#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 -0.46 0.00 7.64 -1.26 -4.87 113.62 114.67 1ner n SER 2 Ca 0.00 -0.39 0.12 0.00 1.01 0.00 0.00 58.87 59.61 1ner n SER 2 Cb 0.00 0.00 0.47 0.00 -1.01 0.00 0.00 64.21 63.67 1ner n SER 2 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1ner n ASN 3 N 0.00 1.41 0.00 6.43 5.15 -1.26 -4.94 115.26 122.05 1ner n ASN 3 Ca 0.00 -1.58 0.00 0.00 -0.60 0.00 0.00 54.58 52.40 1ner n ASN 3 Cb 0.10 -0.05 0.00 0.00 -0.53 0.00 0.00 39.78 39.29 1ner n ASN 3 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 1ner n GLU 4 N 0.13 0.00 -0.02 1.20 2.13 -1.26 -3.95 120.64 118.87 1ner n GLU 4 Ca 0.17 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.98 1ner n GLU 4 Cb 0.31 0.00 -0.00 0.00 0.27 0.00 0.00 31.44 32.02 1ner n GLU 4 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1ner n LYS 5 N 0.00 0.09 0.00 5.31 5.02 -1.26 -4.86 118.16 122.46 1ner n LYS 5 Ca 0.00 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 1ner n LYS 5 Cb 0.00 -0.80 0.00 0.00 -0.02 0.00 0.00 35.03 34.21 1ner n LYS 5 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ner n ALA 6 N -2.70 0.00 0.20 7.82 0.00 -1.25 -3.44 120.51 121.14 1ner n ALA 6 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.53 1ner n ALA 6 Cb 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.43 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 12.72 0.53 -0.68 0.00 3.00 -1.26 -4.96 116.66 126.02 1ner n ARG 7 Ca 0.00 -0.07 -0.18 0.00 -0.01 0.00 0.00 57.85 57.59 1ner n ARG 7 Cb 0.00 -1.61 0.15 0.00 0.00 0.00 0.00 32.46 31.00 1ner n ARG 7 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1ner n ASP 8 N -2.25 -1.50 0.00 0.55 8.00 -1.22 -4.77 116.55 115.36 1ner n ASP 8 Ca -0.01 -0.94 0.00 0.00 0.71 0.00 0.00 54.79 54.55 1ner n ASP 8 Cb 0.52 -0.61 0.00 0.00 -0.02 0.00 0.00 41.12 41.02 1ner n ASP 8 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1ner n TRP 9 N -3.84 0.00 -3.60 1.24 7.02 -1.23 -5.00 117.44 112.02 1ner n TRP 9 Ca 0.09 0.00 -0.08 0.00 -1.02 0.00 0.00 57.50 56.50 1ner n TRP 9 Cb 0.35 0.00 -0.05 0.00 -2.42 0.00 0.00 31.31 29.19 1ner n TRP 9 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 1ner s HIS 10 N 0.00 -0.26 0.56 -5.99 2.46 -1.26 -4.86 115.29 105.93 1ner s HIS 10 Ca 0.00 0.47 0.29 0.00 0.47 0.00 0.00 55.06 56.29 1ner s HIS 10 Cb 0.00 0.46 1.46 0.00 -0.13 0.00 0.00 32.58 34.37 1ner s HIS 10 CO 0.00 -0.23 1.91 0.00 -2.47 0.00 0.00 174.74 173.95 1ner h ARG 11 N 2.50 0.00 0.05 2.88 3.08 -1.98 0.44 114.38 121.34 1ner h ARG 11 Ca -0.16 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 59.56 1ner h ARG 11 Cb 1.17 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.18 1ner h ARG 11 CO 0.27 0.00 -1.88 0.00 -1.07 0.00 0.00 179.97 177.29 1ner n ALA 12 N -2.55 1.25 0.26 0.04 0.00 -1.26 -3.11 120.51 115.15 1ner n ALA 12 Ca 0.13 -0.74 0.14 0.00 0.00 0.00 0.00 53.44 52.97 1ner n ALA 12 Cb 0.78 -0.73 0.69 0.00 0.00 0.00 0.00 19.45 20.20 1ner n ALA 12 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1ner h ASP 13 N 0.03 0.00 0.09 0.00 5.19 -1.10 0.87 116.42 121.49 1ner h ASP 13 Ca -0.36 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.04 1ner h ASP 13 Cb 2.03 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.54 1ner h ASP 13 CO 0.07 0.11 -0.04 0.58 -3.12 0.00 0.00 179.24 176.84 1ner h VAL 14 N 0.00 0.03 0.02 -1.35 2.07 -0.38 -2.99 116.25 113.65 1ner h VAL 14 Ca -0.00 -0.93 -0.00 0.00 0.82 0.00 0.00 66.70 66.59 1ner h VAL 14 Cb 0.46 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1ner h VAL 14 CO 0.01 0.01 -0.01 0.40 0.02 0.00 0.00 177.57 178.00 1ner h ILE 15 N -1.03 1.33 -0.13 4.57 2.04 -1.47 -0.97 117.51 121.85 1ner h ILE 15 Ca -0.01 -1.09 0.04 0.00 1.00 0.00 0.00 64.86 64.80 1ner h ILE 15 Cb 0.11 2.06 -0.05 0.00 -0.74 0.00 0.00 36.82 38.20 1ner h ILE 15 CO 0.02 0.28 -0.17 0.00 0.00 0.00 0.00 178.15 178.28 1ner h ALA 16 N 0.48 -0.09 -0.11 1.87 0.00 0.58 0.65 119.26 122.63 1ner h ALA 16 Ca -0.00 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ner h ALA 16 Cb 0.47 0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1ner h ALA 16 CO 0.00 -0.62 0.05 0.78 0.00 0.00 0.00 179.25 179.46 1ner h GLY 17 N -0.21 0.17 1.04 0.00 0.00 -1.58 -2.41 103.07 100.09 1ner h GLY 17 Ca 0.10 -0.09 -0.05 0.00 0.00 0.00 0.00 47.33 47.29 1ner h GLY 17 CO -0.25 0.08 0.26 1.41 0.00 0.00 0.00 176.54 178.04 1ner h LEU 18 N 0.04 1.02 -2.54 3.11 3.38 -0.83 -1.51 115.31 117.98 1ner h LEU 18 Ca 0.04 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1ner h LEU 18 Cb 0.14 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.62 1ner h LEU 18 CO -0.00 0.94 0.00 0.11 0.09 0.00 0.00 178.44 179.57 1ner h LYS 19 N 1.05 0.00 -0.97 1.13 1.57 0.48 -2.66 116.57 117.17 1ner h LYS 19 Ca 0.24 0.00 0.24 0.00 -1.87 0.00 0.00 60.65 59.26 1ner h LYS 19 Cb 0.26 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.50 1ner h LYS 19 CO -0.01 0.00 0.65 -0.22 -0.57 0.00 0.00 179.45 179.30 1ner h LYS 20 N 0.00 0.31 0.00 3.15 3.64 -0.76 -3.33 116.57 119.58 1ner h LYS 20 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1ner h LYS 20 Cb 0.12 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 1ner h LYS 20 CO 0.00 0.20 0.00 0.54 -2.27 0.00 0.00 179.45 177.92 1ner n ARG 21 N -4.49 0.00 -2.76 1.90 1.74 -1.00 -5.00 116.66 107.05 1ner n ARG 21 Ca 0.22 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.21 1ner n ARG 21 Cb 0.84 0.00 0.08 0.00 -1.02 0.00 0.00 32.46 32.36 1ner n ARG 21 CO 0.00 0.00 0.00 0.36 -1.52 0.00 0.00 177.63 176.47 1ner n LYS 22 N 0.00 1.11 -4.66 5.56 2.85 -1.25 -5.12 118.16 116.64 1ner n LYS 22 Ca 0.00 -2.22 -0.24 0.00 -1.05 0.00 0.00 58.31 54.79 1ner n LYS 22 Cb 0.00 -0.72 -0.14 0.00 -0.65 0.00 0.00 35.03 33.52 1ner n LYS 22 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1ner s LEU 23 N -2.80 2.12 -0.14 -5.58 1.43 -1.23 -5.03 118.68 107.45 1ner s LEU 23 Ca 0.25 -0.45 -0.05 0.00 -1.03 0.00 0.00 54.13 52.85 1ner s LEU 23 Cb 0.37 -0.89 0.07 0.00 0.03 0.00 0.00 46.19 45.76 1ner s LEU 23 CO -0.06 0.16 0.30 -0.94 0.23 0.00 0.00 176.35 176.04 1ner s SER 24 N -0.92 0.14 0.26 2.29 1.04 -1.26 -3.49 113.70 111.75 1ner s SER 24 Ca 0.06 0.69 -0.03 0.00 0.48 0.00 0.00 55.95 57.15 1ner s SER 24 Cb -0.08 0.83 0.52 0.00 0.10 0.00 0.00 66.02 67.40 1ner s SER 24 CO 0.01 -0.23 1.37 0.18 0.98 0.00 0.00 173.24 175.55 1ner n LEU 25 N 5.24 -0.22 -0.10 2.42 4.77 -1.26 0.20 117.00 128.04 1ner n LEU 25 Ca -0.09 1.50 0.06 0.00 -0.03 0.00 0.00 56.01 57.46 1ner n LEU 25 Cb 0.50 -0.50 0.40 0.00 -2.33 0.00 0.00 43.42 41.49 1ner n LEU 25 CO 0.03 -1.48 1.19 0.28 -1.33 0.00 0.00 177.39 176.09 1ner h SER 26 N 0.00 0.55 0.06 -1.43 0.02 -1.96 0.99 113.55 111.78 1ner h SER 26 Ca 0.47 -0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.34 1ner h SER 26 Cb 0.85 -0.12 0.01 0.00 0.14 0.00 0.00 62.40 63.27 1ner h SER 26 CO -0.87 0.37 -0.35 0.00 -1.14 0.00 0.00 176.83 174.84 1ner h ALA 27 N 1.66 -0.04 -0.81 3.77 0.00 0.19 -2.90 119.26 121.14 1ner h ALA 27 Ca 0.25 -0.59 0.01 0.00 0.00 0.00 0.00 54.91 54.58 1ner h ALA 27 Cb 0.19 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1ner h ALA 27 CO -0.07 0.16 0.54 -0.07 0.00 0.00 0.00 179.25 179.81 1ner h LEU 28 N -0.74 0.93 -0.77 0.00 4.07 -0.63 0.22 115.31 118.39 1ner h LEU 28 Ca -0.06 -0.02 -0.06 0.00 0.08 0.00 0.00 57.88 57.81 1ner h LEU 28 Cb 1.27 -0.23 -0.03 0.00 1.08 0.00 0.00 40.66 42.75 1ner h LEU 28 CO 0.06 0.67 0.21 0.77 -1.08 0.00 0.00 178.44 179.07 1ner h SER 29 N 1.09 1.07 0.63 -0.43 4.64 -0.90 -2.29 113.55 117.37 1ner h SER 29 Ca 0.30 -0.21 -0.10 0.00 -0.47 0.00 0.00 61.79 61.31 1ner h SER 29 Cb -0.11 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.68 1ner h SER 29 CO -0.07 1.00 -0.49 -0.09 -0.87 0.00 0.00 176.83 176.31 1ner h ARG 30 N 1.09 0.00 -0.06 4.77 9.65 -0.91 -0.44 114.38 128.49 1ner h ARG 30 Ca 0.23 0.00 -0.10 0.00 -1.10 0.00 0.00 59.98 59.01 1ner h ARG 30 Cb 0.32 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.89 1ner h ARG 30 CO -0.01 0.49 -0.42 1.96 2.80 0.00 0.00 179.97 184.79 1ner h GLN 31 N 0.00 0.12 0.00 0.20 4.20 -0.04 -3.22 115.11 116.37 1ner h GLN 31 Ca -0.00 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.52 1ner h GLN 31 Cb 0.93 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.69 1ner h GLN 31 CO 0.06 0.53 -2.05 1.19 -0.67 0.00 0.00 178.83 177.89 1ner n PHE 32 N -4.02 0.00 0.00 2.96 3.01 -1.14 -5.03 117.46 113.24 1ner n PHE 32 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.44 1ner n PHE 32 Cb 0.47 -0.63 0.00 0.00 -0.01 0.00 0.00 39.48 39.31 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 1.55 3.48 3.61 1.37 0.00 -0.18 -5.07 105.19 109.96 1ner n GLY 33 Ca -0.14 -1.00 -0.64 0.00 0.00 0.00 0.00 46.02 44.24 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 0.00 1.65 -0.99 1.61 4.01 -1.19 -4.73 117.16 117.51 1ner n TYR 34 Ca 0.00 0.95 -0.36 0.00 -0.16 0.00 0.00 57.90 58.33 1ner n TYR 34 Cb 0.00 -2.28 0.04 0.00 -0.31 0.00 0.00 39.34 36.79 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 5.24 -5.39 0.24 -0.72 0.00 -1.26 -4.33 120.51 114.29 1ner n ALA 35 Ca 0.37 -0.70 0.12 0.00 0.00 0.00 0.00 53.44 53.23 1ner n ALA 35 Cb -0.02 -1.16 0.75 0.00 0.00 0.00 0.00 19.45 19.01 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 -1.03 0.00 -0.28 0.00 0.13 -1.88 -2.34 132.00 126.61 1ner h PRO 36 Ca -0.44 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.64 1ner h PRO 36 Cb 1.30 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.42 1ner h PRO 36 CO 0.23 0.00 -0.01 1.79 -0.23 0.00 0.00 178.00 179.79 1ner h THR 37 N 0.00 1.26 0.36 1.56 1.35 -1.98 -2.10 112.91 113.36 1ner h THR 37 Ca 0.03 -0.94 -0.01 0.00 -0.55 0.00 0.00 66.41 64.93 1ner h THR 37 Cb 0.14 1.32 -0.01 0.00 -1.73 0.00 0.00 68.15 67.88 1ner h THR 37 CO -0.00 0.30 -0.31 0.74 -0.25 0.00 0.00 175.52 176.00 1ner h THR 38 N 0.28 0.00 -0.06 6.82 2.02 -1.71 0.58 112.91 120.84 1ner h THR 38 Ca 0.08 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.28 1ner h THR 38 Cb 0.44 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.80 1ner h THR 38 CO 0.02 0.00 -0.46 0.25 0.37 0.00 0.00 175.52 175.69 1ner h LEU 39 N -0.65 -1.46 0.21 2.58 5.85 -1.60 -1.42 115.31 118.81 1ner h LEU 39 Ca -0.05 0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.85 1ner h LEU 39 Cb 0.55 0.56 -0.03 0.00 0.37 0.00 0.00 40.66 42.11 1ner h LEU 39 CO -0.01 -0.43 -0.29 0.00 -0.34 0.00 0.00 178.44 177.37 1ner h ALA 40 N -0.52 -0.56 0.00 1.25 0.00 -1.35 -0.71 119.26 117.37 1ner h ALA 40 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ner h ALA 40 Cb 0.60 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1ner h ALA 40 CO -0.34 -0.86 0.03 -1.71 0.00 0.00 0.00 179.25 176.37 1ner n ASN 41 N -5.40 0.00 0.00 0.00 5.15 0.20 -1.53 115.26 113.68 1ner n ASN 41 Ca -0.08 0.16 0.09 0.00 -0.60 0.00 0.00 54.58 54.15 1ner n ASN 41 Cb 0.31 -0.16 0.44 0.00 -0.53 0.00 0.00 39.78 39.84 1ner n ASN 41 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ner n ALA 42 N -1.10 1.94 1.69 5.20 0.00 -0.27 -2.20 120.51 125.76 1ner n ALA 42 Ca 0.00 -0.08 0.14 0.00 0.00 0.00 0.00 53.44 53.50 1ner n ALA 42 Cb 0.03 -1.30 0.66 0.00 0.00 0.00 0.00 19.45 18.84 1ner n ALA 42 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1ner n LEU 43 N -1.35 0.83 0.04 0.00 4.77 -0.58 -4.53 117.00 116.18 1ner n LEU 43 Ca 0.07 -0.30 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 1ner n LEU 43 Cb 0.17 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1ner n LEU 43 CO 0.15 0.15 0.00 -0.62 -1.33 0.00 0.00 177.39 175.74 1ner n GLU 44 N -0.32 0.00 -2.14 3.23 1.02 -0.94 -5.07 120.64 116.43 1ner n GLU 44 Ca 0.20 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 57.00 1ner n GLU 44 Cb 0.23 -0.18 0.01 0.00 -0.02 0.00 0.00 31.44 31.48 1ner n GLU 44 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 1ner s ARG 45 N -1.53 3.27 -0.24 3.49 1.70 -1.20 -4.92 118.95 119.53 1ner s ARG 45 Ca 0.00 1.44 -0.29 0.00 -0.47 0.00 0.00 55.73 56.41 1ner s ARG 45 Cb 0.00 -2.01 -0.03 0.00 -0.57 0.00 0.00 34.95 32.34 1ner s ARG 45 CO 0.00 -0.88 1.73 -1.58 -1.08 0.00 0.00 175.30 173.49 1ner s HIS 46 N -2.07 1.90 -0.43 5.89 5.65 -1.26 -4.83 115.29 120.14 1ner s HIS 46 Ca 0.69 0.51 0.03 0.00 0.25 0.00 0.00 55.06 56.54 1ner s HIS 46 Cb -0.20 -4.05 0.25 0.00 -1.18 0.00 0.00 32.58 27.40 1ner s HIS 46 CO 0.31 -3.16 1.01 1.87 -0.65 0.00 0.00 174.74 174.12 1ner n TRP 47 N 9.21 -2.30 0.26 3.88 -0.00 -1.26 -5.01 117.44 122.22 1ner n TRP 47 Ca 0.21 -1.34 0.15 0.00 -0.00 0.00 0.00 57.50 56.52 1ner n TRP 47 Cb 0.45 1.39 0.82 0.00 -0.00 0.00 0.00 31.31 33.97 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 3.72 0.00 0.00 5.87 0.11 -1.92 -0.96 132.00 138.82 1ner h PRO 48 Ca -0.17 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.86 1ner h PRO 48 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1ner h PRO 48 CO 0.13 0.00 -0.37 -0.22 -0.21 0.00 0.00 178.00 177.33 1ner h LYS 49 N 0.00 0.00 0.00 1.05 1.63 -1.99 -1.75 116.57 115.51 1ner h LYS 49 Ca 0.00 0.00 -0.09 0.00 -0.85 0.00 0.00 60.65 59.71 1ner h LYS 49 Cb 0.27 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.89 1ner h LYS 49 CO 0.00 0.37 -0.42 0.78 -3.45 0.00 0.00 179.45 176.73 1ner h GLY 50 N 1.58 0.00 1.84 5.01 0.00 -1.56 -2.32 103.07 107.62 1ner h GLY 50 Ca -0.00 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 1ner h GLY 50 CO 0.05 0.00 -0.53 0.83 0.00 0.00 0.00 176.54 176.88 1ner h GLU 51 N 0.00 0.17 -0.82 4.80 4.39 -1.42 -2.66 114.58 119.04 1ner h GLU 51 Ca -0.00 -0.10 -0.02 0.00 0.34 0.00 0.00 59.36 59.58 1ner h GLU 51 Cb 0.92 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.54 1ner h GLU 51 CO 0.05 0.67 0.45 1.96 -1.16 0.00 0.00 179.01 180.98 1ner h GLN 52 N 0.14 1.14 0.19 2.33 1.08 -1.07 0.11 115.11 119.03 1ner h GLN 52 Ca 0.00 -0.13 0.01 0.00 -1.45 0.00 0.00 58.65 57.08 1ner h GLN 52 Cb 0.99 -0.23 -0.02 0.00 -0.05 0.00 0.00 27.48 28.17 1ner h GLN 52 CO 0.08 0.84 -0.23 0.82 -0.95 0.00 0.00 178.83 179.38 1ner h ILE 53 N 1.15 0.49 0.53 2.54 2.04 -1.39 0.40 117.51 123.27 1ner h ILE 53 Ca 0.29 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.12 1ner h ILE 53 Cb 0.03 0.49 0.01 0.00 -0.74 0.00 0.00 36.82 36.60 1ner h ILE 53 CO -0.05 0.00 -0.26 0.40 0.00 0.00 0.00 178.15 178.25 1ner h ILE 54 N -0.47 0.35 -0.79 -0.67 2.04 -1.41 -3.04 117.51 113.51 1ner h ILE 54 Ca 0.01 -0.37 0.09 0.00 1.00 0.00 0.00 64.86 65.58 1ner h ILE 54 Cb 0.46 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 36.97 1ner h ILE 54 CO -0.08 0.05 0.52 0.00 0.00 0.00 0.00 178.15 178.63 1ner h ALA 55 N -0.69 1.73 -0.87 1.87 0.00 -0.76 -0.33 119.26 120.21 1ner h ALA 55 Ca -0.07 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 54.95 1ner h ALA 55 Cb 0.62 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.17 1ner h ALA 55 CO 0.12 0.12 0.56 -0.91 0.00 0.00 0.00 179.25 179.15 1ner h ASN 56 N 0.76 0.69 -0.48 0.00 4.21 -0.10 -0.55 115.58 120.11 1ner h ASN 56 Ca 0.36 0.03 -0.02 0.00 1.21 0.00 0.00 56.30 57.88 1ner h ASN 56 Cb 0.39 -0.11 -0.03 0.00 -1.12 0.00 0.00 38.32 37.45 1ner h ASN 56 CO -0.13 0.38 0.25 0.00 -1.29 0.00 0.00 177.43 176.64 1ner h ALA 57 N 1.59 1.48 -0.31 -0.83 0.00 -0.94 -1.20 119.26 119.05 1ner h ALA 57 Ca 0.42 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1ner h ALA 57 Cb 0.59 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ner h ALA 57 CO -0.19 0.42 0.00 1.28 0.00 0.00 0.00 179.25 180.76 1ner n LEU 58 N -4.38 1.89 -0.73 0.00 4.77 -0.24 -4.85 117.00 113.46 1ner n LEU 58 Ca 0.04 -0.95 -0.08 0.00 -0.03 0.00 0.00 56.01 55.00 1ner n LEU 58 Cb 0.12 -0.27 -0.03 0.00 -2.33 0.00 0.00 43.42 40.91 1ner n LEU 58 CO 0.37 0.42 -0.08 1.21 -1.33 0.00 0.00 177.39 177.98 1ner n GLU 59 N 0.40 -1.69 -1.93 3.23 0.00 -0.45 -4.90 120.64 115.30 1ner n GLU 59 Ca 0.11 0.68 -0.04 0.00 0.00 0.00 0.00 57.16 57.91 1ner n GLU 59 Cb 0.32 -4.87 -0.00 0.00 0.00 0.00 0.00 31.44 26.89 1ner n GLU 59 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1ner n THR 60 N -1.83 0.00 -4.01 6.31 5.66 -1.14 -5.03 114.28 114.25 1ner n THR 60 Ca -0.08 -0.32 -0.30 0.00 -3.05 0.00 0.00 64.05 60.30 1ner n THR 60 Cb 0.47 -0.35 -0.06 0.00 -1.55 0.00 0.00 70.33 68.84 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 -2.31 3.08 0.59 1.09 3.01 -1.26 -4.29 119.74 119.64 1ner s LYS 61 Ca 0.04 -0.62 0.31 0.00 -1.01 0.00 0.00 55.97 54.69 1ner s LYS 61 Cb -0.00 -2.83 1.82 0.00 -1.01 0.00 0.00 37.83 35.81 1ner s LYS 61 CO 0.02 0.57 2.23 -1.00 0.51 0.00 0.00 175.35 177.69 1ner h PRO 62 N 3.13 0.00 0.00 -1.68 0.13 -1.90 -1.36 132.00 130.33 1ner h PRO 62 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 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 0.69 0.02 0.00 0.39 -0.23 0.00 0.00 178.00 178.87 1ner n GLU 63 N -3.70 0.02 -0.02 0.86 1.02 -1.26 -1.54 120.64 116.01 1ner n GLU 63 Ca -0.03 0.37 -0.11 0.00 -0.02 0.00 0.00 57.16 57.37 1ner n GLU 63 Cb 0.11 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.89 1ner n GLU 63 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1ner n VAL 64 N -1.40 1.63 0.15 2.62 0.31 -0.51 -3.18 118.33 117.96 1ner n VAL 64 Ca 0.01 -0.77 0.11 0.00 -0.01 0.00 0.00 64.34 63.68 1ner n VAL 64 Cb 0.02 -1.16 0.07 0.00 -0.91 0.00 0.00 33.84 31.87 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 0.01 0.04 -2.24 2.52 5.03 -1.44 -3.38 117.51 118.04 1ner h ILE 65 Ca -0.33 -1.06 -0.58 0.00 -0.12 0.00 0.00 64.86 62.77 1ner h ILE 65 Cb 2.03 1.76 -0.40 0.00 -3.03 0.00 0.00 36.82 37.18 1ner h ILE 65 CO 0.08 0.02 -0.92 0.79 -0.68 0.00 0.00 178.15 177.44 1ner n TRP 66 N -2.89 0.66 0.04 1.37 8.01 -0.89 -3.49 117.44 120.25 1ner n TRP 66 Ca 0.02 -3.69 -0.02 0.00 -1.31 0.00 0.00 57.50 52.50 1ner n TRP 66 Cb 0.55 -0.27 -0.01 0.00 -2.01 0.00 0.00 31.31 29.58 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 4.58 -0.10 0.00 -0.99 0.13 -1.74 -3.26 132.00 130.62 1ner h PRO 67 Ca 0.15 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1ner h PRO 67 Cb 0.83 0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1ner h PRO 67 CO 0.54 -0.07 0.00 0.43 -0.23 0.00 0.00 178.00 178.67 1ner n SER 68 N -2.56 0.00 -0.02 1.44 7.64 -1.26 -1.43 113.62 117.42 1ner n SER 68 Ca -0.01 -0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.94 1ner n SER 68 Cb 0.04 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.08 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 -0.65 0.66 -1.05 1.43 5.12 -1.23 -4.98 116.66 115.97 1ner n ARG 69 Ca 0.00 -0.16 0.00 0.00 -1.93 0.00 0.00 57.85 55.76 1ner n ARG 69 Cb 0.00 -1.53 0.00 0.00 -1.16 0.00 0.00 32.46 29.77 1ner n ARG 69 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 1ner n TYR 70 N -2.35 -2.13 0.00 -1.55 4.01 -0.51 -5.09 117.16 109.54 1ner n TYR 70 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 1ner n TYR 70 Cb 0.67 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.70 1ner n TYR 70 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1ner n GLN 71 N -0.71 0.00 -3.32 -0.72 -0.06 -1.26 -5.05 117.38 106.26 1ner n GLN 71 Ca 0.00 0.00 -0.17 0.00 -2.00 0.00 0.00 57.00 54.83 1ner n GLN 71 Cb 0.00 0.00 0.01 0.00 -4.06 0.00 0.00 30.24 26.19 1ner n GLN 71 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1ner n ALA 72 N -1.81 -2.66 -1.33 1.69 0.00 -1.26 -4.83 120.51 110.31 1ner n ALA 72 Ca 0.00 0.25 -0.37 0.00 0.00 0.00 0.00 53.44 53.32 1ner n ALA 72 Cb 0.00 -1.92 0.06 0.00 0.00 0.00 0.00 19.45 17.59 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 -1.09 -1.50 0.00 0.00 0.00 -1.26 -5.32 105.19 96.01 1ner n GLY 73 Ca -0.08 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.62 1ner n GLY 73 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11