#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 -3.31 0.00 1.45 -0.08 -1.23 -4.96 116.55 108.43 1tbc n ASP 2 Ca 0.00 -1.10 0.00 0.00 -1.51 0.00 0.00 54.79 52.18 1tbc n ASP 2 Cb 0.00 -2.80 0.00 0.00 2.34 0.00 0.00 41.12 40.66 1tbc n ASP 2 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1tbc n PRO 3 N -4.47 0.00 0.12 -0.67 -0.04 -1.26 -4.78 135.00 123.91 1tbc n PRO 3 Ca -0.17 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.20 1tbc n PRO 3 Cb 0.62 -0.07 -0.05 0.00 -0.04 0.00 0.00 33.50 33.96 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 0.34 0.00 0.52 2.07 -1.92 -3.48 116.25 113.78 1tbc h VAL 4 Ca 0.00 -0.82 0.00 0.00 0.82 0.00 0.00 66.70 66.70 1tbc h VAL 4 Cb 0.00 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.34 1tbc h VAL 4 CO 0.00 0.09 0.00 0.47 0.02 0.00 0.00 177.57 178.15 1tbc n ASP 5 N -5.04 0.00 -2.18 0.57 8.00 -1.26 -5.13 116.55 111.51 1tbc n ASP 5 Ca -0.07 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.42 1tbc n ASP 5 Cb 0.23 0.32 0.01 0.00 -0.02 0.00 0.00 41.12 41.66 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 -2.42 0.71 0.04 -0.24 -0.04 -1.26 -4.14 135.00 127.65 1tbc n PRO 6 Ca 0.00 -0.19 -0.10 0.00 -0.04 0.00 0.00 63.50 63.16 1tbc n PRO 6 Cb 0.00 -0.03 -0.08 0.00 -0.04 0.00 0.00 33.50 33.35 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 -0.02 -0.15 0.00 3.54 2.35 -1.37 -3.36 115.58 116.56 1tbc h ASN 7 Ca -0.02 -0.38 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 1tbc h ASN 7 Cb 0.08 0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1tbc h ASN 7 CO 0.02 0.43 -0.34 2.30 -1.65 0.00 0.00 177.43 178.20 1tbc n ILE 8 N -4.89 0.49 -3.51 2.81 -0.00 -1.26 -4.88 119.36 108.12 1tbc n ILE 8 Ca -0.07 -0.58 -0.21 0.00 -0.00 0.00 0.00 62.75 61.88 1tbc n ILE 8 Cb 0.26 0.34 0.03 0.00 -0.00 0.00 0.00 39.64 40.27 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 -0.37 -1.38 -1.02 6.28 1.02 -1.26 -4.84 120.64 119.07 1tbc n GLU 9 Ca 0.04 0.81 -0.16 0.00 -0.02 0.00 0.00 57.16 57.83 1tbc n GLU 9 Cb 0.67 -4.29 -0.02 0.00 -0.02 0.00 0.00 31.44 27.77 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 -3.18 1.88 -0.84 3.49 -0.04 -1.26 -4.37 135.00 130.67 1tbc n PRO 10 Ca -0.11 -1.46 -0.02 0.00 -0.04 0.00 0.00 63.50 61.86 1tbc n PRO 10 Cb 0.59 -1.72 0.27 0.00 -0.04 0.00 0.00 33.50 32.60 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 0.98 1.82 -4.43 0.54 7.02 -1.26 -4.83 117.44 117.28 1tbc n TRP 11 Ca 0.33 -1.22 -0.27 0.00 -1.02 0.00 0.00 57.50 55.32 1tbc n TRP 11 Cb 0.61 -0.56 -0.17 0.00 -2.42 0.00 0.00 31.31 28.77 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 -1.58 2.14 -0.20 -0.99 2.20 -1.24 -3.05 114.94 112.21 1tbc s ASN 12 Ca 0.50 -0.36 -0.01 0.00 -0.94 0.00 0.00 52.86 52.05 1tbc s ASN 12 Cb 0.41 -0.95 0.06 0.00 -2.00 0.00 0.00 41.25 38.77 1tbc s ASN 12 CO 0.10 0.00 -0.01 -1.00 -2.94 0.00 0.00 177.10 173.25 1tbc s HIS 13 N 0.97 1.61 0.04 1.54 3.76 -1.23 -4.95 115.29 117.02 1tbc s HIS 13 Ca -0.08 -1.21 0.32 0.00 -0.15 0.00 0.00 55.06 53.94 1tbc s HIS 13 Cb -0.15 -1.26 1.48 0.00 1.11 0.00 0.00 32.58 33.76 1tbc s HIS 13 CO -0.00 -0.67 1.96 -1.00 -0.85 0.00 0.00 174.74 174.17 1tbc h PRO 14 N 8.12 0.00 -0.09 8.40 0.13 -1.93 -3.44 132.00 143.19 1tbc h PRO 14 Ca -0.18 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.91 1tbc h PRO 14 Cb 1.10 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 1tbc h PRO 14 CO 0.37 0.00 -0.04 0.41 -0.23 0.00 0.00 178.00 178.51 1tbc n GLY 15 N -0.41 0.54 0.00 1.56 0.00 -1.26 -3.74 105.19 101.88 1tbc n GLY 15 Ca -0.00 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.28 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 1.19 0.01 0.07 1.61 2.88 -1.26 -4.40 113.62 113.71 1tbc n SER 16 Ca -0.02 -1.00 0.00 0.00 -1.33 0.00 0.00 58.87 56.52 1tbc n SER 16 Cb 0.08 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.54 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 0.00 -1.46 6.02 -1.26 -3.47 117.38 117.21 1tbc n GLN 17 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.00 57.07 1tbc n GLN 17 Cb 0.30 -0.01 0.43 0.00 1.02 0.00 0.00 30.24 31.98 1tbc n GLN 17 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1tbc n PRO 18 N -3.00 0.26 -0.54 -1.09 -0.04 -1.26 -0.55 135.00 128.78 1tbc n PRO 18 Ca 0.00 0.12 0.02 0.00 -0.04 0.00 0.00 63.50 63.60 1tbc n PRO 18 Cb 0.00 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 31.98 1tbc n PRO 18 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1tbc n LYS 19 N -1.27 0.18 0.00 0.54 4.76 -1.26 -4.71 118.16 116.40 1tbc n LYS 19 Ca 0.08 -1.33 0.00 0.00 -2.87 0.00 0.00 58.31 54.20 1tbc n LYS 19 Cb 0.13 -0.59 0.00 0.00 -1.84 0.00 0.00 35.03 32.73 1tbc n LYS 19 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1tbc n THR 20 N -0.15 0.00 -0.69 -0.18 -1.04 -1.08 -4.76 114.28 106.38 1tbc n THR 20 Ca 0.03 0.00 -0.06 0.00 -2.04 0.00 0.00 64.05 61.97 1tbc n THR 20 Cb 0.74 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 69.16 1tbc n THR 20 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1tbc n ALA 21 N -1.32 4.86 -3.93 2.41 0.00 0.29 -4.70 120.51 118.13 1tbc n ALA 21 Ca 0.00 -0.97 -0.31 0.00 0.00 0.00 0.00 53.44 52.16 1tbc n ALA 21 Cb 0.00 -1.86 -0.04 0.00 0.00 0.00 0.00 19.45 17.54 1tbc n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tbc h ASN 23 N -0.83 0.58 -5.53 0.00 7.08 -1.84 -3.49 115.58 111.56 1tbc h ASN 23 Ca -0.46 -0.45 0.21 0.00 -3.08 0.00 0.00 56.30 52.52 1tbc h ASN 23 Cb 1.30 -0.18 -0.04 0.00 -2.08 0.00 0.00 38.32 37.32 1tbc h ASN 23 CO 0.66 1.24 0.67 0.00 -2.08 0.00 0.00 177.43 177.91 1tbc s ARG 24 N -3.36 1.07 0.00 4.14 1.70 -1.26 -5.08 118.95 116.15 1tbc s ARG 24 Ca -0.06 -0.69 0.00 0.00 -0.47 0.00 0.00 55.73 54.51 1tbc s ARG 24 Cb 0.09 0.30 0.00 0.00 -0.57 0.00 0.00 34.95 34.77 1tbc s ARG 24 CO 0.87 -0.50 0.00 0.00 -1.08 0.00 0.00 175.30 174.59 1tbc n HIS 26 N 0.00 -4.16 0.85 0.00 -0.00 -1.26 -4.92 115.22 105.74 1tbc n HIS 26 Ca 0.00 1.23 0.13 0.00 -0.00 0.00 0.00 57.72 59.09 1tbc n HIS 26 Cb 0.00 3.18 0.47 0.00 -0.00 0.00 0.00 29.99 33.64 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 0.00 0.00 0.00 3.64 -1.96 -3.29 116.57 114.96 1tbc h LYS 28 Ca 0.00 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.29 1tbc h LYS 28 Cb 0.59 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 32.22 1tbc h LYS 28 CO 0.00 0.46 -0.72 0.36 -2.27 0.00 0.00 179.45 177.28 1tbc n LYS 29 N -3.52 0.61 -0.58 1.90 0.00 -1.23 -4.87 118.16 110.47 1tbc n LYS 29 Ca -0.00 -2.34 -0.04 0.00 -0.00 0.00 0.00 58.31 55.93 1tbc n LYS 29 Cb 0.58 -0.69 -0.05 0.00 -0.00 0.00 0.00 35.03 34.87 1tbc n LYS 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1tbc n TYR 32 N -0.36 -0.73 -1.45 0.00 4.11 -1.26 -4.95 117.16 112.52 1tbc n TYR 32 Ca -0.06 -1.92 -0.14 0.00 -0.00 0.00 0.00 57.90 55.78 1tbc n TYR 32 Cb 0.64 0.83 -0.06 0.00 -0.00 0.00 0.00 39.34 40.75 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 -1.11 -0.34 0.00 -3.48 8.25 -1.26 -4.33 115.22 112.94 1tbc n HIS 33 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1tbc n HIS 33 Cb 0.85 -2.73 0.00 0.00 1.12 0.00 0.00 29.99 29.23 1tbc n HIS 33 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1tbc n GLN 35 N 14.00 0.00 0.00 0.00 6.02 -1.26 -4.62 117.38 131.52 1tbc n GLN 35 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1tbc n GLN 35 Cb 0.00 -2.90 0.00 0.00 1.02 0.00 0.00 30.24 28.36 1tbc n GLN 35 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1tbc n VAL 36 N -2.00 0.00 -2.57 5.09 0.24 -1.26 -3.41 118.33 114.42 1tbc n VAL 36 Ca 0.00 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.87 1tbc n VAL 36 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 1tbc n VAL 36 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1tbc n PHE 38 N 7.18 0.00 0.05 0.00 -1.74 -1.22 -3.83 117.46 117.90 1tbc n PHE 38 Ca 0.46 0.00 0.05 0.00 -0.56 0.00 0.00 57.45 57.39 1tbc n PHE 38 Cb 0.44 0.00 0.46 0.00 1.52 0.00 0.00 39.48 41.90 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 1.09 -3.64 1.97 3.07 -1.86 -1.50 117.51 116.64 1tbc h ILE 39 Ca 0.00 -0.18 -0.68 0.00 1.55 0.00 0.00 64.86 65.56 1tbc h ILE 39 Cb 0.00 0.60 -0.21 0.00 -0.27 0.00 0.00 36.82 36.95 1tbc h ILE 39 CO 0.00 0.09 -0.85 -0.89 -1.05 0.00 0.00 178.15 175.45 1tbc s THR 40 N -5.40 2.33 -0.38 0.16 2.01 -1.26 -3.49 115.64 109.61 1tbc s THR 40 Ca -0.08 -1.84 0.25 0.00 0.31 0.00 0.00 61.69 60.34 1tbc s THR 40 Cb 0.17 -2.07 0.27 0.00 0.01 0.00 0.00 72.50 70.89 1tbc s THR 40 CO 0.72 0.02 1.76 0.07 -0.69 0.00 0.00 174.62 176.50 1tbc h LYS 41 N 3.62 0.00 0.00 4.92 5.09 -1.96 -2.73 116.57 125.52 1tbc h LYS 41 Ca -0.49 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.25 1tbc h LYS 41 Cb 1.18 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.51 1tbc h LYS 41 CO 0.43 0.00 0.00 0.41 -2.09 0.00 0.00 179.45 178.20 1tbc n GLY 42 N 0.01 -0.97 2.39 0.07 0.00 -1.26 -4.86 105.19 100.57 1tbc n GLY 42 Ca 0.02 -0.06 -0.17 0.00 0.00 0.00 0.00 46.02 45.80 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 -1.43 -1.63 -0.38 0.99 4.77 -1.03 -2.02 117.00 116.27 1tbc n LEU 43 Ca 0.05 0.13 -0.04 0.00 -0.03 0.00 0.00 56.01 56.12 1tbc n LEU 43 Cb 0.17 -2.52 -0.01 0.00 -2.33 0.00 0.00 43.42 38.73 1tbc n LEU 43 CO 0.14 -0.42 -0.04 0.61 -1.33 0.00 0.00 177.39 176.35 1tbc n GLY 44 N -0.96 0.45 0.31 -0.72 0.00 -1.26 -4.52 105.19 98.49 1tbc n GLY 44 Ca -0.20 -0.81 -0.13 0.00 0.00 0.00 0.00 46.02 44.88 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 0.00 0.21 0.00 -0.61 -0.00 -1.60 -3.44 117.51 112.07 1tbc h ILE 45 Ca -0.09 -0.44 -0.02 0.00 -0.00 0.00 0.00 64.86 64.31 1tbc h ILE 45 Cb 0.66 0.30 -0.02 0.00 -0.00 0.00 0.00 36.82 37.76 1tbc h ILE 45 CO 0.11 0.04 -0.05 -1.54 -0.00 0.00 0.00 178.15 176.71 1tbc n SER 46 N -5.29 -0.18 0.11 2.16 3.41 -1.26 -4.97 113.62 107.59 1tbc n SER 46 Ca -0.10 -0.46 -0.02 0.00 -0.26 0.00 0.00 58.87 58.03 1tbc n SER 46 Cb 0.32 0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 64.31 1tbc n SER 46 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 1tbc h TYR 47 N 0.00 0.00 0.00 7.33 -0.00 -1.93 -3.46 116.97 118.91 1tbc h TYR 47 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.63 1tbc h TYR 47 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.32 1tbc h TYR 47 CO -0.06 0.72 0.00 0.41 -0.00 0.00 0.00 178.16 179.23 1tbc n GLY 48 N 1.19 -0.48 3.77 0.10 0.00 -1.26 -5.14 105.19 103.37 1tbc n GLY 48 Ca 0.01 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1tbc n GLY 48 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1tbc s ARG 49 N 0.00 4.29 0.00 1.61 3.52 -1.26 -4.94 118.95 122.17 1tbc s ARG 49 Ca 0.00 1.83 0.00 0.00 -0.13 0.00 0.00 55.73 57.43 1tbc s ARG 49 Cb 0.00 -2.87 0.00 0.00 -1.56 0.00 0.00 34.95 30.52 1tbc s ARG 49 CO 0.00 -0.11 0.11 0.36 -0.81 0.00 0.00 175.30 174.85 1tbc n LYS 50 N 0.49 4.54 -1.31 5.12 0.00 -1.26 -5.13 118.16 120.61 1tbc n LYS 50 Ca 0.02 -0.11 0.17 0.00 -0.00 0.00 0.00 58.31 58.39 1tbc n LYS 50 Cb 0.46 -0.57 -0.05 0.00 -0.00 0.00 0.00 35.03 34.87 1tbc n LYS 50 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1tbc n LYS 51 N -0.68 -2.67 -1.08 -1.58 4.76 -1.26 -4.77 118.16 110.88 1tbc n LYS 51 Ca 0.00 1.92 -0.03 0.00 -2.87 0.00 0.00 58.31 57.33 1tbc n LYS 51 Cb 0.01 -3.26 -0.01 0.00 -1.84 0.00 0.00 35.03 29.92 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 -3.93 -1.86 -0.01 1.97 5.12 -1.26 -4.77 116.66 111.93 1tbc n ARG 52 Ca -0.02 0.58 0.11 0.00 -1.93 0.00 0.00 57.85 56.59 1tbc n ARG 52 Cb 0.66 -5.01 0.59 0.00 -1.16 0.00 0.00 32.46 27.53 1tbc n ARG 52 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1tbc n ARG 53 N 0.43 1.11 -0.07 5.56 5.12 -1.26 -3.59 116.66 123.97 1tbc n ARG 53 Ca -0.03 -0.17 -0.12 0.00 -1.93 0.00 0.00 57.85 55.60 1tbc n ARG 53 Cb 0.51 -1.34 -0.05 0.00 -1.16 0.00 0.00 32.46 30.41 1tbc n ARG 53 CO 0.00 0.00 0.00 1.96 -1.93 0.00 0.00 177.63 177.66 1tbc h GLN 54 N 0.36 0.37 0.00 5.56 4.20 -2.00 -3.43 115.11 120.17 1tbc h GLN 54 Ca 0.00 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.58 1tbc h GLN 54 Cb 0.08 -0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1tbc h GLN 54 CO 0.00 0.60 0.00 0.54 -0.67 0.00 0.00 178.83 179.30 1tbc n ARG 55 N -4.65 -0.94 -2.03 1.46 5.12 -1.24 -4.78 116.66 109.61 1tbc n ARG 55 Ca -0.05 0.23 -0.09 0.00 -1.93 0.00 0.00 57.85 56.02 1tbc n ARG 55 Cb 0.26 -4.30 0.06 0.00 -1.16 0.00 0.00 32.46 27.32 1tbc n ARG 55 CO 0.00 0.00 0.00 0.54 -1.93 0.00 0.00 177.63 176.24 1tbc n ARG 56 N -0.76 2.31 -0.32 5.56 3.00 -1.26 -4.85 116.66 120.33 1tbc n ARG 56 Ca 0.00 -3.59 0.00 0.00 -0.01 0.00 0.00 57.85 54.26 1tbc n ARG 56 Cb 0.23 -1.71 0.18 0.00 0.00 0.00 0.00 32.46 31.16 1tbc n ARG 56 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 1tbc h ARG 57 N 2.02 1.15 0.00 5.56 9.65 -1.98 -1.77 114.38 129.01 1tbc h ARG 57 Ca 0.08 -0.07 -0.00 0.00 -1.10 0.00 0.00 59.98 58.89 1tbc h ARG 57 Cb 1.41 -0.26 -0.00 0.00 -1.39 0.00 0.00 29.97 29.73 1tbc h ARG 57 CO 0.39 0.76 -0.01 -1.00 2.80 0.00 0.00 179.97 182.91 1tbc h PRO 58 N 1.19 0.00 -5.28 0.20 0.13 -2.01 -3.43 132.00 122.79 1tbc h PRO 58 Ca 0.35 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.85 1tbc h PRO 58 Cb -0.05 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 30.94 1tbc h PRO 58 CO -0.10 0.01 -0.06 0.45 -0.23 0.00 0.00 178.00 178.07 1tbc s SER 59 N -6.14 6.36 -0.37 1.44 0.15 -0.67 -4.89 113.70 109.59 1tbc s SER 59 Ca 0.06 0.28 0.11 0.00 0.70 0.00 0.00 55.95 57.10 1tbc s SER 59 Cb 0.06 -2.26 0.39 0.00 -1.71 0.00 0.00 66.02 62.50 1tbc s SER 59 CO 0.65 -0.34 1.44 0.00 1.20 0.00 0.00 173.24 176.19 1tbc n GLN 60 N 5.58 1.26 -2.09 5.44 3.00 -1.26 -4.90 117.38 124.42 1tbc n GLN 60 Ca -0.05 -1.52 -0.41 0.00 -0.01 0.00 0.00 57.00 55.01 1tbc n GLN 60 Cb 0.50 0.18 -0.01 0.00 0.00 0.00 0.00 30.24 30.90 1tbc n GLN 60 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1tbc n GLY 61 N -1.04 3.09 2.53 1.08 0.00 -1.26 -3.78 105.19 105.81 1tbc n GLY 61 Ca -0.10 -1.42 -0.15 0.00 0.00 0.00 0.00 46.02 44.35 1tbc n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1tbc n GLY 62 N 4.89 -0.17 0.00 -0.02 0.00 -1.26 -4.87 105.19 103.76 1tbc n GLY 62 Ca 0.50 -0.18 0.15 0.00 0.00 0.00 0.00 46.02 46.48 1tbc n GLY 62 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1tbc n GLN 63 N -2.85 0.37 -4.18 1.61 1.13 -1.25 -4.80 117.38 107.41 1tbc n GLN 63 Ca -0.10 0.00 -0.31 0.00 -1.94 0.00 0.00 57.00 54.65 1tbc n GLN 63 Cb 0.60 -1.50 -0.05 0.00 0.11 0.00 0.00 30.24 29.39 1tbc n GLN 63 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1tbc n THR 64 N -1.31 -1.73 1.36 5.09 -1.04 -1.26 -3.50 114.28 111.89 1tbc n THR 64 Ca 0.13 -0.36 0.00 0.00 -2.04 0.00 0.00 64.05 61.78 1tbc n THR 64 Cb 0.25 -1.73 0.00 0.00 -1.82 0.00 0.00 70.33 67.03 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 -4.43 0.00 0.00 -1.42 8.25 -1.17 -4.30 115.22 112.15 1tbc n HIS 65 Ca -0.21 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.25 1tbc n HIS 65 Cb 0.63 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.71 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 -0.29 0.00 -0.04 -0.41 3.00 -1.26 -4.03 117.38 114.34 1tbc n GLN 66 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.00 56.83 1tbc n GLN 66 Cb 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 30.24 30.25 1tbc n GLN 66 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 1tbc h ASP 67 N 0.00 0.93 0.56 1.08 1.82 -1.98 -2.55 116.42 116.27 1tbc h ASP 67 Ca 0.00 -0.60 -0.26 0.00 -0.39 0.00 0.00 57.03 55.78 1tbc h ASP 67 Cb 0.00 -0.27 0.00 0.00 0.68 0.00 0.00 39.33 39.74 1tbc h ASP 67 CO 0.00 1.36 -1.17 1.55 -1.61 0.00 0.00 179.24 179.38 1tbc h PRO 68 N 0.55 0.31 -0.76 0.28 0.13 -1.96 -3.37 132.00 127.17 1tbc h PRO 68 Ca -0.03 -0.46 -0.51 0.00 -0.87 0.00 0.00 66.00 64.13 1tbc h PRO 68 Cb 1.29 0.16 -0.43 0.00 0.13 0.00 0.00 31.00 32.16 1tbc h PRO 68 CO 0.14 1.19 -0.86 0.44 -0.23 0.00 0.00 178.00 178.68 1tbc n ILE 69 N -3.59 2.34 0.53 -3.56 -0.00 -1.25 -4.75 119.36 109.08 1tbc n ILE 69 Ca -0.08 -4.09 0.08 0.00 -0.00 0.00 0.00 62.75 58.66 1tbc n ILE 69 Cb 0.97 -0.82 0.34 0.00 -0.00 0.00 0.00 39.64 40.14 1tbc n ILE 69 CO 0.00 0.00 0.00 -0.81 -0.00 0.00 0.00 176.55 175.74 1tbc n PRO 70 N -0.67 0.01 0.08 6.28 -0.04 -0.96 -2.93 135.00 136.77 1tbc n PRO 70 Ca 0.39 0.24 -0.19 0.00 -0.04 0.00 0.00 63.50 63.89 1tbc n PRO 70 Cb 0.93 -1.52 -0.11 0.00 -0.04 0.00 0.00 33.50 32.76 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 0.57 -2.67 0.54 2.10 -1.87 -3.48 116.57 111.76 1tbc h LYS 71 Ca 0.00 -0.70 0.11 0.00 -2.00 0.00 0.00 60.65 58.06 1tbc h LYS 71 Cb 0.28 0.22 -0.07 0.00 -0.90 0.00 0.00 32.23 31.75 1tbc h LYS 71 CO 0.00 1.30 0.36 1.14 -2.00 0.00 0.00 179.45 180.24 1tbc s GLN 72 N -3.10 1.44 0.06 0.07 1.03 -1.15 -5.04 119.66 112.97 1tbc s GLN 72 Ca -0.08 -0.77 -0.20 0.00 0.04 0.00 0.00 55.36 54.35 1tbc s GLN 72 Cb 0.07 0.51 -0.12 0.00 0.03 0.00 0.00 33.01 33.50 1tbc s GLN 72 CO 0.91 -0.66 1.45 -1.00 -2.54 0.00 0.00 175.29 173.46 1tbc h PRO 73 N 2.00 0.35 -6.38 9.60 0.13 -1.94 -3.46 132.00 132.30 1tbc h PRO 73 Ca -0.22 -0.13 -0.48 0.00 -0.87 0.00 0.00 66.00 64.29 1tbc h PRO 73 Cb 1.25 -0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 1tbc h PRO 73 CO 0.26 0.61 -0.81 0.45 -0.23 0.00 0.00 178.00 178.27 1tbc n SER 74 N -4.65 -2.90 0.00 1.44 2.88 -1.26 -4.32 113.62 104.81 1tbc n SER 74 Ca -0.05 -0.88 0.00 0.00 -1.33 0.00 0.00 58.87 56.61 1tbc n SER 74 Cb 0.27 -3.54 0.00 0.00 -0.75 0.00 0.00 64.21 60.19 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 -2.87 0.00 0.10 -3.46 2.88 -1.26 -4.03 113.62 104.97 1tbc n SER 75 Ca -0.09 0.00 -0.21 0.00 -1.33 0.00 0.00 58.87 57.24 1tbc n SER 75 Cb 0.58 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.91 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 0.00 0.57 -0.21 -1.46 7.50 -1.77 0.60 115.11 120.34 1tbc h GLN 76 Ca 0.00 -0.78 0.00 0.00 0.50 0.00 0.00 58.65 58.37 1tbc h GLN 76 Cb 0.00 0.26 0.00 0.00 0.05 0.00 0.00 27.48 27.79 1tbc h GLN 76 CO 0.00 1.35 0.00 -0.35 -1.50 0.00 0.00 178.83 178.33 1tbc n PRO 77 N -3.76 1.69 0.00 1.46 -0.04 -1.25 -3.63 135.00 129.47 1tbc n PRO 77 Ca -0.13 -1.05 0.00 0.00 -0.04 0.00 0.00 63.50 62.28 1tbc n PRO 77 Cb 0.99 -1.34 0.00 0.00 -0.04 0.00 0.00 33.50 33.11 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 0.29 0.00 0.00 0.54 1.85 -1.23 -5.01 116.66 113.10 1tbc n ARG 78 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.99 1tbc n ARG 78 Cb 0.30 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.71 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 -0.38 -1.21 3.80 2.89 0.00 0.18 -4.96 105.19 105.52 1tbc n GLY 79 Ca 0.00 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 44.98 1tbc n GLY 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1tbc s ASP 80 N -1.49 5.88 0.14 1.61 1.11 -1.09 -4.86 116.67 117.96 1tbc s ASP 80 Ca 0.00 1.86 -0.31 0.00 0.18 0.00 0.00 52.55 54.28 1tbc s ASP 80 Cb 0.00 -2.54 -0.08 0.00 1.07 0.00 0.00 42.92 41.37 1tbc s ASP 80 CO 0.00 -1.10 1.36 -2.16 1.18 0.00 0.00 175.17 174.45 1tbc s PRO 81 N -3.87 4.34 -0.00 8.23 0.04 -1.26 -4.43 135.00 138.05 1tbc s PRO 81 Ca 0.65 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.76 1tbc s PRO 81 Cb -0.17 -3.23 -0.00 0.00 0.04 0.00 0.00 34.50 31.14 1tbc s PRO 81 CO 0.33 -0.38 0.00 0.25 0.04 0.00 0.00 177.00 177.24 1tbc n THR 82 N 3.56 0.00 0.00 1.26 -2.24 -1.26 -5.11 114.28 110.49 1tbc n THR 82 Ca 0.10 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1tbc n THR 82 Cb 0.42 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.56 1tbc n THR 82 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1tbc n GLY 83 N 2.69 -0.69 2.23 3.38 0.00 -1.25 -4.46 105.19 107.10 1tbc n GLY 83 Ca -0.00 0.25 -0.27 0.00 0.00 0.00 0.00 46.02 46.00 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 2.39 0.09 1.61 -0.04 -1.26 -4.46 135.00 133.34 1tbc n PRO 84 Ca 0.00 -3.12 0.12 0.00 -0.04 0.00 0.00 63.50 60.47 1tbc n PRO 84 Cb 0.00 -2.21 0.27 0.00 -0.04 0.00 0.00 33.50 31.53 1tbc n PRO 84 CO 0.00 0.00 0.00 1.57 -0.04 0.00 0.00 175.50 177.03 1tbc h LYS 85 N 1.34 0.00 0.00 0.54 2.10 -1.87 -3.51 116.57 115.17 1tbc h LYS 85 Ca 0.62 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.27 1tbc h LYS 85 Cb 2.16 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.49 1tbc h LYS 85 CO 1.25 0.00 0.00 0.39 -2.00 0.00 0.00 179.45 179.09