#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 3.55 0.20 0.03 2.47 -1.26 -4.94 119.74 119.78 2k53 s LYS 2 Ca 0.00 1.44 -0.32 0.00 -1.56 0.00 0.00 55.97 55.53 2k53 s LYS 2 Cb 0.00 -4.11 -0.11 0.00 -1.46 0.00 0.00 37.83 32.15 2k53 s LYS 2 CO 0.00 -1.60 1.64 0.42 0.16 0.00 0.00 175.35 175.98 2k53 s ILE 3 N 6.01 2.29 0.37 5.43 -1.09 -1.26 -5.02 121.20 127.93 2k53 s ILE 3 Ca 0.74 0.21 0.08 0.00 -2.23 0.00 0.00 60.65 59.45 2k53 s ILE 3 Cb -0.22 -3.14 -0.07 0.00 -1.58 0.00 0.00 42.46 37.45 2k53 s ILE 3 CO 0.32 0.02 -0.05 0.42 -1.23 0.00 0.00 174.94 174.42 2k53 s THR 4 N 1.05 2.11 -1.12 2.92 -4.23 -1.26 -4.89 115.64 110.22 2k53 s THR 4 Ca 0.72 -2.11 0.21 0.00 -1.18 0.00 0.00 61.69 59.32 2k53 s THR 4 Cb -0.47 -2.80 0.23 0.00 1.34 0.00 0.00 72.50 70.80 2k53 s THR 4 CO 0.33 -0.11 1.67 2.29 -0.54 0.00 0.00 174.62 178.26 2k53 n LYS 5 N -0.86 0.09 0.11 3.99 2.85 -1.26 -2.86 118.16 120.21 2k53 n LYS 5 Ca -0.05 0.13 0.02 0.00 -1.05 0.00 0.00 58.31 57.36 2k53 n LYS 5 Cb 0.65 -1.50 -0.00 0.00 -0.65 0.00 0.00 35.03 33.53 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 -4.24 -5.58 3.58 -1.96 0.51 116.42 108.74 2k53 h ASP 6 Ca 0.00 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.93 2k53 h ASP 6 Cb 0.31 0.00 0.14 0.00 1.72 0.00 0.00 39.33 41.50 2k53 h ASP 6 CO 0.00 0.49 0.34 -0.04 -2.88 0.00 0.00 179.24 177.15 2k53 s MET 7 N -2.97 2.18 0.07 0.28 -1.94 -1.13 -4.57 119.30 111.21 2k53 s MET 7 Ca 0.02 1.46 -0.28 0.00 -1.71 0.00 0.00 55.69 55.18 2k53 s MET 7 Cb 0.08 -1.87 -0.05 0.00 2.01 0.00 0.00 34.83 35.00 2k53 s MET 7 CO 0.76 -1.75 0.89 0.42 -0.01 0.00 0.00 175.02 175.34 2k53 s ILE 8 N -2.45 4.65 0.11 2.53 -1.09 -1.26 -0.82 121.20 122.87 2k53 s ILE 8 Ca 0.67 1.90 -0.22 0.00 -2.23 0.00 0.00 60.65 60.77 2k53 s ILE 8 Cb -0.22 -4.24 -0.09 0.00 -1.58 0.00 0.00 42.46 36.32 2k53 s ILE 8 CO 0.49 0.31 1.71 0.40 -1.23 0.00 0.00 174.94 176.62 2k53 h ILE 9 N 4.20 0.85 -0.82 2.92 2.04 -1.40 -2.08 117.51 123.22 2k53 h ILE 9 Ca -0.43 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.45 2k53 h ILE 9 Cb 1.21 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 38.10 2k53 h ILE 9 CO 0.72 0.00 0.54 0.00 0.00 0.00 0.00 178.15 179.41 2k53 h ALA 10 N 0.99 1.43 -0.59 1.87 0.00 -1.14 -1.99 119.26 119.83 2k53 h ALA 10 Ca 0.04 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.92 2k53 h ALA 10 Cb 0.12 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 2k53 h ALA 10 CO -0.10 0.52 0.38 0.22 0.00 0.00 0.00 179.25 180.27 2k53 h ASP 11 N 1.09 0.63 -0.77 0.00 3.58 -1.68 -0.92 116.42 118.36 2k53 h ASP 11 Ca 0.31 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.75 2k53 h ASP 11 Cb -0.09 -0.15 -0.04 0.00 1.72 0.00 0.00 39.33 40.77 2k53 h ASP 11 CO -0.07 0.45 0.49 0.58 -2.88 0.00 0.00 179.24 177.81 2k53 h VAL 12 N 0.76 1.21 -0.41 2.25 2.07 -0.91 -2.42 116.25 118.80 2k53 h VAL 12 Ca 0.23 -0.41 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 2k53 h VAL 12 Cb -0.04 0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.81 2k53 h VAL 12 CO -0.07 0.21 0.25 -0.07 0.02 0.00 0.00 177.57 177.90 2k53 h LEU 13 N 1.05 0.48 -1.46 2.57 3.38 -0.62 -1.29 115.31 119.41 2k53 h LEU 13 Ca 0.28 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.20 2k53 h LEU 13 Cb -0.08 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.54 2k53 h LEU 13 CO -0.06 0.37 -0.13 1.56 0.09 0.00 0.00 178.44 180.27 2k53 h GLN 14 N 0.56 0.00 0.10 1.13 4.20 -0.69 -2.58 115.11 117.82 2k53 h GLN 14 Ca 0.15 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.66 2k53 h GLN 14 Cb -0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 2k53 h GLN 14 CO -0.03 0.13 -0.98 0.52 -0.67 0.00 0.00 178.83 177.81 2k53 h MET 15 N 0.00 0.21 -2.02 1.46 2.86 -1.12 -3.46 114.93 112.86 2k53 h MET 15 Ca -0.00 -0.35 -0.12 0.00 -2.06 0.00 0.00 59.70 57.17 2k53 h MET 15 Cb 0.56 0.13 -0.29 0.00 0.06 0.00 0.00 31.60 32.07 2k53 h MET 15 CO 0.02 1.17 -0.43 0.34 1.06 0.00 0.00 176.91 179.06 2k53 s ASP 16 N -6.88 -0.01 0.11 1.22 -1.08 -0.72 -5.02 116.67 104.30 2k53 s ASP 16 Ca -0.18 0.49 0.15 0.00 -0.52 0.00 0.00 52.55 52.49 2k53 s ASP 16 Cb 0.02 1.25 0.66 0.00 -1.46 0.00 0.00 42.92 43.39 2k53 s ASP 16 CO 0.76 -0.28 1.45 0.54 0.52 0.00 0.00 175.17 178.17 2k53 n ARG 17 N 5.38 0.07 0.00 4.34 5.12 -0.98 -2.06 116.66 128.53 2k53 n ARG 17 Ca -0.05 0.41 0.07 0.00 -1.93 0.00 0.00 57.85 56.35 2k53 n ARG 17 Cb 0.50 -1.66 0.32 0.00 -1.16 0.00 0.00 32.46 30.46 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 -0.52 -0.98 0.15 -0.13 0.00 -1.26 -2.13 105.19 100.30 2k53 n GLY 18 Ca 0.02 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 2.61 1.35 -1.77 -3.36 112.91 111.74 2k53 h THR 19 Ca 0.00 -0.59 0.02 0.00 -0.55 0.00 0.00 66.41 65.29 2k53 h THR 19 Cb 0.24 1.57 -0.03 0.00 -1.73 0.00 0.00 68.15 68.20 2k53 h THR 19 CO 0.00 0.00 -0.14 0.00 -0.25 0.00 0.00 175.52 175.13 2k53 h ALA 20 N 2.34 -0.16 -0.96 6.62 0.00 -1.66 -1.27 119.26 124.18 2k53 h ALA 20 Ca 0.00 0.01 0.17 0.00 0.00 0.00 0.00 54.91 55.09 2k53 h ALA 20 Cb 0.76 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.71 2k53 h ALA 20 CO 0.00 -0.63 0.61 -1.35 0.00 0.00 0.00 179.25 177.88 2k53 h PRO 21 N -0.23 0.69 -0.29 0.00 0.11 -1.80 -0.25 132.00 130.22 2k53 h PRO 21 Ca 0.05 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 2k53 h PRO 21 Cb 0.29 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.23 2k53 h PRO 21 CO -0.13 0.46 0.13 0.82 -0.21 0.00 0.00 178.00 179.07 2k53 h ILE 22 N 0.71 1.16 -0.41 4.15 2.04 -1.55 0.24 117.51 123.86 2k53 h ILE 22 Ca 0.51 -0.47 0.02 0.00 1.00 0.00 0.00 64.86 65.92 2k53 h ILE 22 Cb 0.85 0.93 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 2k53 h ILE 22 CO -0.28 0.17 0.24 -0.26 0.00 0.00 0.00 178.15 178.02 2k53 h PHE 23 N 0.34 0.46 -0.79 1.37 0.04 -0.34 -2.37 116.94 115.64 2k53 h PHE 23 Ca 0.10 0.01 0.01 0.00 2.80 0.00 0.00 57.97 60.90 2k53 h PHE 23 Cb 0.14 -0.15 -0.04 0.00 2.20 0.00 0.00 35.95 38.10 2k53 h PHE 23 CO -0.01 0.27 0.52 0.82 -0.60 0.00 0.00 178.31 179.30 2k53 h ILE 24 N 0.49 1.19 -0.98 -0.55 2.04 -0.79 0.22 117.51 119.13 2k53 h ILE 24 Ca 0.16 -0.36 0.09 0.00 1.00 0.00 0.00 64.86 65.75 2k53 h ILE 24 Cb 0.01 0.04 -0.07 0.00 -0.74 0.00 0.00 36.82 36.05 2k53 h ILE 24 CO -0.07 0.19 0.62 -1.13 0.00 0.00 0.00 178.15 177.76 2k53 h ASN 25 N 1.06 0.96 0.14 1.72 -1.24 -0.02 -1.43 115.58 116.76 2k53 h ASN 25 Ca 0.29 0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.33 2k53 h ASN 25 Cb -0.10 -0.17 0.00 0.00 0.73 0.00 0.00 38.32 38.78 2k53 h ASN 25 CO -0.07 0.57 -0.09 0.59 -1.29 0.00 0.00 177.43 177.14 2k53 n ASN 26 N -4.57 0.98 0.00 1.15 3.02 -0.76 -4.92 115.26 110.16 2k53 n ASN 26 Ca 0.16 -1.08 0.00 0.00 -0.03 0.00 0.00 54.58 53.63 2k53 n ASN 26 Cb 0.25 0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 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 1.22 1.13 3.82 7.41 0.00 -0.54 -4.88 105.19 113.36 2k53 n GLY 27 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.65 3.39 -0.03 1.61 -1.94 -0.01 -4.96 119.30 116.70 2k53 s MET 28 Ca 0.00 1.04 -0.00 0.00 -1.71 0.00 0.00 55.69 55.02 2k53 s MET 28 Cb 0.00 -2.05 0.03 0.00 2.01 0.00 0.00 34.83 34.82 2k53 s MET 28 CO 0.00 -0.74 0.02 -3.38 -0.01 0.00 0.00 175.02 170.90 2k53 s HIS 29 N -2.72 0.22 -1.98 -0.03 -3.43 -1.26 -4.14 115.29 101.96 2k53 s HIS 29 Ca 0.60 0.06 0.18 0.00 -0.80 0.00 0.00 55.06 55.10 2k53 s HIS 29 Cb -0.14 -0.40 0.31 0.00 -1.43 0.00 0.00 32.58 30.92 2k53 s HIS 29 CO 0.42 -0.14 1.24 0.00 -2.00 0.00 0.00 174.74 174.26 2k53 s LEU 31 N -1.30 3.46 0.00 0.00 1.98 -1.26 -4.47 118.68 117.09 2k53 s LEU 31 Ca 0.29 0.63 0.00 0.00 -2.89 0.00 0.00 54.13 52.16 2k53 s LEU 31 Cb 0.17 -3.21 0.00 0.00 0.66 0.00 0.00 46.19 43.81 2k53 s LEU 31 CO 0.25 -1.72 0.00 0.61 -1.89 0.00 0.00 176.35 173.60 2k53 n GLY 32 N 5.30 2.13 3.62 7.98 0.00 -1.26 -4.90 105.19 118.05 2k53 n GLY 32 Ca 0.17 -0.14 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2k53 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k53 n PRO 34 N 6.22 0.36 0.11 0.00 -0.04 -1.26 -3.95 135.00 136.45 2k53 n PRO 34 Ca 0.05 0.07 -0.16 0.00 -0.04 0.00 0.00 63.50 63.42 2k53 n PRO 34 Cb 0.48 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.34 2k53 n PRO 34 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2k53 h SER 35 N 0.00 -1.54 -0.02 3.54 0.87 -1.93 -0.68 113.55 113.80 2k53 h SER 35 Ca 0.00 0.16 0.01 0.00 -1.23 0.00 0.00 61.79 60.73 2k53 h SER 35 Cb 0.17 0.56 -0.00 0.00 -0.44 0.00 0.00 62.40 62.69 2k53 h SER 35 CO 0.00 -0.54 0.33 -1.28 -0.53 0.00 0.00 176.83 174.80 2k53 h SER 36 N -0.74 0.00 0.06 6.23 0.87 -1.81 -1.07 113.55 117.09 2k53 h SER 36 Ca -0.01 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.37 2k53 h SER 36 Cb 0.74 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.69 2k53 h SER 36 CO -0.27 0.00 -0.94 0.24 -0.53 0.00 0.00 176.83 175.33 2k53 h MET 37 N 0.00 0.14 -0.89 2.24 2.86 -1.43 -3.38 114.93 114.46 2k53 h MET 37 Ca 0.01 -0.23 -0.05 0.00 -2.06 0.00 0.00 59.70 57.37 2k53 h MET 37 Cb 0.66 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.38 2k53 h MET 37 CO -0.00 1.11 0.06 0.41 1.06 0.00 0.00 176.91 179.55 2k53 n GLY 38 N 1.63 2.22 3.45 8.32 0.00 -0.40 -0.66 105.19 119.76 2k53 n GLY 38 Ca -0.21 -0.33 -0.22 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.48 1.66 0.46 1.61 -1.05 -1.12 -4.99 118.70 113.80 2k53 s GLU 39 Ca 0.19 -1.93 -0.22 0.00 -0.15 0.00 0.00 54.97 52.86 2k53 s GLU 39 Cb 0.15 -0.84 -0.08 0.00 -0.44 0.00 0.00 34.13 32.92 2k53 s GLU 39 CO 0.05 -0.20 1.10 -1.12 0.95 0.00 0.00 175.26 176.03 2k53 s SER 40 N -3.49 6.30 0.16 0.83 0.01 -1.26 -1.69 113.70 114.55 2k53 s SER 40 Ca 0.36 2.13 -0.21 0.00 1.31 0.00 0.00 55.95 59.54 2k53 s SER 40 Cb 0.08 -2.59 0.05 0.00 0.21 0.00 0.00 66.02 63.78 2k53 s SER 40 CO 0.15 -0.82 1.64 0.40 0.41 0.00 0.00 173.24 175.02 2k53 h ILE 41 N 1.78 0.44 -0.41 1.44 2.04 -0.97 -0.90 117.51 120.94 2k53 h ILE 41 Ca -0.49 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.34 2k53 h ILE 41 Cb 1.23 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 37.73 2k53 h ILE 41 CO 0.60 0.00 0.12 1.05 0.00 0.00 0.00 178.15 179.92 2k53 h GLU 42 N -0.18 0.59 0.18 2.37 4.11 -1.17 -1.09 114.58 119.39 2k53 h GLU 42 Ca 0.15 -0.09 -0.01 0.00 0.07 0.00 0.00 59.36 59.48 2k53 h GLU 42 Cb 0.42 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.57 2k53 h GLU 42 CO -0.40 0.53 -0.08 0.22 0.07 0.00 0.00 179.01 179.34 2k53 h ASP 43 N 0.58 -0.20 -0.92 3.06 3.58 -1.57 0.78 116.42 121.74 2k53 h ASP 43 Ca 0.14 -0.21 0.05 0.00 0.42 0.00 0.00 57.03 57.43 2k53 h ASP 43 Cb 0.19 0.05 -0.06 0.00 1.72 0.00 0.00 39.33 41.24 2k53 h ASP 43 CO -0.01 0.10 0.60 0.00 -2.88 0.00 0.00 179.24 177.06 2k53 h ALA 44 N 0.25 1.44 -0.04 -0.78 0.00 -1.10 -2.26 119.26 116.78 2k53 h ALA 44 Ca -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2k53 h ALA 44 Cb 0.39 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2k53 h ALA 44 CO 0.04 0.45 0.02 0.00 0.00 0.00 0.00 179.25 179.76 2k53 h ALA 46 N 1.00 1.75 0.16 0.00 0.00 -0.27 0.42 119.26 122.33 2k53 h ALA 46 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2k53 h ALA 46 Cb 0.00 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2k53 h ALA 46 CO -0.00 -0.29 -0.08 0.28 0.00 0.00 0.00 179.25 179.16 2k53 h VAL 47 N 0.00 0.95 -0.25 0.00 2.07 -1.14 -3.28 116.25 114.61 2k53 h VAL 47 Ca 0.08 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.08 2k53 h VAL 47 Cb 0.49 1.27 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 2k53 h VAL 47 CO -0.00 0.12 0.00 1.41 0.02 0.00 0.00 177.57 179.12 2k53 n HIS 48 N -5.07 0.30 -1.84 1.57 8.25 -0.78 -4.94 115.22 112.71 2k53 n HIS 48 Ca -0.09 -0.15 -0.06 0.00 -0.26 0.00 0.00 57.72 57.16 2k53 n HIS 48 Cb 0.20 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.30 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 1.42 0.34 3.79 -1.41 0.00 0.12 -5.02 105.19 104.43 2k53 n GLY 49 Ca 0.17 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.18 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 -2.28 3.62 -0.75 -0.61 1.01 0.50 -4.96 121.20 117.73 2k53 s ILE 50 Ca 0.00 0.98 -0.23 0.00 0.00 0.00 0.00 60.65 61.41 2k53 s ILE 50 Cb 0.00 -3.40 0.07 0.00 0.01 0.00 0.00 42.46 39.15 2k53 s ILE 50 CO 0.00 -0.24 1.08 -0.62 0.00 0.00 0.00 174.94 175.16 2k53 s ASP 51 N -1.99 6.28 0.40 3.58 -1.08 -1.26 -4.51 116.67 118.08 2k53 s ASP 51 Ca 0.68 -1.15 0.11 0.00 -0.52 0.00 0.00 52.55 51.67 2k53 s ASP 51 Cb -0.18 -2.45 0.82 0.00 -1.46 0.00 0.00 42.92 39.64 2k53 s ASP 51 CO 0.23 -1.44 1.91 0.00 0.52 0.00 0.00 175.17 176.40 2k53 h ALA 52 N 9.52 1.52 -0.75 3.66 0.00 -1.93 -2.92 119.26 128.36 2k53 h ALA 52 Ca -0.16 -0.22 -0.05 0.00 0.00 0.00 0.00 54.91 54.48 2k53 h ALA 52 Cb 1.05 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.74 2k53 h ALA 52 CO 1.20 0.34 0.27 0.22 0.00 0.00 0.00 179.25 181.29 2k53 h ASP 53 N 0.14 1.07 -0.22 0.00 3.58 -1.99 0.12 116.42 119.12 2k53 h ASP 53 Ca 0.03 -0.19 -0.01 0.00 0.42 0.00 0.00 57.03 57.28 2k53 h ASP 53 Cb 0.42 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.18 2k53 h ASP 53 CO 0.03 0.97 0.10 0.11 -2.88 0.00 0.00 179.24 177.57 2k53 h LYS 54 N 1.10 0.31 -0.23 0.28 1.57 -1.94 -2.18 116.57 115.48 2k53 h LYS 54 Ca 0.25 -0.05 0.02 0.00 -1.87 0.00 0.00 60.65 59.01 2k53 h LYS 54 Cb 0.26 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 2k53 h LYS 54 CO -0.01 0.32 0.08 1.25 -0.57 0.00 0.00 179.45 180.52 2k53 h LEU 55 N 0.22 0.08 -0.79 2.94 5.85 -1.29 -1.73 115.31 120.60 2k53 h LEU 55 Ca 0.07 0.02 0.06 0.00 0.84 0.00 0.00 57.88 58.88 2k53 h LEU 55 Cb 0.12 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 2k53 h LEU 55 CO -0.01 0.08 0.47 0.58 -0.34 0.00 0.00 178.44 179.22 2k53 h VAL 56 N 0.19 1.02 0.07 1.05 2.07 -0.73 0.03 116.25 119.95 2k53 h VAL 56 Ca 0.10 -0.30 0.02 0.00 0.82 0.00 0.00 66.70 67.34 2k53 h VAL 56 Cb 0.07 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.89 2k53 h VAL 56 CO -0.11 0.16 -0.18 0.11 0.02 0.00 0.00 177.57 177.57 2k53 h LYS 57 N 0.87 -0.32 -0.98 1.57 1.57 -0.96 -0.76 116.57 117.56 2k53 h LYS 57 Ca 0.34 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 59.25 2k53 h LYS 57 Cb 0.17 0.07 -0.08 0.00 0.08 0.00 0.00 32.23 32.47 2k53 h LYS 57 CO -0.17 -0.22 0.62 0.93 -0.57 0.00 0.00 179.45 180.04 2k53 h GLU 58 N -0.34 0.97 0.44 3.15 5.08 -0.75 -1.35 114.58 121.79 2k53 h GLU 58 Ca 0.03 -0.06 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 2k53 h GLU 58 Cb 0.37 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2k53 h GLU 58 CO -0.12 0.64 -0.21 -0.07 -1.00 0.00 0.00 179.01 178.25 2k53 h LEU 59 N 1.00 -0.50 -0.11 1.33 3.38 -0.58 -2.01 115.31 117.82 2k53 h LEU 59 Ca 0.48 -0.07 0.04 0.00 0.09 0.00 0.00 57.88 58.41 2k53 h LEU 59 Cb 0.42 0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 2k53 h LEU 59 CO -0.25 -0.21 -0.12 0.78 0.09 0.00 0.00 178.44 178.72 2k53 h ASN 60 N -0.79 -0.38 -0.03 -0.43 2.35 -0.91 -1.48 115.58 113.90 2k53 h ASN 60 Ca -0.06 0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.77 2k53 h ASN 60 Cb 0.55 0.19 -0.00 0.00 0.05 0.00 0.00 38.32 39.10 2k53 h ASN 60 CO 0.10 -0.17 0.03 -0.33 -1.65 0.00 0.00 177.43 175.41 2k53 h GLU 61 N -0.16 0.00 -0.11 0.81 5.08 -1.30 -1.61 114.58 117.28 2k53 h GLU 61 Ca 0.08 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2k53 h GLU 61 Cb 0.27 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2k53 h GLU 61 CO -0.20 0.00 -0.11 -0.92 -1.00 0.00 0.00 179.01 176.78 2k53 h TYR 62 N 0.00 0.33 -0.43 4.33 3.20 -0.52 -2.66 116.97 121.22 2k53 h TYR 62 Ca 0.02 -0.10 0.05 0.00 3.14 0.00 0.00 58.73 61.84 2k53 h TYR 62 Cb 0.08 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 2k53 h TYR 62 CO 0.00 0.68 0.29 0.74 -1.64 0.00 0.00 178.16 178.23 2k53 h PHE 63 N -0.12 0.37 -0.92 -3.82 0.04 -0.47 0.18 116.94 112.21 2k53 h PHE 63 Ca 0.02 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 2k53 h PHE 63 Cb 0.62 -0.12 -0.04 0.00 2.20 0.00 0.00 35.95 38.61 2k53 h PHE 63 CO 0.08 0.21 0.54 0.93 -0.60 0.00 0.00 178.31 179.47 2k53 h GLU 64 N 0.38 1.25 -0.37 1.51 5.08 -1.31 -2.90 114.58 118.21 2k53 h GLU 64 Ca 0.19 -0.12 -0.04 0.00 -1.00 0.00 0.00 59.36 58.39 2k53 h GLU 64 Cb 0.26 -0.26 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 2k53 h GLU 64 CO -0.04 0.88 0.06 0.87 -1.00 0.00 0.00 179.01 179.78 2k53 h LYS 65 N 1.27 0.55 -0.18 2.33 1.79 -0.29 -3.24 116.57 118.80 2k53 h LYS 65 Ca 0.33 -0.10 0.03 0.00 -2.18 0.00 0.00 60.65 58.73 2k53 h LYS 65 Cb -0.04 -0.09 -0.05 0.00 -1.58 0.00 0.00 32.23 30.47 2k53 h LYS 65 CO -0.06 0.53 -0.43 0.87 -1.08 0.00 0.00 179.45 179.29 2k53 h LYS 66 N 0.54 -0.39 0.00 3.15 1.57 -1.17 0.97 116.57 121.24 2k53 h LYS 66 Ca 0.12 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2k53 h LYS 66 Cb 0.25 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.65 2k53 h LYS 66 CO 0.00 -0.26 0.00 0.39 -0.57 0.00 0.00 179.45 179.01 2k53 n GLU 67 N -4.77 0.07 -0.08 3.15 1.02 -1.22 -0.22 120.64 118.59 2k53 n GLU 67 Ca -0.04 0.40 -0.12 0.00 -0.02 0.00 0.00 57.16 57.38 2k53 n GLU 67 Cb 0.28 -1.65 -0.07 0.00 -0.02 0.00 0.00 31.44 29.98 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 0.68 0.15 2.62 2.07 -1.28 -3.41 116.25 117.08 2k53 h VAL 68 Ca 0.00 -1.69 -0.01 0.00 0.82 0.00 0.00 66.70 65.82 2k53 h VAL 68 Cb 0.18 1.46 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2k53 h VAL 68 CO 0.00 0.23 -0.07 -0.07 0.02 0.00 0.00 177.57 177.68 2k53 h LEU 69 N -1.00 -0.18 0.00 2.57 3.38 -0.59 -3.52 115.31 115.97 2k53 h LEU 69 Ca -0.13 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.49 2k53 h LEU 69 Cb 0.82 0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.61 2k53 h LEU 69 CO -0.08 0.32 0.00 -0.62 0.09 0.00 0.00 178.44 178.15