#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tbc n ASP 2 N 0.00 -4.19 0.00 1.45 2.03 -1.21 -4.96 116.55 109.66 1tbc n ASP 2 Ca 0.00 -1.10 0.00 0.00 0.52 0.00 0.00 54.79 54.21 1tbc n ASP 2 Cb 0.00 -2.85 0.00 0.00 -0.72 0.00 0.00 41.12 37.55 1tbc n ASP 2 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1tbc n PRO 3 N -4.46 0.00 0.07 -0.67 -0.04 -1.26 -4.74 135.00 123.91 1tbc n PRO 3 Ca -0.13 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.22 1tbc n PRO 3 Cb 0.60 -0.08 -0.08 0.00 -0.04 0.00 0.00 33.50 33.91 1tbc n PRO 3 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1tbc h VAL 4 N 0.00 0.83 0.00 0.52 2.07 -1.93 -3.47 116.25 114.27 1tbc h VAL 4 Ca 0.00 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1tbc h VAL 4 Cb 0.00 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 31.14 1tbc h VAL 4 CO 0.00 0.20 0.00 0.47 0.02 0.00 0.00 177.57 178.26 1tbc n ASP 5 N -4.95 0.00 -1.96 0.57 8.00 -1.26 -5.13 116.55 111.82 1tbc n ASP 5 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.42 1tbc n ASP 5 Cb 0.26 0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 1tbc n ASP 5 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1tbc n PRO 6 N -1.89 0.78 0.08 -0.24 -0.04 -1.26 -4.11 135.00 128.31 1tbc n PRO 6 Ca 0.00 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.36 1tbc n PRO 6 Cb 0.00 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.39 1tbc n PRO 6 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1tbc h ASN 7 N 0.00 -0.24 0.00 3.54 2.35 -1.68 -3.35 115.58 116.20 1tbc h ASN 7 Ca 0.00 -0.26 0.00 0.00 -0.55 0.00 0.00 56.30 55.49 1tbc h ASN 7 Cb 0.00 0.06 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1tbc h ASN 7 CO 0.00 0.28 -0.30 2.30 -1.65 0.00 0.00 177.43 178.06 1tbc n ILE 8 N -4.97 0.46 -3.46 2.81 -0.00 -1.26 -4.85 119.36 108.09 1tbc n ILE 8 Ca -0.07 -0.55 -0.23 0.00 -0.00 0.00 0.00 62.75 61.90 1tbc n ILE 8 Cb 0.25 0.41 0.06 0.00 -0.00 0.00 0.00 39.64 40.35 1tbc n ILE 8 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 1tbc n GLU 9 N -0.34 -1.73 -0.92 6.28 1.02 -1.26 -4.86 120.64 118.83 1tbc n GLU 9 Ca 0.03 0.67 -0.14 0.00 -0.02 0.00 0.00 57.16 57.71 1tbc n GLU 9 Cb 0.64 -4.99 -0.01 0.00 -0.02 0.00 0.00 31.44 27.05 1tbc n GLU 9 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1tbc n PRO 10 N -3.69 1.74 -1.09 3.49 -0.04 -1.26 -4.38 135.00 129.76 1tbc n PRO 10 Ca -0.08 -1.25 -0.13 0.00 -0.04 0.00 0.00 63.50 62.01 1tbc n PRO 10 Cb 0.60 -1.61 0.25 0.00 -0.04 0.00 0.00 33.50 32.71 1tbc n PRO 10 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1tbc n TRP 11 N 1.00 2.64 -4.20 0.54 7.02 -1.26 -4.62 117.44 118.56 1tbc n TRP 11 Ca 0.28 -1.46 -0.13 0.00 -1.02 0.00 0.00 57.50 55.16 1tbc n TRP 11 Cb 0.60 -0.78 -0.09 0.00 -2.42 0.00 0.00 31.31 28.61 1tbc n TRP 11 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1tbc s ASN 12 N -1.21 0.31 0.13 -0.99 2.20 -1.19 -2.75 114.94 111.44 1tbc s ASN 12 Ca 0.55 -1.41 0.02 0.00 -0.94 0.00 0.00 52.86 51.09 1tbc s ASN 12 Cb 0.45 0.41 -0.04 0.00 -2.00 0.00 0.00 41.25 40.08 1tbc s ASN 12 CO 0.12 -0.89 -0.03 -1.00 -2.94 0.00 0.00 177.10 172.36 1tbc s HIS 13 N -4.06 1.01 -0.22 1.54 3.76 -1.26 -4.98 115.29 111.08 1tbc s HIS 13 Ca 0.38 -0.97 0.20 0.00 -0.15 0.00 0.00 55.06 54.52 1tbc s HIS 13 Cb 0.06 -0.58 0.33 0.00 1.11 0.00 0.00 32.58 33.50 1tbc s HIS 13 CO 0.14 -0.19 1.58 -1.00 -0.85 0.00 0.00 174.74 174.41 1tbc h PRO 14 N 2.86 0.00 -0.53 8.40 0.13 -1.97 -3.48 132.00 137.41 1tbc h PRO 14 Ca -0.36 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.72 1tbc h PRO 14 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1tbc h PRO 14 CO 0.64 0.26 -0.07 0.41 -0.23 0.00 0.00 178.00 179.00 1tbc n GLY 15 N 1.00 0.32 0.00 1.56 0.00 -1.26 -4.34 105.19 102.46 1tbc n GLY 15 Ca 0.02 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1tbc n GLY 15 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1tbc n SER 16 N 1.42 0.00 0.15 1.61 2.88 -1.26 -3.23 113.62 115.18 1tbc n SER 16 Ca -0.03 -1.00 0.00 0.00 -1.33 0.00 0.00 58.87 56.51 1tbc n SER 16 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 1tbc n SER 16 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tbc n GLN 17 N 0.00 0.00 0.27 -1.46 10.64 -1.26 -4.33 117.38 121.24 1tbc n GLN 17 Ca 0.00 0.00 0.15 0.00 -1.83 0.00 0.00 57.00 55.32 1tbc n GLN 17 Cb 0.39 0.00 0.71 0.00 -0.86 0.00 0.00 30.24 30.49 1tbc n GLN 17 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.06 174.23 1tbc h PRO 18 N 0.00 0.00 -0.36 2.61 0.13 -1.92 1.82 132.00 134.29 1tbc h PRO 18 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1tbc h PRO 18 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1tbc h PRO 18 CO 0.00 0.07 0.00 1.63 -0.23 0.00 0.00 178.00 179.47 1tbc n LYS 19 N -3.27 2.70 0.03 0.86 5.02 -1.26 -2.92 118.16 119.32 1tbc n LYS 19 Ca -0.00 -2.04 0.00 0.00 -2.02 0.00 0.00 58.31 54.24 1tbc n LYS 19 Cb 0.29 -1.29 0.00 0.00 -0.02 0.00 0.00 35.03 34.01 1tbc n LYS 19 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1tbc n THR 20 N 0.62 0.00 0.24 -0.18 -2.24 -0.85 -4.46 114.28 107.42 1tbc n THR 20 Ca 0.12 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.02 1tbc n THR 20 Cb 0.43 -0.44 0.17 0.00 -2.10 0.00 0.00 70.33 68.40 1tbc n THR 20 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1tbc h ALA 21 N 0.00 0.96 0.00 6.98 0.00 0.20 -3.33 119.26 124.06 1tbc h ALA 21 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1tbc h ALA 21 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 17.68 1tbc h ALA 21 CO 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 179.25 178.67 1tbc n ASN 23 N -0.16 3.63 -0.12 0.00 0.23 -1.15 -4.40 115.26 113.29 1tbc n ASN 23 Ca 0.06 -1.98 -0.07 0.00 -0.53 0.00 0.00 54.58 52.06 1tbc n ASN 23 Cb 0.82 -0.71 0.01 0.00 -2.08 0.00 0.00 39.78 37.82 1tbc n ASN 23 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 1tbc h ARG 24 N 0.87 0.44 0.00 -3.83 -0.00 -1.90 -3.47 114.38 106.48 1tbc h ARG 24 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.98 59.45 1tbc h ARG 24 Cb 0.86 -0.10 0.00 0.00 0.00 0.00 0.00 29.97 30.73 1tbc h ARG 24 CO 0.00 0.29 0.00 0.00 0.00 0.00 0.00 179.97 180.26 1tbc n HIS 26 N -2.63 -2.04 0.19 0.00 -0.00 -1.26 -4.90 115.22 104.58 1tbc n HIS 26 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 57.72 57.84 1tbc n HIS 26 Cb 0.20 0.41 0.09 0.00 -0.00 0.00 0.00 29.99 30.68 1tbc n HIS 26 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1tbc h LYS 28 N 0.00 -0.35 0.02 0.00 3.64 -1.91 -3.30 116.57 114.67 1tbc h LYS 28 Ca 0.00 0.02 -0.21 0.00 -1.27 0.00 0.00 60.65 59.19 1tbc h LYS 28 Cb 0.98 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.86 1tbc h LYS 28 CO 0.00 -0.24 -1.00 1.57 -2.27 0.00 0.00 179.45 177.52 1tbc h LYS 29 N -0.42 0.06 -1.01 1.90 -0.00 -1.92 -3.48 116.57 111.70 1tbc h LYS 29 Ca -0.04 -0.09 -0.17 0.00 -0.00 0.00 0.00 60.65 60.36 1tbc h LYS 29 Cb 0.28 0.03 -0.02 0.00 -0.00 0.00 0.00 32.23 32.52 1tbc h LYS 29 CO 0.06 1.00 -0.20 0.00 -0.00 0.00 0.00 179.45 180.31 1tbc n TYR 32 N 0.64 -1.73 -1.05 0.00 4.11 -1.26 -4.95 117.16 112.92 1tbc n TYR 32 Ca 0.00 -1.82 -0.02 0.00 -0.00 0.00 0.00 57.90 56.06 1tbc n TYR 32 Cb 0.37 1.35 -0.01 0.00 -0.00 0.00 0.00 39.34 41.05 1tbc n TYR 32 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.86 177.58 1tbc n HIS 33 N -1.26 0.00 -3.37 -3.48 8.25 -1.26 -3.41 115.22 110.69 1tbc n HIS 33 Ca -0.12 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.16 1tbc n HIS 33 Cb 0.87 -1.85 0.04 0.00 1.12 0.00 0.00 29.99 30.17 1tbc n HIS 33 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1tbc h GLN 35 N -0.93 0.00 -2.95 0.00 1.08 -1.78 -3.45 115.11 107.08 1tbc h GLN 35 Ca -0.49 0.00 0.34 0.00 -1.45 0.00 0.00 58.65 57.04 1tbc h GLN 35 Cb 1.26 0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 28.58 1tbc h GLN 35 CO 0.42 0.03 -0.69 0.28 -0.95 0.00 0.00 178.83 177.92 1tbc n VAL 36 N -2.83 0.00 -2.37 -0.54 0.31 -1.26 -4.13 118.33 107.50 1tbc n VAL 36 Ca 0.01 0.28 -0.43 0.00 -0.01 0.00 0.00 64.34 64.19 1tbc n VAL 36 Cb 0.57 -0.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.78 1tbc n VAL 36 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1tbc n PHE 38 N 6.27 0.00 0.22 0.00 -1.74 -1.26 -4.00 117.46 116.95 1tbc n PHE 38 Ca 0.45 0.00 0.11 0.00 -0.56 0.00 0.00 57.45 57.45 1tbc n PHE 38 Cb 0.41 0.00 0.67 0.00 1.52 0.00 0.00 39.48 42.08 1tbc n PHE 38 CO 0.00 0.00 0.00 -0.84 -0.56 0.00 0.00 176.76 175.36 1tbc h ILE 39 N 0.00 0.92 -3.41 1.97 3.07 -1.87 -3.16 117.51 115.03 1tbc h ILE 39 Ca 0.00 0.00 -0.66 0.00 1.55 0.00 0.00 64.86 65.75 1tbc h ILE 39 Cb 0.00 0.95 -0.24 0.00 -0.27 0.00 0.00 36.82 37.26 1tbc h ILE 39 CO 0.00 0.00 -0.73 -0.89 -1.05 0.00 0.00 178.15 175.48 1tbc s THR 40 N -5.02 3.35 -2.00 0.16 2.01 -1.26 -3.36 115.64 109.51 1tbc s THR 40 Ca -0.05 -0.56 0.08 0.00 0.31 0.00 0.00 61.69 61.46 1tbc s THR 40 Cb 0.17 -2.41 0.23 0.00 0.01 0.00 0.00 72.50 70.50 1tbc s THR 40 CO 0.67 0.53 1.13 0.29 -0.69 0.00 0.00 174.62 176.55 1tbc n LYS 41 N 3.29 0.79 -0.04 4.92 4.76 -1.26 -3.39 118.16 127.23 1tbc n LYS 41 Ca -0.18 0.00 0.10 0.00 -2.87 0.00 0.00 58.31 55.36 1tbc n LYS 41 Cb 0.53 -1.16 0.46 0.00 -1.84 0.00 0.00 35.03 33.01 1tbc n LYS 41 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1tbc n GLY 42 N 0.38 -0.37 3.25 0.72 0.00 -1.26 -4.91 105.19 103.01 1tbc n GLY 42 Ca 0.06 -0.26 -0.19 0.00 0.00 0.00 0.00 46.02 45.62 1tbc n GLY 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tbc n LEU 43 N -0.24 -3.32 -2.66 0.99 4.32 -1.22 -2.53 117.00 112.34 1tbc n LEU 43 Ca 0.15 -0.48 -0.08 0.00 -0.02 0.00 0.00 56.01 55.58 1tbc n LEU 43 Cb 0.19 -2.69 -0.01 0.00 -1.62 0.00 0.00 43.42 39.30 1tbc n LEU 43 CO 0.12 0.51 -0.06 0.61 -1.22 0.00 0.00 177.39 177.35 1tbc n GLY 44 N -1.66 -0.49 0.17 -0.72 0.00 -1.26 -4.50 105.19 96.73 1tbc n GLY 44 Ca -0.05 0.01 0.03 0.00 0.00 0.00 0.00 46.02 46.02 1tbc n GLY 44 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1tbc h ILE 45 N -0.12 1.11 0.00 -0.61 -0.00 -1.80 -3.44 117.51 112.65 1tbc h ILE 45 Ca -0.16 -1.67 0.00 0.00 -0.00 0.00 0.00 64.86 63.03 1tbc h ILE 45 Cb 1.11 1.96 0.00 0.00 -0.00 0.00 0.00 36.82 39.89 1tbc h ILE 45 CO 0.20 0.44 0.00 -0.24 -0.00 0.00 0.00 178.15 178.55 1tbc n SER 46 N -3.69 0.00 0.00 2.16 2.88 -1.26 -5.13 113.62 108.57 1tbc n SER 46 Ca -0.01 -0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.27 1tbc n SER 46 Cb 0.53 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.99 1tbc n SER 46 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1tbc n TYR 47 N 0.00 0.00 0.15 0.66 0.18 -1.26 -4.91 117.16 111.98 1tbc n TYR 47 Ca 0.00 0.00 -0.13 0.00 1.88 0.00 0.00 57.90 59.65 1tbc n TYR 47 Cb 0.07 0.00 -0.06 0.00 -0.38 0.00 0.00 39.34 38.96 1tbc n TYR 47 CO 0.00 0.00 0.00 0.78 -2.08 0.00 0.00 176.86 175.56 1tbc h GLY 48 N 0.00 -0.43 -5.88 -7.48 0.00 -2.01 -3.47 103.07 83.79 1tbc h GLY 48 Ca 0.00 0.23 -0.36 0.00 0.00 0.00 0.00 47.33 47.20 1tbc h GLY 48 CO 0.00 -0.19 -0.87 0.54 0.00 0.00 0.00 176.54 176.02 1tbc n ARG 49 N -5.33 -2.93 0.17 4.80 1.74 -1.26 -4.89 116.66 108.96 1tbc n ARG 49 Ca -0.08 0.67 0.02 0.00 -0.77 0.00 0.00 57.85 57.69 1tbc n ARG 49 Cb 0.24 -5.11 0.29 0.00 -1.02 0.00 0.00 32.46 26.85 1tbc n ARG 49 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 1tbc h LYS 50 N -1.61 0.00 0.00 5.56 2.10 -2.01 -3.47 116.57 117.14 1tbc h LYS 50 Ca -0.63 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.02 1tbc h LYS 50 Cb 1.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.67 1tbc h LYS 50 CO 0.49 0.46 0.00 1.63 -2.00 0.00 0.00 179.45 180.03 1tbc n LYS 51 N -3.81 0.00 -0.04 0.07 4.76 -1.26 -4.58 118.16 113.29 1tbc n LYS 51 Ca -0.01 0.00 0.08 0.00 -2.87 0.00 0.00 58.31 55.51 1tbc n LYS 51 Cb 0.51 -0.11 0.40 0.00 -1.84 0.00 0.00 35.03 33.99 1tbc n LYS 51 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1tbc n ARG 52 N 0.00 1.29 0.27 1.97 5.12 -1.26 -3.92 116.66 120.13 1tbc n ARG 52 Ca 0.00 -0.45 0.18 0.00 -1.93 0.00 0.00 57.85 55.66 1tbc n ARG 52 Cb 0.00 -1.29 0.98 0.00 -1.16 0.00 0.00 32.46 30.99 1tbc n ARG 52 CO 0.00 0.00 0.00 0.07 -1.93 0.00 0.00 177.63 175.77 1tbc h ARG 53 N 0.86 0.00 -0.05 5.56 -0.00 -1.99 -1.41 114.38 117.36 1tbc h ARG 53 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 59.98 59.81 1tbc h ARG 53 Cb 0.19 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.15 1tbc h ARG 53 CO 0.00 0.00 -0.71 1.96 -0.00 0.00 0.00 179.97 181.22 1tbc h GLN 54 N 0.00 0.27 0.00 0.08 4.20 -1.95 -3.40 115.11 114.31 1tbc h GLN 54 Ca 0.00 -0.22 0.00 0.00 0.06 0.00 0.00 58.65 58.49 1tbc h GLN 54 Cb 0.00 0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1tbc h GLN 54 CO 0.00 0.87 0.00 0.54 -0.67 0.00 0.00 178.83 179.57 1tbc n ARG 55 N -3.81 -1.55 -2.30 1.46 1.74 -0.53 -4.78 116.66 106.89 1tbc n ARG 55 Ca -0.03 0.39 -0.06 0.00 -0.77 0.00 0.00 57.85 57.38 1tbc n ARG 55 Cb 0.69 -4.61 0.05 0.00 -1.02 0.00 0.00 32.46 27.57 1tbc n ARG 55 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1tbc n ARG 56 N 0.14 2.01 -0.35 5.56 1.74 -1.26 -4.89 116.66 119.62 1tbc n ARG 56 Ca 0.00 -3.48 0.03 0.00 -0.77 0.00 0.00 57.85 53.63 1tbc n ARG 56 Cb 0.39 -1.58 0.18 0.00 -1.02 0.00 0.00 32.46 30.42 1tbc n ARG 56 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1tbc h ARG 57 N 2.18 1.02 0.00 5.56 9.65 -1.94 -1.81 114.38 129.04 1tbc h ARG 57 Ca -0.01 -0.06 -0.06 0.00 -1.10 0.00 0.00 59.98 58.75 1tbc h ARG 57 Cb 1.41 -0.23 -0.01 0.00 -1.39 0.00 0.00 29.97 29.75 1tbc h ARG 57 CO 0.31 0.68 -0.30 -1.00 2.80 0.00 0.00 179.97 182.46 1tbc h PRO 58 N 1.05 0.00 -6.41 0.20 0.13 -2.01 -3.43 132.00 121.53 1tbc h PRO 58 Ca 0.43 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.99 1tbc h PRO 58 Cb 0.25 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.31 1tbc h PRO 58 CO -0.20 0.30 0.88 0.45 -0.23 0.00 0.00 178.00 179.21 1tbc s SER 59 N -6.33 6.83 0.00 1.44 0.15 -0.68 -4.83 113.70 110.28 1tbc s SER 59 Ca 0.04 0.93 0.12 0.00 0.70 0.00 0.00 55.95 57.74 1tbc s SER 59 Cb 0.07 -2.54 0.20 0.00 -1.71 0.00 0.00 66.02 62.04 1tbc s SER 59 CO 0.70 -1.00 1.05 0.00 1.20 0.00 0.00 173.24 175.20 1tbc n GLN 60 N 7.16 0.00 -2.30 5.44 6.02 -1.26 -4.84 117.38 127.60 1tbc n GLN 60 Ca 0.12 -1.42 -0.34 0.00 -0.01 0.00 0.00 57.00 55.36 1tbc n GLN 60 Cb 0.47 -0.17 -0.04 0.00 1.02 0.00 0.00 30.24 31.53 1tbc n GLN 60 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1tbc s GLY 61 N -1.42 0.73 -0.55 1.08 0.00 -1.26 -3.07 107.32 102.83 1tbc s GLY 61 Ca 0.16 -1.94 0.00 0.00 0.00 0.00 0.00 44.72 42.94 1tbc s GLY 61 CO -0.08 3.10 0.00 0.61 0.00 0.00 0.00 173.10 176.73 1tbc n GLY 62 N 6.74 0.72 0.21 0.20 0.00 -1.20 -4.91 105.19 106.95 1tbc n GLY 62 Ca 0.38 -0.80 0.13 0.00 0.00 0.00 0.00 46.02 45.73 1tbc n GLY 62 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1tbc h GLN 63 N 0.00 0.00 -6.91 1.61 1.08 -1.77 -3.44 115.11 105.68 1tbc h GLN 63 Ca -0.11 0.00 -0.58 0.00 -1.45 0.00 0.00 58.65 56.50 1tbc h GLN 63 Cb 0.43 0.00 -0.16 0.00 -0.05 0.00 0.00 27.48 27.70 1tbc h GLN 63 CO 0.16 0.00 -0.95 2.41 -0.95 0.00 0.00 178.83 179.50 1tbc n THR 64 N -2.97 -1.64 0.75 -0.54 -1.04 -1.26 -3.19 114.28 104.39 1tbc n THR 64 Ca 0.03 -0.50 0.08 0.00 -2.04 0.00 0.00 64.05 61.62 1tbc n THR 64 Cb 0.47 -1.51 0.41 0.00 -1.82 0.00 0.00 70.33 67.88 1tbc n THR 64 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1tbc n HIS 65 N -4.54 0.00 0.00 -1.42 8.25 -1.11 -3.81 115.22 112.59 1tbc n HIS 65 Ca -0.32 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.14 1tbc n HIS 65 Cb 0.69 -0.34 0.00 0.00 1.12 0.00 0.00 29.99 31.47 1tbc n HIS 65 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1tbc n GLN 66 N -1.34 0.00 -0.04 -0.41 6.02 -1.26 -4.05 117.38 116.31 1tbc n GLN 66 Ca 0.07 0.00 -0.13 0.00 -0.01 0.00 0.00 57.00 56.93 1tbc n GLN 66 Cb 0.15 0.00 -0.11 0.00 1.02 0.00 0.00 30.24 31.30 1tbc n GLN 66 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1tbc h ASP 67 N 0.00 -0.01 1.04 1.08 1.82 -1.90 -1.49 116.42 116.96 1tbc h ASP 67 Ca 0.00 -0.70 -0.15 0.00 -0.39 0.00 0.00 57.03 55.79 1tbc h ASP 67 Cb 0.00 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 39.99 1tbc h ASP 67 CO 0.00 0.70 -0.73 1.55 -1.61 0.00 0.00 179.24 179.15 1tbc h PRO 68 N -0.72 0.00 -1.20 0.28 0.13 -1.97 -3.35 132.00 125.17 1tbc h PRO 68 Ca -0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.61 1tbc h PRO 68 Cb 0.71 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.42 1tbc h PRO 68 CO 0.00 0.73 -0.85 0.44 -0.23 0.00 0.00 178.00 178.09 1tbc n ILE 69 N -3.42 2.10 0.85 -3.56 -5.35 -1.25 -4.82 119.36 103.91 1tbc n ILE 69 Ca 0.00 -4.35 0.07 0.00 -0.27 0.00 0.00 62.75 58.20 1tbc n ILE 69 Cb 0.78 -0.76 0.39 0.00 -1.74 0.00 0.00 39.64 38.30 1tbc n ILE 69 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1tbc n PRO 70 N -0.47 0.42 0.09 6.28 -0.04 -0.56 -2.88 135.00 137.84 1tbc n PRO 70 Ca 0.33 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.73 1tbc n PRO 70 Cb 0.76 -1.48 -0.02 0.00 -0.04 0.00 0.00 33.50 32.72 1tbc n PRO 70 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1tbc h LYS 71 N 0.00 0.06 -2.14 0.54 2.10 -1.88 -3.49 116.57 111.77 1tbc h LYS 71 Ca 0.00 -0.07 0.23 0.00 -2.00 0.00 0.00 60.65 58.81 1tbc h LYS 71 Cb 0.00 0.02 -0.07 0.00 -0.90 0.00 0.00 32.23 31.28 1tbc h LYS 71 CO 0.00 0.90 0.66 1.14 -2.00 0.00 0.00 179.45 180.15 1tbc s GLN 72 N -3.06 0.92 0.13 0.07 1.03 -1.14 -5.02 119.66 112.58 1tbc s GLN 72 Ca -0.01 -0.55 -0.15 0.00 0.04 0.00 0.00 55.36 54.69 1tbc s GLN 72 Cb 0.11 0.28 -0.01 0.00 0.03 0.00 0.00 33.01 33.42 1tbc s GLN 72 CO 0.81 -0.42 1.62 -1.00 -2.54 0.00 0.00 175.29 173.75 1tbc h PRO 73 N 2.00 0.66 -3.67 9.60 0.13 -1.94 -3.47 132.00 135.31 1tbc h PRO 73 Ca -0.27 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1tbc h PRO 73 Cb 1.21 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1tbc h PRO 73 CO 0.30 0.70 -0.76 0.45 -0.23 0.00 0.00 178.00 178.46 1tbc n SER 74 N -4.53 -7.52 0.00 1.44 2.88 -1.26 -4.14 113.62 100.49 1tbc n SER 74 Ca -0.00 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.64 1tbc n SER 74 Cb 0.22 -4.22 0.00 0.00 -0.75 0.00 0.00 64.21 59.46 1tbc n SER 74 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1tbc n SER 75 N 1.51 0.00 -0.00 -3.46 2.88 -1.26 -3.27 113.62 110.02 1tbc n SER 75 Ca 0.00 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.37 1tbc n SER 75 Cb 0.00 -0.05 -0.11 0.00 -0.75 0.00 0.00 64.21 63.30 1tbc n SER 75 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1tbc h GLN 76 N 0.47 0.38 0.00 -1.46 7.50 -1.82 0.47 115.11 120.65 1tbc h GLN 76 Ca 0.00 -0.40 0.00 0.00 0.50 0.00 0.00 58.65 58.75 1tbc h GLN 76 Cb 0.00 0.11 0.00 0.00 0.05 0.00 0.00 27.48 27.64 1tbc h GLN 76 CO 0.00 1.07 0.00 -0.35 -1.50 0.00 0.00 178.83 178.05 1tbc n PRO 77 N -4.27 0.13 -2.11 1.46 -0.04 -1.08 -3.95 135.00 125.14 1tbc n PRO 77 Ca -0.10 0.08 -0.02 0.00 -0.04 0.00 0.00 63.50 63.42 1tbc n PRO 77 Cb 0.64 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.65 1tbc n PRO 77 CO 0.00 0.00 0.00 2.89 -0.04 0.00 0.00 175.50 178.35 1tbc n ARG 78 N -1.42 0.89 0.00 0.54 1.85 -1.22 -4.78 116.66 112.53 1tbc n ARG 78 Ca 0.08 -1.83 0.00 0.00 -1.00 0.00 0.00 57.85 55.10 1tbc n ARG 78 Cb 0.24 -0.10 0.00 0.00 -1.05 0.00 0.00 32.46 31.55 1tbc n ARG 78 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1tbc n GLY 79 N -0.61 0.68 3.74 2.89 0.00 0.16 -4.86 105.19 107.18 1tbc n GLY 79 Ca -0.11 0.20 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1tbc n GLY 79 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1tbc s ASP 80 N 1.68 7.28 -1.08 1.61 2.15 -0.80 -4.93 116.67 122.58 1tbc s ASP 80 Ca 0.00 2.08 -0.23 0.00 0.43 0.00 0.00 52.55 54.83 1tbc s ASP 80 Cb 0.00 -2.60 -0.04 0.00 -0.30 0.00 0.00 42.92 39.97 1tbc s ASP 80 CO 0.00 -0.21 1.87 -2.16 -0.17 0.00 0.00 175.17 174.50 1tbc s PRO 81 N -0.36 2.78 -0.03 4.34 0.04 -1.26 -4.61 135.00 135.89 1tbc s PRO 81 Ca 0.49 -0.95 -0.24 0.00 0.04 0.00 0.00 61.00 60.34 1tbc s PRO 81 Cb -0.29 -5.22 -0.18 0.00 0.04 0.00 0.00 34.50 28.84 1tbc s PRO 81 CO 0.35 -3.42 1.10 1.79 0.04 0.00 0.00 177.00 176.86 1tbc h THR 82 N 6.55 1.09 0.00 1.26 1.35 -1.79 -3.50 112.91 117.87 1tbc h THR 82 Ca 0.20 -1.09 0.00 0.00 -0.55 0.00 0.00 66.41 64.97 1tbc h THR 82 Cb 0.96 1.74 0.00 0.00 -1.73 0.00 0.00 68.15 69.12 1tbc h THR 82 CO 1.26 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 177.39 1tbc n GLY 83 N 0.31 -1.34 0.59 5.82 0.00 -1.20 -4.38 105.19 104.99 1tbc n GLY 83 Ca -0.08 0.49 0.12 0.00 0.00 0.00 0.00 46.02 46.55 1tbc n GLY 83 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1tbc n PRO 84 N 0.00 1.60 -0.16 1.61 -0.04 -1.24 -4.14 135.00 132.62 1tbc n PRO 84 Ca 0.00 -1.19 0.07 0.00 -0.04 0.00 0.00 63.50 62.34 1tbc n PRO 84 Cb 0.00 -1.48 0.20 0.00 -0.04 0.00 0.00 33.50 32.19 1tbc n PRO 84 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1tbc n LYS 85 N 0.34 1.80 0.00 0.54 4.76 -1.26 -5.10 118.16 119.24 1tbc n LYS 85 Ca 0.14 -1.24 0.13 0.00 -2.87 0.00 0.00 58.31 54.46 1tbc n LYS 85 Cb 0.46 -1.30 0.77 0.00 -1.84 0.00 0.00 35.03 33.12 1tbc n LYS 85 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42