#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 -4.80 0.00 1.45 2.03 -1.22 -4.96 116.55 109.06 1tbc n ASP 2 Ca 0.00 -1.15 0.00 0.00 0.52 0.00 0.00 54.79 54.16 1tbc n ASP 2 Cb 0.00 -2.58 0.00 0.00 -0.72 0.00 0.00 41.12 37.82 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 -4.60 0.00 0.08 -0.67 -0.04 -1.26 -4.72 135.00 123.79 1tbc n PRO 3 Ca -0.10 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.25 1tbc n PRO 3 Cb 0.58 -0.06 -0.08 0.00 -0.04 0.00 0.00 33.50 33.90 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 0.82 0.00 0.52 2.07 -1.92 -3.47 116.25 114.26 1tbc h VAL 4 Ca 0.00 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.55 1tbc h VAL 4 Cb 0.00 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1tbc h VAL 4 CO 0.00 0.19 0.00 0.47 0.02 0.00 0.00 177.57 178.25 1tbc n ASP 5 N -4.98 0.00 -3.60 0.57 8.00 -1.26 -5.13 116.55 110.14 1tbc n ASP 5 Ca -0.08 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.28 1tbc n ASP 5 Cb 0.26 0.28 0.07 0.00 -0.02 0.00 0.00 41.12 41.71 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 -2.05 0.22 -0.01 -0.24 -0.04 -1.26 -4.21 135.00 127.41 1tbc n PRO 6 Ca 0.00 -1.71 -0.12 0.00 -0.04 0.00 0.00 63.50 61.62 1tbc n PRO 6 Cb 0.00 -0.39 -0.10 0.00 -0.04 0.00 0.00 33.50 32.97 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 -0.33 -0.06 0.00 3.54 2.35 -1.82 -3.35 115.58 115.91 1tbc h ASN 7 Ca -0.20 -0.57 0.00 0.00 -0.55 0.00 0.00 56.30 54.98 1tbc h ASN 7 Cb 0.76 0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1tbc h ASN 7 CO 0.22 0.58 -0.22 2.30 -1.65 0.00 0.00 177.43 178.66 1tbc n ILE 8 N -4.81 0.64 -3.38 2.81 -0.00 -1.26 -4.90 119.36 108.46 1tbc n ILE 8 Ca -0.08 -0.75 -0.20 0.00 -0.00 0.00 0.00 62.75 61.72 1tbc n ILE 8 Cb 0.31 0.38 0.01 0.00 -0.00 0.00 0.00 39.64 40.34 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 -0.46 -1.75 -0.75 6.28 1.02 -1.26 -4.86 120.64 118.86 1tbc n GLU 9 Ca 0.05 1.35 -0.11 0.00 -0.02 0.00 0.00 57.16 58.43 1tbc n GLU 9 Cb 0.60 -3.65 0.15 0.00 -0.02 0.00 0.00 31.44 28.52 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 -1.37 2.16 -1.75 3.49 -0.04 -1.26 -4.41 135.00 131.82 1tbc n PRO 10 Ca -0.11 -1.96 -0.35 0.00 -0.04 0.00 0.00 63.50 61.05 1tbc n PRO 10 Cb 0.61 -1.81 0.05 0.00 -0.04 0.00 0.00 33.50 32.31 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 -0.36 3.10 -3.23 0.54 7.02 -1.26 -4.69 117.44 118.56 1tbc n TRP 11 Ca 0.34 -2.68 -0.24 0.00 -1.02 0.00 0.00 57.50 53.91 1tbc n TRP 11 Cb 1.18 -1.11 -0.06 0.00 -2.42 0.00 0.00 31.31 28.90 1tbc n TRP 11 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1tbc n ASN 12 N -0.70 1.72 -4.99 -0.99 3.02 -1.09 -4.14 115.26 108.08 1tbc n ASN 12 Ca 0.55 -3.06 -0.18 0.00 -0.03 0.00 0.00 54.58 51.87 1tbc n ASN 12 Cb 0.51 -0.64 0.00 0.00 -0.61 0.00 0.00 39.78 39.05 1tbc n ASN 12 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1tbc s HIS 13 N -2.00 2.85 -0.32 3.10 3.76 0.40 -4.84 115.29 118.24 1tbc s HIS 13 Ca 0.39 -0.38 0.20 0.00 -0.15 0.00 0.00 55.06 55.12 1tbc s HIS 13 Cb 0.21 -2.27 0.22 0.00 1.11 0.00 0.00 32.58 31.84 1tbc s HIS 13 CO -0.08 -0.30 1.52 -1.00 -0.85 0.00 0.00 174.74 174.03 1tbc h PRO 14 N 0.74 0.00 0.00 8.40 0.13 -1.83 -3.29 132.00 136.15 1tbc h PRO 14 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1tbc h PRO 14 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 1tbc h PRO 14 CO 0.48 0.20 0.00 0.41 -0.23 0.00 0.00 178.00 178.86 1tbc n GLY 15 N 1.15 0.42 0.01 1.56 0.00 -1.26 -1.26 105.19 105.81 1tbc n GLY 15 Ca 0.03 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.06 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 1.92 0.00 0.08 1.61 2.88 -1.26 -4.75 113.62 114.10 1tbc n SER 16 Ca 0.00 -1.01 0.00 0.00 -1.33 0.00 0.00 58.87 56.53 1tbc n SER 16 Cb 0.16 -0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.62 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 -3.39 117.38 117.29 1tbc n GLN 17 Ca 0.00 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 57.08 1tbc n GLN 17 Cb 0.50 0.00 0.42 0.00 1.02 0.00 0.00 30.24 32.19 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 -3.03 0.16 0.00 -1.09 -0.04 -1.26 -0.64 135.00 129.09 1tbc n PRO 18 Ca 0.00 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 1tbc n PRO 18 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.96 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 -1.37 0.11 0.00 0.54 5.02 -1.26 -4.54 118.16 116.66 1tbc n LYS 19 Ca 0.07 -0.50 0.00 0.00 -2.02 0.00 0.00 58.31 55.86 1tbc n LYS 19 Cb 0.17 -0.77 0.00 0.00 -0.02 0.00 0.00 35.03 34.41 1tbc n LYS 19 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1tbc n THR 20 N -0.08 0.00 -1.28 -0.18 -1.04 -1.12 -4.90 114.28 105.67 1tbc n THR 20 Ca 0.00 0.00 -0.42 0.00 -2.04 0.00 0.00 64.05 61.59 1tbc n THR 20 Cb 0.19 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.65 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 -1.39 3.44 -4.11 2.41 0.00 0.18 -4.45 120.51 116.60 1tbc n ALA 21 Ca 0.00 -3.36 -0.35 0.00 0.00 0.00 0.00 53.44 49.73 1tbc n ALA 21 Cb 0.00 -3.62 -0.07 0.00 0.00 0.00 0.00 19.45 15.76 1tbc n ALA 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tbc n ASN 23 N -2.10 0.00 0.00 0.00 0.23 -1.26 -4.98 115.26 107.15 1tbc n ASN 23 Ca 0.02 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.07 1tbc n ASN 23 Cb 0.44 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.14 1tbc n ASN 23 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1tbc n ARG 24 N 0.00 0.00 -3.16 -3.83 1.74 -1.26 -4.91 116.66 105.24 1tbc n ARG 24 Ca 0.00 0.30 -0.15 0.00 -0.77 0.00 0.00 57.85 57.23 1tbc n ARG 24 Cb 0.00 -1.16 0.05 0.00 -1.02 0.00 0.00 32.46 30.34 1tbc n ARG 24 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1tbc n HIS 26 N -3.89 0.00 0.17 0.00 -0.00 -1.26 -4.93 115.22 105.30 1tbc n HIS 26 Ca -0.04 0.00 0.19 0.00 -0.00 0.00 0.00 57.72 57.86 1tbc n HIS 26 Cb 0.56 0.00 0.78 0.00 -0.00 0.00 0.00 29.99 31.32 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 0.39 0.00 0.00 3.64 -1.94 -3.35 116.57 115.32 1tbc h LYS 28 Ca 0.13 -0.08 -0.12 0.00 -1.27 0.00 0.00 60.65 59.31 1tbc h LYS 28 Cb 0.90 -0.06 -0.19 0.00 -0.41 0.00 0.00 32.23 32.46 1tbc h LYS 28 CO -0.00 0.44 -0.55 0.36 -2.27 0.00 0.00 179.45 177.43 1tbc n LYS 29 N -4.31 0.00 0.10 1.90 0.00 -0.33 -4.39 118.16 111.13 1tbc n LYS 29 Ca 0.01 -1.24 -0.13 0.00 -0.00 0.00 0.00 58.31 56.95 1tbc n LYS 29 Cb 0.23 0.15 -0.06 0.00 -0.00 0.00 0.00 35.03 35.35 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 0.76 -1.44 -1.07 0.00 4.11 -1.26 -4.95 117.16 113.31 1tbc n TYR 32 Ca -0.05 -1.95 -0.03 0.00 -0.00 0.00 0.00 57.90 55.87 1tbc n TYR 32 Cb 0.75 1.15 -0.01 0.00 -0.00 0.00 0.00 39.34 41.23 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 -0.97 -0.00 -3.15 -3.48 8.25 -1.26 -3.83 115.22 110.77 1tbc n HIS 33 Ca -0.07 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.17 1tbc n HIS 33 Cb 0.85 -2.17 0.02 0.00 1.12 0.00 0.00 29.99 29.82 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 -0.18 0.65 -3.15 0.00 1.13 -1.25 -4.84 117.38 109.74 1tbc n GLN 35 Ca 0.02 0.15 -0.10 0.00 -1.94 0.00 0.00 57.00 55.13 1tbc n GLN 35 Cb 0.55 -1.68 0.01 0.00 0.11 0.00 0.00 30.24 29.23 1tbc n GLN 35 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 1tbc n VAL 36 N -2.88 -8.80 -3.62 5.09 0.31 -1.26 -3.48 118.33 103.68 1tbc n VAL 36 Ca -0.22 0.17 -0.22 0.00 -0.01 0.00 0.00 64.34 64.06 1tbc n VAL 36 Cb 1.06 -6.10 0.01 0.00 -0.91 0.00 0.00 33.84 27.89 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 -2.63 0.00 -0.26 0.00 -1.74 -1.23 -4.61 117.46 106.99 1tbc n PHE 38 Ca -0.13 0.00 0.01 0.00 -0.56 0.00 0.00 57.45 56.77 1tbc n PHE 38 Cb 0.38 0.00 0.23 0.00 1.52 0.00 0.00 39.48 41.61 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 1.17 -3.75 1.97 3.07 -1.90 -3.31 117.51 114.76 1tbc h ILE 39 Ca 0.00 -0.37 -0.68 0.00 1.55 0.00 0.00 64.86 65.37 1tbc h ILE 39 Cb 0.00 0.01 -0.19 0.00 -0.27 0.00 0.00 36.82 36.37 1tbc h ILE 39 CO 0.00 0.20 -0.75 -0.89 -1.05 0.00 0.00 178.15 175.65 1tbc s THR 40 N -5.90 3.22 -1.30 0.16 2.01 -1.26 -3.39 115.64 109.17 1tbc s THR 40 Ca -0.11 -1.06 0.22 0.00 0.31 0.00 0.00 61.69 61.05 1tbc s THR 40 Cb 0.18 -2.41 0.33 0.00 0.01 0.00 0.00 72.50 70.61 1tbc s THR 40 CO 0.79 0.31 1.71 0.29 -0.69 0.00 0.00 174.62 177.03 1tbc n LYS 41 N 1.36 0.22 0.00 4.92 4.76 -1.26 -2.74 118.16 125.42 1tbc n LYS 41 Ca -0.15 0.09 0.12 0.00 -2.87 0.00 0.00 58.31 55.50 1tbc n LYS 41 Cb 0.52 -1.50 0.66 0.00 -1.84 0.00 0.00 35.03 32.87 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 0.64 -1.00 2.83 0.72 0.00 -1.26 -4.88 105.19 102.24 1tbc n GLY 42 Ca 0.09 -0.13 -0.18 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 -1.20 -2.62 -2.07 0.99 4.77 -1.11 -2.47 117.00 113.30 1tbc n LEU 43 Ca 0.14 -0.28 -0.16 0.00 -0.03 0.00 0.00 56.01 55.68 1tbc n LEU 43 Cb 0.16 -2.41 -0.03 0.00 -2.33 0.00 0.00 43.42 38.81 1tbc n LEU 43 CO 0.17 0.27 -0.19 0.61 -1.33 0.00 0.00 177.39 176.93 1tbc n GLY 44 N -1.44 0.27 0.08 -0.72 0.00 -1.26 -4.59 105.19 97.53 1tbc n GLY 44 Ca -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.83 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 1.19 0.00 -0.61 3.07 -1.78 -3.45 117.51 115.93 1tbc h ILE 45 Ca -0.37 -0.91 -0.01 0.00 1.55 0.00 0.00 64.86 65.12 1tbc h ILE 45 Cb 1.21 1.78 -0.01 0.00 -0.27 0.00 0.00 36.82 39.53 1tbc h ILE 45 CO 0.47 0.22 -0.03 -0.24 -1.05 0.00 0.00 178.15 177.53 1tbc n SER 46 N -4.94 -0.10 0.11 2.16 2.88 -1.26 -5.00 113.62 107.48 1tbc n SER 46 Ca -0.08 -0.27 -0.02 0.00 -1.33 0.00 0.00 58.87 57.16 1tbc n SER 46 Cb 0.22 0.03 -0.00 0.00 -0.75 0.00 0.00 64.21 63.71 1tbc n SER 46 CO 0.00 0.00 0.00 0.10 -1.23 0.00 0.00 175.04 173.91 1tbc h TYR 47 N 0.00 0.00 0.00 0.66 -0.00 -1.93 -3.46 116.97 112.24 1tbc h TYR 47 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.67 1tbc h TYR 47 Cb 0.44 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.17 1tbc h TYR 47 CO -0.04 0.73 0.00 0.41 -0.00 0.00 0.00 178.16 179.26 1tbc n GLY 48 N 1.12 -0.14 3.69 0.10 0.00 -1.26 -5.11 105.19 103.60 1tbc n GLY 48 Ca 0.01 -0.29 -0.42 0.00 0.00 0.00 0.00 46.02 45.31 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 4.28 0.31 1.61 3.52 -1.26 -4.90 118.95 122.51 1tbc s ARG 49 Ca 0.00 2.04 0.00 0.00 -0.13 0.00 0.00 55.73 57.64 1tbc s ARG 49 Cb 0.00 -3.50 0.50 0.00 -1.56 0.00 0.00 34.95 30.39 1tbc s ARG 49 CO 0.00 -0.56 1.92 1.57 -0.81 0.00 0.00 175.30 177.41 1tbc h LYS 50 N 7.67 0.85 0.00 5.12 -0.00 -2.02 -3.48 116.57 124.70 1tbc h LYS 50 Ca -0.39 -0.11 0.00 0.00 -0.00 0.00 0.00 60.65 60.15 1tbc h LYS 50 Cb 1.19 -0.16 0.00 0.00 -0.00 0.00 0.00 32.23 33.26 1tbc h LYS 50 CO 0.90 0.66 0.00 0.36 -0.00 0.00 0.00 179.45 181.37 1tbc n LYS 51 N -4.35 0.00 0.13 0.07 2.85 -1.26 -4.98 118.16 110.61 1tbc n LYS 51 Ca 0.05 0.00 0.03 0.00 -1.05 0.00 0.00 58.31 57.34 1tbc n LYS 51 Cb 0.13 0.00 0.02 0.00 -0.65 0.00 0.00 35.03 34.53 1tbc n LYS 51 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1tbc h ARG 52 N 0.00 0.00 0.00 -1.58 -0.00 -2.01 -3.47 114.38 107.32 1tbc h ARG 52 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1tbc h ARG 52 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29.97 29.97 1tbc h ARG 52 CO 0.00 0.42 0.00 -2.13 0.00 0.00 0.00 179.97 178.26 1tbc n ARG 53 N -3.14 0.00 -0.07 0.04 0.00 -1.26 -4.80 116.66 107.43 1tbc n ARG 53 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 57.76 1tbc n ARG 53 Cb 0.73 -3.83 -0.02 0.00 0.00 0.00 0.00 32.46 29.34 1tbc n ARG 53 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.63 177.07 1tbc h GLN 54 N 0.78 0.28 -4.89 -0.14 3.07 -1.98 -3.45 115.11 108.79 1tbc h GLN 54 Ca 0.00 -0.02 -0.08 0.00 0.09 0.00 0.00 58.65 58.65 1tbc h GLN 54 Cb 0.00 -0.06 -0.02 0.00 0.08 0.00 0.00 27.48 27.48 1tbc h GLN 54 CO 0.00 0.19 -0.10 0.54 0.09 0.00 0.00 178.83 179.54 1tbc n ARG 55 N -4.96 -2.78 -1.48 0.06 1.74 -1.26 -4.50 116.66 103.48 1tbc n ARG 55 Ca -0.02 0.12 -0.01 0.00 -0.77 0.00 0.00 57.85 57.17 1tbc n ARG 55 Cb 0.05 -4.65 0.02 0.00 -1.02 0.00 0.00 32.46 26.87 1tbc n ARG 55 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 1tbc n ARG 56 N -2.64 0.30 -0.28 5.56 1.85 -1.26 -5.02 116.66 115.16 1tbc n ARG 56 Ca -0.02 -0.38 0.05 0.00 -1.00 0.00 0.00 57.85 56.51 1tbc n ARG 56 Cb 0.52 0.26 0.20 0.00 -1.05 0.00 0.00 32.46 32.39 1tbc n ARG 56 CO 0.00 0.00 0.00 -0.09 -0.01 0.00 0.00 177.63 177.53 1tbc h ARG 57 N 0.22 0.60 0.00 2.89 9.65 -1.96 0.96 114.38 126.75 1tbc h ARG 57 Ca -0.16 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.68 1tbc h ARG 57 Cb 1.00 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.44 1tbc h ARG 57 CO -0.07 0.40 0.00 -1.00 2.80 0.00 0.00 179.97 182.09 1tbc h PRO 58 N 0.62 0.00 -5.81 0.20 0.13 -1.97 -3.42 132.00 121.75 1tbc h PRO 58 Ca 0.43 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.96 1tbc h PRO 58 Cb 0.56 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.59 1tbc h PRO 58 CO -0.34 0.00 0.43 -1.12 -0.23 0.00 0.00 178.00 176.75 1tbc s SER 59 N -4.64 6.70 -0.10 1.44 0.01 0.33 -4.87 113.70 112.57 1tbc s SER 59 Ca 0.02 0.72 0.18 0.00 1.31 0.00 0.00 55.95 58.18 1tbc s SER 59 Cb 0.09 -2.42 0.35 0.00 0.21 0.00 0.00 66.02 64.25 1tbc s SER 59 CO 0.40 -0.62 1.17 0.00 0.41 0.00 0.00 173.24 174.60 1tbc n GLN 60 N 6.23 0.57 -2.51 12.44 6.02 -1.26 -4.88 117.38 133.99 1tbc n GLN 60 Ca 0.04 -2.02 -0.40 0.00 -0.01 0.00 0.00 57.00 54.61 1tbc n GLN 60 Cb 0.48 -0.20 -0.03 0.00 1.02 0.00 0.00 30.24 31.51 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 -2.08 1.20 -1.63 1.08 0.00 -1.26 -3.69 107.32 100.94 1tbc s GLY 61 Ca 0.22 -2.30 0.00 0.00 0.00 0.00 0.00 44.72 42.64 1tbc s GLY 61 CO -0.10 2.78 0.00 0.61 0.00 0.00 0.00 173.10 176.40 1tbc n GLY 62 N 6.63 -0.21 0.12 0.20 0.00 -1.26 -4.79 105.19 105.88 1tbc n GLY 62 Ca 0.36 -0.10 -0.19 0.00 0.00 0.00 0.00 46.02 46.10 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 0.34 -6.35 1.61 1.08 -1.75 -3.33 115.11 106.72 1tbc h GLN 63 Ca -0.44 -0.59 -0.47 0.00 -1.45 0.00 0.00 58.65 55.71 1tbc h GLN 63 Cb 1.32 0.22 0.02 0.00 -0.05 0.00 0.00 27.48 28.99 1tbc h GLN 63 CO 0.53 1.27 -0.91 2.41 -0.95 0.00 0.00 178.83 181.17 1tbc n THR 64 N -3.57 -4.48 -0.79 -0.54 -1.04 -1.24 -0.46 114.28 102.16 1tbc n THR 64 Ca -0.12 -0.72 -0.30 0.00 -2.04 0.00 0.00 64.05 60.87 1tbc n THR 64 Cb 1.05 -3.53 0.25 0.00 -1.82 0.00 0.00 70.33 66.29 1tbc n THR 64 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1tbc s HIS 65 N -3.69 0.27 0.08 -1.42 3.76 -1.26 -4.36 115.29 108.67 1tbc s HIS 65 Ca 0.24 0.61 0.00 0.00 -0.15 0.00 0.00 55.06 55.76 1tbc s HIS 65 Cb -0.09 -3.21 0.00 0.00 1.11 0.00 0.00 32.58 30.39 1tbc s HIS 65 CO 0.87 -4.22 0.00 1.04 -0.85 0.00 0.00 174.74 171.58 1tbc n GLN 66 N -5.06 0.00 0.10 1.40 3.00 -1.26 -4.63 117.38 110.93 1tbc n GLN 66 Ca 0.11 0.00 -0.23 0.00 -0.01 0.00 0.00 57.00 56.88 1tbc n GLN 66 Cb 0.59 -0.36 -0.15 0.00 0.00 0.00 0.00 30.24 30.31 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 0.67 0.08 1.08 3.58 -1.94 -3.05 116.42 116.85 1tbc h ASP 67 Ca 0.00 -0.93 -0.25 0.00 0.42 0.00 0.00 57.03 56.26 1tbc h ASP 67 Cb 0.34 -0.22 0.02 0.00 1.72 0.00 0.00 39.33 41.19 1tbc h ASP 67 CO 0.00 1.59 -1.00 1.55 -2.88 0.00 0.00 179.24 178.49 1tbc h PRO 68 N -0.08 0.64 -1.01 0.28 0.13 -1.92 -3.38 132.00 126.66 1tbc h PRO 68 Ca -0.22 -0.67 -0.48 0.00 -0.87 0.00 0.00 66.00 63.76 1tbc h PRO 68 Cb 1.94 0.19 -0.42 0.00 0.13 0.00 0.00 31.00 32.84 1tbc h PRO 68 CO 0.21 1.27 -0.91 0.44 -0.23 0.00 0.00 178.00 178.78 1tbc n ILE 69 N -3.83 1.99 0.24 -3.56 -0.00 -1.26 -4.82 119.36 108.11 1tbc n ILE 69 Ca -0.10 -4.04 0.08 0.00 -0.00 0.00 0.00 62.75 58.69 1tbc n ILE 69 Cb 0.86 -0.45 0.36 0.00 -0.00 0.00 0.00 39.64 40.41 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 -0.50 0.09 0.10 6.28 -0.04 -1.15 -2.68 135.00 137.10 1tbc n PRO 70 Ca 0.30 0.48 0.05 0.00 -0.04 0.00 0.00 63.50 64.28 1tbc n PRO 70 Cb 0.81 -1.73 0.47 0.00 -0.04 0.00 0.00 33.50 33.01 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 0.32 -2.85 0.54 2.10 -1.88 -3.46 116.57 111.34 1tbc h LYS 71 Ca 0.00 -0.03 0.04 0.00 -2.00 0.00 0.00 60.65 58.66 1tbc h LYS 71 Cb 0.13 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 31.39 1tbc h LYS 71 CO 0.00 0.27 0.37 1.14 -2.00 0.00 0.00 179.45 179.23 1tbc s GLN 72 N -5.18 1.93 0.57 0.07 1.03 -1.09 -5.00 119.66 111.98 1tbc s GLN 72 Ca -0.07 -1.23 0.28 0.00 0.04 0.00 0.00 55.36 54.38 1tbc s GLN 72 Cb 0.17 0.54 1.71 0.00 0.03 0.00 0.00 33.01 35.46 1tbc s GLN 72 CO 0.72 -0.90 2.21 -1.00 -2.54 0.00 0.00 175.29 173.78 1tbc h PRO 73 N 2.00 0.00 0.00 9.60 0.13 -1.90 -3.47 132.00 138.36 1tbc h PRO 73 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1tbc h PRO 73 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1tbc h PRO 73 CO 0.39 0.03 0.00 -1.13 -0.23 0.00 0.00 178.00 177.05 1tbc n SER 74 N -3.86 0.00 -0.44 1.44 3.41 -1.26 -4.02 113.62 108.89 1tbc n SER 74 Ca -0.03 0.00 0.12 0.00 -0.26 0.00 0.00 58.87 58.70 1tbc n SER 74 Cb 0.11 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.24 1tbc n SER 74 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1tbc n SER 75 N 4.27 1.70 0.12 4.04 3.41 -1.26 -4.19 113.62 121.72 1tbc n SER 75 Ca 0.00 -1.32 -0.22 0.00 -0.26 0.00 0.00 58.87 57.07 1tbc n SER 75 Cb 0.00 0.29 -0.14 0.00 -0.26 0.00 0.00 64.21 64.10 1tbc n SER 75 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1tbc h GLN 76 N 2.14 0.51 0.00 4.33 7.50 -1.78 -0.01 115.11 127.81 1tbc h GLN 76 Ca 0.00 -0.80 0.00 0.00 0.50 0.00 0.00 58.65 58.35 1tbc h GLN 76 Cb 0.67 0.29 0.00 0.00 0.05 0.00 0.00 27.48 28.48 1tbc h GLN 76 CO 0.00 1.37 0.00 -0.35 -1.50 0.00 0.00 178.83 178.35 1tbc n PRO 77 N -3.70 0.83 0.00 1.46 -0.04 -1.26 0.20 135.00 132.48 1tbc n PRO 77 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 1tbc n PRO 77 Cb 1.05 -1.10 0.00 0.00 -0.04 0.00 0.00 33.50 33.41 1tbc n PRO 77 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1tbc n ARG 78 N -0.60 0.00 0.00 0.54 1.74 -1.18 -4.83 116.66 112.33 1tbc n ARG 78 Ca 0.04 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 1tbc n ARG 78 Cb 0.02 -0.65 0.00 0.00 -1.02 0.00 0.00 32.46 30.81 1tbc n ARG 78 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1tbc n GLY 79 N 3.13 1.16 3.92 -0.13 0.00 -0.40 -4.73 105.19 108.14 1tbc n GLY 79 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.51 2.84 -0.91 1.61 1.11 -0.15 -4.85 116.67 114.81 1tbc s ASP 80 Ca 0.00 0.21 -0.24 0.00 0.18 0.00 0.00 52.55 52.70 1tbc s ASP 80 Cb 0.00 -0.20 -0.16 0.00 1.07 0.00 0.00 42.92 43.63 1tbc s ASP 80 CO 0.00 -2.90 1.91 -0.81 1.18 0.00 0.00 175.17 174.56 1tbc n PRO 81 N -3.87 1.20 0.00 8.23 -0.04 -1.26 -4.65 135.00 134.61 1tbc n PRO 81 Ca 0.16 -2.01 0.00 0.00 -0.04 0.00 0.00 63.50 61.61 1tbc n PRO 81 Cb 0.59 -3.36 0.00 0.00 -0.04 0.00 0.00 33.50 30.69 1tbc n PRO 81 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1tbc n THR 82 N 7.31 0.00 -0.01 0.52 -2.24 -1.26 -4.67 114.28 113.92 1tbc n THR 82 Ca 0.46 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 62.23 1tbc n THR 82 Cb 0.44 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.67 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 2.70 -0.37 2.46 3.38 0.00 -0.39 -4.60 105.19 108.38 1tbc n GLY 83 Ca 0.00 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.88 3.89 -1.14 1.61 -0.04 -1.26 -4.79 135.00 130.40 1tbc n PRO 84 Ca -0.02 -3.04 -0.28 0.00 -0.04 0.00 0.00 63.50 60.11 1tbc n PRO 84 Cb 0.09 -2.48 -0.07 0.00 -0.04 0.00 0.00 33.50 30.99 1tbc n PRO 84 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 1tbc n LYS 85 N 1.57 2.96 0.00 0.54 2.85 -1.25 -4.14 118.16 120.68 1tbc n LYS 85 Ca 0.59 -1.71 0.15 0.00 -1.05 0.00 0.00 58.31 56.29 1tbc n LYS 85 Cb 0.35 -2.49 0.73 0.00 -0.65 0.00 0.00 35.03 32.97 1tbc n LYS 85 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50