#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ner n SER 2 N 0.00 0.00 -0.18 0.00 7.64 -1.26 -4.65 113.62 115.18 1ner n SER 2 Ca 0.00 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 59.86 1ner n SER 2 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1ner n SER 2 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1ner n ASN 3 N 3.19 -3.84 -3.11 6.43 4.13 -1.26 -4.89 115.26 115.91 1ner n ASN 3 Ca 0.00 0.04 0.00 0.00 1.68 0.00 0.00 54.58 56.30 1ner n ASN 3 Cb 0.00 -2.55 0.00 0.00 -1.54 0.00 0.00 39.78 35.69 1ner n ASN 3 CO 0.00 0.00 0.00 -1.84 0.28 0.00 0.00 177.26 175.70 1ner n GLU 4 N 0.32 -0.95 -4.07 3.52 0.28 -1.26 -3.89 120.64 114.59 1ner n GLU 4 Ca -0.02 0.00 -0.32 0.00 -0.16 0.00 0.00 57.16 56.66 1ner n GLU 4 Cb 0.34 0.00 -0.01 0.00 1.43 0.00 0.00 31.44 33.20 1ner n GLU 4 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1ner n LYS 5 N -1.42 -3.96 0.00 3.44 4.76 -1.26 -4.93 118.16 114.79 1ner n LYS 5 Ca 0.00 0.45 0.00 0.00 -2.87 0.00 0.00 58.31 55.89 1ner n LYS 5 Cb 0.00 -5.13 0.00 0.00 -1.84 0.00 0.00 35.03 28.06 1ner n LYS 5 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ner n ALA 6 N -4.48 0.00 -0.05 7.82 0.00 -1.25 -4.94 120.51 117.61 1ner n ALA 6 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ner n ALA 6 Cb 0.54 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.85 1ner n ALA 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1ner n ARG 7 N 0.00 0.87 0.00 0.00 5.12 -1.26 -4.93 116.66 116.46 1ner n ARG 7 Ca 0.00 -0.09 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 1ner n ARG 7 Cb 0.00 -1.45 0.00 0.00 -1.16 0.00 0.00 32.46 29.85 1ner n ARG 7 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 1ner n ASP 8 N -2.40 0.00 -4.61 0.55 8.00 -1.26 -4.90 116.55 111.94 1ner n ASP 8 Ca -0.16 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 54.91 1ner n ASP 8 Cb 0.78 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.85 1ner n ASP 8 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 1ner s TRP 9 N 0.00 1.92 1.02 1.24 0.52 -1.22 -4.96 118.94 117.46 1ner s TRP 9 Ca 0.00 0.60 -0.18 0.00 0.02 0.00 0.00 56.10 56.53 1ner s TRP 9 Cb 0.00 -4.12 -0.04 0.00 -1.15 0.00 0.00 33.47 28.16 1ner s TRP 9 CO 0.00 -2.89 -0.39 0.72 0.02 0.00 0.00 176.95 174.40 1ner n HIS 10 N 9.71 -2.32 0.19 -1.98 8.25 -1.26 -4.46 115.22 123.35 1ner n HIS 10 Ca 0.21 0.23 0.15 0.00 -0.26 0.00 0.00 57.72 58.05 1ner n HIS 10 Cb 0.46 -1.56 0.76 0.00 1.12 0.00 0.00 29.99 30.78 1ner n HIS 10 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1ner h ARG 11 N -1.45 0.00 0.00 -0.41 1.12 -2.00 0.36 114.38 112.00 1ner h ARG 11 Ca -0.45 0.00 -0.18 0.00 -1.11 0.00 0.00 59.98 58.23 1ner h ARG 11 Cb 1.33 0.00 -0.03 0.00 -0.01 0.00 0.00 29.97 31.26 1ner h ARG 11 CO 0.30 0.00 -1.20 0.00 -3.11 0.00 0.00 179.97 175.96 1ner h ALA 12 N 1.86 0.64 0.00 2.80 0.00 -1.99 -3.14 119.26 119.43 1ner h ALA 12 Ca 0.08 -0.88 -0.03 0.00 0.00 0.00 0.00 54.91 54.08 1ner h ALA 12 Cb 0.38 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ner h ALA 12 CO -0.00 1.03 -0.13 -0.44 0.00 0.00 0.00 179.25 179.71 1ner h ASP 13 N 0.00 0.00 0.10 0.00 5.19 -1.21 0.66 116.42 121.16 1ner h ASP 13 Ca -0.13 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.28 1ner h ASP 13 Cb 1.65 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.16 1ner h ASP 13 CO 0.07 0.13 -0.05 0.58 -3.12 0.00 0.00 179.24 176.85 1ner h VAL 14 N 0.00 0.23 -0.06 -1.35 2.07 -1.40 -2.79 116.25 112.95 1ner h VAL 14 Ca -0.00 -1.05 -0.07 0.00 0.82 0.00 0.00 66.70 66.40 1ner h VAL 14 Cb 0.53 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1ner h VAL 14 CO 0.02 0.07 -0.24 0.40 0.02 0.00 0.00 177.57 177.83 1ner h ILE 15 N -1.02 1.44 -0.29 4.57 2.04 -1.49 -0.50 117.51 122.26 1ner h ILE 15 Ca -0.01 -1.66 0.05 0.00 1.00 0.00 0.00 64.86 64.24 1ner h ILE 15 Cb 0.22 2.34 -0.05 0.00 -0.74 0.00 0.00 36.82 38.60 1ner h ILE 15 CO 0.02 0.47 -0.01 0.00 0.00 0.00 0.00 178.15 178.63 1ner h ALA 16 N 0.42 0.25 0.21 1.87 0.00 0.16 0.95 119.26 123.12 1ner h ALA 16 Ca -0.01 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ner h ALA 16 Cb 0.89 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1ner h ALA 16 CO 0.05 -0.42 -0.10 0.78 0.00 0.00 0.00 179.25 179.56 1ner h GLY 17 N 0.08 -0.30 0.85 0.00 0.00 -1.53 -1.94 103.07 100.22 1ner h GLY 17 Ca 0.14 0.11 -0.01 0.00 0.00 0.00 0.00 47.33 47.57 1ner h GLY 17 CO -0.24 -0.11 -0.05 1.41 0.00 0.00 0.00 176.54 177.55 1ner h LEU 18 N -0.53 -0.13 -0.74 3.11 3.38 -0.86 -1.63 115.31 117.90 1ner h LEU 18 Ca -0.03 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1ner h LEU 18 Cb 0.40 0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.18 1ner h LEU 18 CO 0.05 0.05 0.07 1.17 0.09 0.00 0.00 178.44 179.87 1ner n LYS 19 N -5.09 0.07 0.23 1.13 4.81 0.33 -1.24 118.16 118.41 1ner n LYS 19 Ca -0.08 0.55 0.14 0.00 -0.87 0.00 0.00 58.31 58.04 1ner n LYS 19 Cb 0.15 -1.81 0.79 0.00 0.02 0.00 0.00 35.03 34.18 1ner n LYS 19 CO 0.00 0.00 0.00 1.57 1.17 0.00 0.00 177.40 180.14 1ner h LYS 20 N 0.00 0.00 0.00 1.64 2.10 -0.46 -3.35 116.57 116.50 1ner h LYS 20 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1ner h LYS 20 Cb 0.14 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.47 1ner h LYS 20 CO 0.00 0.00 0.00 0.54 -2.00 0.00 0.00 179.45 177.99 1ner n ARG 21 N -4.08 0.00 -2.76 0.07 1.74 -0.37 -5.00 116.66 106.26 1ner n ARG 21 Ca -0.01 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.98 1ner n ARG 21 Cb 0.20 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 31.72 1ner n ARG 21 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1ner n LYS 22 N 0.00 1.11 -4.31 5.56 5.02 -1.25 -5.13 118.16 119.15 1ner n LYS 22 Ca 0.00 -2.24 -0.23 0.00 -2.02 0.00 0.00 58.31 53.82 1ner n LYS 22 Cb 0.00 -0.70 -0.13 0.00 -0.02 0.00 0.00 35.03 34.18 1ner n LYS 22 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ner s LEU 23 N -2.82 2.28 -0.17 -0.35 1.43 -1.25 -5.02 118.68 112.77 1ner s LEU 23 Ca 0.25 -0.65 -0.08 0.00 -1.03 0.00 0.00 54.13 52.62 1ner s LEU 23 Cb 0.37 -0.84 0.07 0.00 0.03 0.00 0.00 46.19 45.82 1ner s LEU 23 CO -0.06 0.05 0.39 -0.94 0.23 0.00 0.00 176.35 176.02 1ner s SER 24 N -1.77 -0.32 0.37 2.29 1.04 -1.26 -3.63 113.70 110.42 1ner s SER 24 Ca 0.05 0.87 0.09 0.00 0.48 0.00 0.00 55.95 57.44 1ner s SER 24 Cb -0.10 0.93 0.51 0.00 0.10 0.00 0.00 66.02 67.46 1ner s SER 24 CO 0.04 -0.21 1.15 -0.07 0.98 0.00 0.00 173.24 175.13 1ner h LEU 25 N 7.59 0.00 0.12 2.42 3.38 -1.98 1.04 115.31 127.88 1ner h LEU 25 Ca -0.28 0.00 -0.30 0.00 0.09 0.00 0.00 57.88 57.40 1ner h LEU 25 Cb 1.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.89 1ner h LEU 25 CO 0.23 0.00 -1.45 0.77 0.09 0.00 0.00 178.44 178.07 1ner h SER 26 N 0.00 0.38 0.12 -0.43 4.64 -1.96 -2.87 113.55 113.43 1ner h SER 26 Ca 0.00 -0.50 -0.17 0.00 -0.47 0.00 0.00 61.79 60.66 1ner h SER 26 Cb 0.98 -0.12 0.02 0.00 -0.31 0.00 0.00 62.40 62.97 1ner h SER 26 CO 0.00 1.41 -0.75 0.00 -0.87 0.00 0.00 176.83 176.62 1ner h ALA 27 N 0.53 -0.05 -0.08 5.18 0.00 0.69 -3.14 119.26 122.39 1ner h ALA 27 Ca -0.21 -0.71 -0.04 0.00 0.00 0.00 0.00 54.91 53.95 1ner h ALA 27 Cb 2.00 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.91 1ner h ALA 27 CO 0.17 0.36 -0.13 -0.07 0.00 0.00 0.00 179.25 179.59 1ner h LEU 28 N -0.46 0.11 0.34 0.00 4.07 -1.43 -1.59 115.31 116.35 1ner h LEU 28 Ca -0.14 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.79 1ner h LEU 28 Cb 1.56 -0.03 0.00 0.00 1.08 0.00 0.00 40.66 43.27 1ner h LEU 28 CO 0.12 0.26 -0.16 -1.28 -1.08 0.00 0.00 178.44 176.29 1ner h SER 29 N 0.12 -0.38 0.80 -0.43 0.87 -1.57 -2.92 113.55 110.03 1ner h SER 29 Ca 0.02 -0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 1ner h SER 29 Cb 0.30 0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.36 1ner h SER 29 CO 0.02 -0.06 0.00 0.08 -0.53 0.00 0.00 176.83 176.34 1ner h ARG 30 N -0.73 0.00 -0.37 2.24 0.11 -1.47 -0.63 114.38 113.52 1ner h ARG 30 Ca -0.05 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.94 1ner h ARG 30 Cb 0.50 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.56 1ner h ARG 30 CO 0.08 0.00 -0.15 1.96 0.10 0.00 0.00 179.97 181.95 1ner h GLN 31 N 0.00 0.68 0.00 0.08 4.20 -1.10 -3.20 115.11 115.77 1ner h GLN 31 Ca 0.00 -0.23 -0.26 0.00 0.06 0.00 0.00 58.65 58.22 1ner h GLN 31 Cb 0.40 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.08 1ner h GLN 31 CO 0.00 0.80 -2.25 1.19 -0.67 0.00 0.00 178.83 177.90 1ner n PHE 32 N -4.16 0.04 -0.80 2.96 3.01 -1.09 -5.01 117.46 112.42 1ner n PHE 32 Ca 0.01 0.01 0.00 0.00 1.01 0.00 0.00 57.45 58.48 1ner n PHE 32 Cb 0.37 -0.87 0.00 0.00 -0.01 0.00 0.00 39.48 38.98 1ner n PHE 32 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ner n GLY 33 N 1.60 0.80 0.76 1.37 0.00 -0.26 -4.94 105.19 104.51 1ner n GLY 33 Ca -0.24 -0.59 0.06 0.00 0.00 0.00 0.00 46.02 45.25 1ner n GLY 33 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ner n TYR 34 N -2.63 0.57 -0.13 1.61 4.01 -1.23 -5.02 117.16 114.34 1ner n TYR 34 Ca 0.00 -0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.47 1ner n TYR 34 Cb 0.11 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 39.10 1ner n TYR 34 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ner n ALA 35 N 0.58 -0.86 0.31 -0.72 0.00 -1.26 -3.57 120.51 114.98 1ner n ALA 35 Ca 0.13 0.04 0.18 0.00 0.00 0.00 0.00 53.44 53.78 1ner n ALA 35 Cb 0.37 -0.58 0.99 0.00 0.00 0.00 0.00 19.45 20.23 1ner n ALA 35 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ner h PRO 36 N 0.05 0.00 -0.17 0.00 0.13 -1.91 -2.29 132.00 127.80 1ner h PRO 36 Ca 0.00 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 1ner h PRO 36 Cb 0.06 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.18 1ner h PRO 36 CO 0.00 0.02 -0.06 1.79 -0.23 0.00 0.00 178.00 179.52 1ner h THR 37 N 0.00 1.30 0.01 1.56 1.35 -1.97 -0.49 112.91 114.66 1ner h THR 37 Ca -0.00 -1.07 -0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1ner h THR 37 Cb 0.07 1.65 -0.00 0.00 -1.73 0.00 0.00 68.15 68.14 1ner h THR 37 CO 0.00 0.32 -0.01 0.74 -0.25 0.00 0.00 175.52 176.32 1ner h THR 38 N 0.04 0.00 -0.46 6.82 2.02 -1.46 0.23 112.91 120.09 1ner h THR 38 Ca 0.04 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.31 1ner h THR 38 Cb 0.52 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.84 1ner h THR 38 CO 0.02 0.00 -0.14 0.25 0.37 0.00 0.00 175.52 176.02 1ner h LEU 39 N -0.01 -0.52 0.15 2.58 5.85 -1.66 0.18 115.31 121.89 1ner h LEU 39 Ca -0.00 0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.86 1ner h LEU 39 Cb 0.01 0.32 -0.01 0.00 0.37 0.00 0.00 40.66 41.36 1ner h LEU 39 CO -0.00 -0.18 -0.15 0.00 -0.34 0.00 0.00 178.44 177.77 1ner h ALA 40 N 1.39 -0.87 0.00 1.25 0.00 -0.98 -1.15 119.26 118.90 1ner h ALA 40 Ca 0.22 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1ner h ALA 40 Cb 0.38 0.40 0.00 0.00 0.00 0.00 0.00 17.79 18.56 1ner h ALA 40 CO -0.50 -0.88 0.00 -1.71 0.00 0.00 0.00 179.25 176.17 1ner n ASN 41 N -3.23 0.00 0.00 0.00 4.05 0.79 -2.39 115.26 114.48 1ner n ASN 41 Ca -0.04 0.19 0.00 0.00 0.45 0.00 0.00 54.58 55.19 1ner n ASN 41 Cb 0.14 -0.21 0.01 0.00 1.23 0.00 0.00 39.78 40.95 1ner n ASN 41 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1ner n ALA 42 N -1.21 2.10 -0.09 5.20 0.00 0.62 -1.57 120.51 125.57 1ner n ALA 42 Ca 0.01 -0.00 -0.18 0.00 0.00 0.00 0.00 53.44 53.26 1ner n ALA 42 Cb 0.01 -1.01 -0.11 0.00 0.00 0.00 0.00 19.45 18.33 1ner n ALA 42 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1ner h LEU 43 N 0.00 0.00 -0.49 0.00 3.38 -1.64 -3.41 115.31 113.16 1ner h LEU 43 Ca 0.00 -0.65 0.00 0.00 0.09 0.00 0.00 57.88 57.32 1ner h LEU 43 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1ner h LEU 43 CO 0.00 1.27 -0.35 -0.62 0.09 0.00 0.00 178.44 178.83 1ner n GLU 44 N -4.51 2.49 -2.57 1.13 -0.58 -1.19 -4.99 120.64 110.42 1ner n GLU 44 Ca -0.23 -0.41 -0.39 0.00 -0.42 0.00 0.00 57.16 55.71 1ner n GLU 44 Cb 0.58 -1.09 -0.05 0.00 -0.57 0.00 0.00 31.44 30.31 1ner n GLU 44 CO 0.00 0.00 0.00 0.50 -0.48 0.00 0.00 177.13 177.15 1ner s ARG 45 N -1.71 4.55 -1.02 3.49 3.52 -0.61 -4.91 118.95 122.25 1ner s ARG 45 Ca 0.08 1.62 -0.24 0.00 -0.13 0.00 0.00 55.73 57.06 1ner s ARG 45 Cb 0.09 -2.99 -0.08 0.00 -1.56 0.00 0.00 34.95 30.41 1ner s ARG 45 CO 0.36 0.18 1.97 -1.01 -0.81 0.00 0.00 175.30 175.99 1ner s HIS 46 N -1.34 1.81 -0.48 5.12 3.76 -1.26 -4.61 115.29 118.28 1ner s HIS 46 Ca 0.48 0.70 0.06 0.00 -0.15 0.00 0.00 55.06 56.15 1ner s HIS 46 Cb -0.27 -3.96 0.23 0.00 1.11 0.00 0.00 32.58 29.69 1ner s HIS 46 CO 0.34 -1.46 0.89 1.87 -0.85 0.00 0.00 174.74 175.52 1ner n TRP 47 N 14.64 -3.25 0.27 1.40 -0.00 -1.26 -5.00 117.44 124.23 1ner n TRP 47 Ca 0.42 -1.62 0.15 0.00 -0.00 0.00 0.00 57.50 56.46 1ner n TRP 47 Cb 0.47 1.53 0.79 0.00 -0.00 0.00 0.00 31.31 34.09 1ner n TRP 47 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1ner h PRO 48 N 4.12 0.00 0.00 5.87 0.11 -1.93 -0.51 132.00 139.66 1ner h PRO 48 Ca -0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.99 1ner h PRO 48 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1ner h PRO 48 CO 0.25 0.00 0.00 -0.22 -0.21 0.00 0.00 178.00 177.82 1ner h LYS 49 N 0.00 0.00 0.00 1.05 1.63 -1.97 -2.26 116.57 115.02 1ner h LYS 49 Ca 0.00 0.00 -0.12 0.00 -0.85 0.00 0.00 60.65 59.68 1ner h LYS 49 Cb 0.34 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.95 1ner h LYS 49 CO 0.00 0.00 -0.59 0.78 -3.45 0.00 0.00 179.45 176.19 1ner h GLY 50 N 2.35 0.00 1.14 5.01 0.00 -1.44 -3.16 103.07 106.97 1ner h GLY 50 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 47.33 47.14 1ner h GLY 50 CO 0.00 0.00 -0.55 0.83 0.00 0.00 0.00 176.54 176.82 1ner h GLU 51 N 0.00 0.86 -0.29 4.80 5.08 -1.54 -2.97 114.58 120.52 1ner h GLU 51 Ca -0.01 -0.56 -0.02 0.00 -1.00 0.00 0.00 59.36 57.78 1ner h GLU 51 Cb 1.27 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.58 1ner h GLU 51 CO 0.08 1.19 0.10 -0.56 -1.00 0.00 0.00 179.01 178.81 1ner h GLN 52 N 0.64 0.40 0.31 2.33 -0.00 -1.51 0.08 115.11 117.37 1ner h GLN 52 Ca 0.01 -0.05 -0.01 0.00 -0.00 0.00 0.00 58.65 58.60 1ner h GLN 52 Cb 1.17 -0.08 0.00 0.00 -0.00 0.00 0.00 27.48 28.57 1ner h GLN 52 CO 0.12 0.35 -0.15 0.82 -0.00 0.00 0.00 178.83 179.97 1ner h ILE 53 N 0.40 0.68 0.17 1.86 2.04 -1.49 0.38 117.51 121.55 1ner h ILE 53 Ca 0.10 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.95 1ner h ILE 53 Cb 0.12 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1ner h ILE 53 CO -0.01 0.00 -0.08 0.40 0.00 0.00 0.00 178.15 178.46 1ner h ILE 54 N -0.42 0.91 -0.73 -0.67 2.04 -1.38 -2.80 117.51 114.46 1ner h ILE 54 Ca -0.04 -0.32 0.04 0.00 1.00 0.00 0.00 64.86 65.54 1ner h ILE 54 Cb 0.33 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.47 1ner h ILE 54 CO 0.06 0.08 0.48 0.00 0.00 0.00 0.00 178.15 178.77 1ner h ALA 55 N 0.42 1.62 -0.62 1.87 0.00 -0.91 0.03 119.26 121.67 1ner h ALA 55 Ca -0.02 -0.03 0.14 0.00 0.00 0.00 0.00 54.91 55.00 1ner h ALA 55 Cb 0.30 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1ner h ALA 55 CO 0.04 0.29 0.43 -0.91 0.00 0.00 0.00 179.25 179.10 1ner h ASN 56 N 0.84 0.21 -0.82 0.00 -0.26 0.03 0.74 115.58 116.32 1ner h ASN 56 Ca 0.30 0.01 0.00 0.00 -0.56 0.00 0.00 56.30 56.05 1ner h ASN 56 Cb 0.12 -0.03 -0.04 0.00 -1.06 0.00 0.00 38.32 37.31 1ner h ASN 56 CO -0.09 0.11 0.53 0.00 -1.06 0.00 0.00 177.43 176.92 1ner h ALA 57 N 1.70 1.38 -0.36 -0.83 0.00 -0.88 0.84 119.26 121.11 1ner h ALA 57 Ca 0.30 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1ner h ALA 57 Cb 0.86 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.32 1ner h ALA 57 CO -0.06 0.56 0.00 1.28 0.00 0.00 0.00 179.25 181.03 1ner n LEU 58 N -4.40 2.01 -2.08 0.00 4.77 0.21 -4.87 117.00 112.65 1ner n LEU 58 Ca 0.09 -1.01 -0.14 0.00 -0.03 0.00 0.00 56.01 54.93 1ner n LEU 58 Cb 0.04 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 40.84 1ner n LEU 58 CO 0.37 0.48 -0.16 -0.62 -1.33 0.00 0.00 177.39 176.13 1ner n GLU 59 N 0.54 -1.86 -0.61 3.23 1.02 0.29 -4.92 120.64 118.33 1ner n GLU 59 Ca 0.12 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 57.97 1ner n GLU 59 Cb 0.33 -5.19 0.00 0.00 -0.02 0.00 0.00 31.44 26.56 1ner n GLU 59 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1ner n THR 60 N -2.94 0.00 -4.21 2.62 5.66 -1.06 -5.01 114.28 109.35 1ner n THR 60 Ca -0.15 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.55 1ner n THR 60 Cb 0.56 -0.28 -0.09 0.00 -1.55 0.00 0.00 70.33 68.97 1ner n THR 60 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1ner s LYS 61 N 0.30 2.32 0.51 1.09 1.02 -1.26 -4.37 119.74 119.35 1ner s LYS 61 Ca 0.00 -0.93 0.18 0.00 0.02 0.00 0.00 55.97 55.24 1ner s LYS 61 Cb 0.00 -2.41 1.27 0.00 -0.52 0.00 0.00 37.83 36.17 1ner s LYS 61 CO 0.00 0.53 2.11 -1.00 -0.92 0.00 0.00 175.35 176.07 1ner h PRO 62 N 3.61 0.00 0.00 -1.68 0.13 -1.92 -1.01 132.00 131.14 1ner h PRO 62 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1ner h PRO 62 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 1ner h PRO 62 CO 0.55 0.07 0.00 0.39 -0.23 0.00 0.00 178.00 178.78 1ner n GLU 63 N -4.31 0.00 -0.04 0.86 -0.58 -1.26 -1.44 120.64 113.86 1ner n GLU 63 Ca -0.03 0.29 -0.16 0.00 -0.42 0.00 0.00 57.16 56.85 1ner n GLU 63 Cb 0.15 -1.50 -0.14 0.00 -0.57 0.00 0.00 31.44 29.38 1ner n GLU 63 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 1ner n VAL 64 N -1.29 1.62 0.17 2.62 0.31 -0.38 -3.68 118.33 117.71 1ner n VAL 64 Ca 0.00 -0.71 0.12 0.00 -0.01 0.00 0.00 64.34 63.74 1ner n VAL 64 Cb 0.00 -1.30 0.06 0.00 -0.91 0.00 0.00 33.84 31.70 1ner n VAL 64 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1ner h ILE 65 N 0.03 0.00 -2.04 2.52 5.03 -1.39 -3.40 117.51 118.27 1ner h ILE 65 Ca -0.43 -0.96 -0.57 0.00 -0.12 0.00 0.00 64.86 62.78 1ner h ILE 65 Cb 2.03 1.61 -0.39 0.00 -3.03 0.00 0.00 36.82 37.04 1ner h ILE 65 CO 0.04 0.00 -1.06 0.79 -0.68 0.00 0.00 178.15 177.25 1ner n TRP 66 N -2.75 -0.02 0.04 1.37 8.01 -0.76 -3.39 117.44 119.95 1ner n TRP 66 Ca 0.01 -3.61 -0.20 0.00 -1.31 0.00 0.00 57.50 52.40 1ner n TRP 66 Cb 0.54 -0.34 -0.12 0.00 -2.01 0.00 0.00 31.31 29.37 1ner n TRP 66 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1ner h PRO 67 N 4.09 0.54 0.00 -0.99 0.13 -1.78 -3.21 132.00 130.77 1ner h PRO 67 Ca 0.09 -0.64 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 1ner h PRO 67 Cb 0.86 0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1ner h PRO 67 CO 0.49 1.25 0.00 0.43 -0.23 0.00 0.00 178.00 179.95 1ner n SER 68 N -4.00 0.00 -0.23 1.44 7.64 -1.26 -0.59 113.62 116.62 1ner n SER 68 Ca -0.12 0.14 0.10 0.00 1.01 0.00 0.00 58.87 60.00 1ner n SER 68 Cb 0.83 -0.25 -0.06 0.00 -1.01 0.00 0.00 64.21 63.71 1ner n SER 68 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1ner n ARG 69 N -1.25 0.81 -4.24 1.43 1.74 -1.21 -4.92 116.66 109.01 1ner n ARG 69 Ca 0.04 -0.47 -0.20 0.00 -0.77 0.00 0.00 57.85 56.44 1ner n ARG 69 Cb 0.05 -1.45 -0.12 0.00 -1.02 0.00 0.00 32.46 29.92 1ner n ARG 69 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1ner s TYR 70 N -2.64 1.38 -0.44 -1.55 2.02 0.24 -5.08 117.35 111.28 1ner s TYR 70 Ca 0.12 -0.43 0.07 0.00 -0.37 0.00 0.00 57.07 56.46 1ner s TYR 70 Cb 0.16 -0.78 0.34 0.00 -0.40 0.00 0.00 41.96 41.28 1ner s TYR 70 CO 0.69 0.09 1.20 0.00 -1.57 0.00 0.00 175.55 175.96 1ner n GLN 71 N 1.35 1.04 -0.21 -0.62 0.00 -1.26 -4.86 117.38 112.82 1ner n GLN 71 Ca -0.20 -1.85 0.09 0.00 0.00 0.00 0.00 57.00 55.04 1ner n GLN 71 Cb 0.54 -0.69 0.17 0.00 0.00 0.00 0.00 30.24 30.27 1ner n GLN 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1ner n ALA 72 N 0.06 2.56 -1.00 2.61 0.00 -1.26 -4.94 120.51 118.54 1ner n ALA 72 Ca 0.02 -2.60 0.00 0.00 0.00 0.00 0.00 53.44 50.87 1ner n ALA 72 Cb 0.75 -0.47 0.00 0.00 0.00 0.00 0.00 19.45 19.73 1ner n ALA 72 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ner n GLY 73 N -1.19 -1.91 0.00 0.00 0.00 -1.26 -5.35 105.19 95.48 1ner n GLY 73 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1ner n GLY 73 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50