54 N 0.25 0.81 -0.12 0.28 1.57 -1.99 -2.55 116.57 114.82 2k53 h LYS 54 Ca 0.07 -0.61 0.03 0.00 -1.87 0.00 0.00 60.65 58.27 2k53 h LYS 54 Cb 0.02 0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2k53 h LYS 54 CO -0.01 1.23 -0.06 1.25 -0.57 0.00 0.00 179.45 181.29 2k53 h LEU 55 N 0.58 -0.20 -1.16 2.94 5.85 -1.40 -1.60 115.31 120.33 2k53 h LEU 55 Ca -0.03 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.76 2k53 h LEU 55 Cb 1.33 0.11 -0.05 0.00 0.37 0.00 0.00 40.66 42.42 2k53 h LEU 55 CO 0.15 -0.08 0.57 0.58 -0.34 0.00 0.00 178.44 179.32 2k53 h VAL 56 N -0.05 1.18 -0.07 1.05 2.07 -1.07 -1.71 116.25 117.64 2k53 h VAL 56 Ca 0.07 -0.39 0.02 0.00 0.82 0.00 0.00 66.70 67.22 2k53 h VAL 56 Cb 0.15 -0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.86 2k53 h VAL 56 CO -0.15 0.20 -0.05 0.11 0.02 0.00 0.00 177.57 177.71 2k53 h LYS 57 N 1.12 -0.04 -0.87 1.57 1.57 -0.98 -0.23 116.57 118.70 2k53 h LYS 57 Ca 0.33 0.00 0.04 0.00 -1.87 0.00 0.00 60.65 59.16 2k53 h LYS 57 Cb -0.04 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.23 2k53 h LYS 57 CO -0.09 -0.03 0.57 0.93 -0.57 0.00 0.00 179.45 180.26 2k53 h GLU 58 N -0.05 1.04 0.09 3.15 5.08 -0.85 -0.82 114.58 122.23 2k53 h GLU 58 Ca 0.05 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.34 2k53 h GLU 58 Cb 0.11 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.13 2k53 h GLU 58 CO -0.10 0.69 -0.04 -0.07 -1.00 0.00 0.00 179.01 178.48 2k53 h LEU 59 N 1.07 -0.10 0.51 1.33 3.38 -0.88 -2.48 115.31 118.14 2k53 h LEU 59 Ca 0.35 -0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.23 2k53 h LEU 59 Cb 0.06 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 2k53 h LEU 59 CO -0.11 0.00 -0.29 0.78 0.09 0.00 0.00 178.44 178.91 2k53 h ASN 60 N -0.20 -0.72 -0.91 -0.43 2.35 -0.61 -2.78 115.58 112.27 2k53 h ASN 60 Ca -0.01 0.04 0.17 0.00 -0.55 0.00 0.00 56.30 55.95 2k53 h ASN 60 Cb 0.17 0.21 -0.07 0.00 0.05 0.00 0.00 38.32 38.67 2k53 h ASN 60 CO 0.02 -0.47 0.59 -0.33 -1.65 0.00 0.00 177.43 175.59 2k53 h GLU 61 N -0.75 0.58 0.07 0.81 5.08 -1.22 -0.92 114.58 118.22 2k53 h GLU 61 Ca -0.06 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2k53 h GLU 61 Cb 0.60 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 2k53 h GLU 61 CO 0.08 0.38 -0.10 -0.92 -1.00 0.00 0.00 179.01 177.45 2k53 h TYR 62 N 0.60 -0.26 -0.43 4.33 3.20 -1.19 0.12 116.97 123.33 2k53 h TYR 62 Ca 0.48 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.33 2k53 h TYR 62 Cb 0.92 0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 2k53 h TYR 62 CO -0.00 -0.16 0.18 0.74 -1.64 0.00 0.00 178.16 177.28 2k53 h PHE 63 N -0.21 0.59 -0.44 -3.82 0.04 -0.96 -1.22 116.94 110.92 2k53 h PHE 63 Ca 0.02 -0.02 -0.08 0.00 2.80 0.00 0.00 57.97 60.68 2k53 h PHE 63 Cb 0.22 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 38.16 2k53 h PHE 63 CO -0.13 0.46 -0.07 0.93 -0.60 0.00 0.00 178.31 178.89 2k53 h GLU 64 N 0.60 0.77 -0.60 1.51 5.08 -0.80 -2.64 114.58 118.49 2k53 h GLU 64 Ca 0.15 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.23 2k53 h GLU 64 Cb 0.10 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.25 2k53 h GLU 64 CO -0.02 0.82 0.19 0.87 -1.00 0.00 0.00 179.01 179.88 2k53 h LYS 65 N 0.70 0.90 -0.68 2.33 1.79 0.26 -2.68 116.57 119.20 2k53 h LYS 65 Ca 0.13 -0.17 0.07 0.00 -2.18 0.00 0.00 60.65 58.50 2k53 h LYS 65 Cb 0.54 -0.14 -0.06 0.00 -1.58 0.00 0.00 32.23 30.98 2k53 h LYS 65 CO 0.03 0.77 0.36 0.87 -1.08 0.00 0.00 179.45 180.41 2k53 h LYS 66 N 0.88 0.64 -0.20 3.15 1.57 -0.91 0.15 116.57 121.85 2k53 h LYS 66 Ca 0.20 -0.04 0.06 0.00 -1.87 0.00 0.00 60.65 59.00 2k53 h LYS 66 Cb 0.24 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 2k53 h LYS 66 CO -0.01 0.42 0.16 0.93 -0.57 0.00 0.00 179.45 180.38 2k53 h GLU 67 N 0.66 0.00 0.00 3.15 5.08 -1.27 0.15 114.58 122.35 2k53 h GLU 67 Ca 0.31 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.58 2k53 h GLU 67 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2k53 h GLU 67 CO -0.21 0.00 -0.58 0.28 -1.00 0.00 0.00 179.01 177.50 2k53 h VAL 68 N 0.00 0.96 0.37 3.13 2.07 -1.17 -3.40 116.25 118.21 2k53 h VAL 68 Ca 0.10 -1.92 -0.02 0.00 0.82 0.00 0.00 66.70 65.68 2k53 h VAL 68 Cb 0.41 2.02 0.00 0.00 -1.52 0.00 0.00 31.29 32.20 2k53 h VAL 68 CO -0.00 0.33 -0.18 -0.07 0.02 0.00 0.00 177.57 177.67 2k53 h LEU 69 N -1.00 -0.42 -1.71 2.57 3.38 -0.57 -3.52 115.31 114.04 2k53 h LEU 69 Ca -0.14 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2k53 h LEU 69 Cb 0.93 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2k53 h LEU 69 CO -0.09 -0.13 0.00 -0.62 0.09 0.00 0.00 178.44 177.69