#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 -2.62 0.00 3.41 -1.26 -5.07 113.62 108.08 1ner n SER 2 Ca 0.00 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.57 1ner n SER 2 Cb 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 64.21 64.06 1ner n SER 2 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1ner n ASN 3 N 0.00 -1.58 -2.36 4.04 0.23 -1.26 -5.09 115.26 109.25 1ner n ASN 3 Ca 0.00 -2.23 -0.01 0.00 -0.53 0.00 0.00 54.58 51.82 1ner n ASN 3 Cb 0.00 0.83 -0.01 0.00 -2.08 0.00 0.00 39.78 38.53 1ner n ASN 3 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 1ner n GLU 4 N -0.95 -4.26 -0.22 -3.83 2.13 -1.26 -4.77 120.64 107.49 1ner n GLU 4 Ca -0.11 3.11 0.03 0.00 0.66 0.00 0.00 57.16 60.85 1ner n GLU 4 Cb 0.83 -4.04 -0.01 0.00 0.27 0.00 0.00 31.44 28.49 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 1.89 -0.45 0.00 5.31 5.02 -1.26 -5.01 118.16 123.66 1ner n LYS 5 Ca -0.05 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.53 1ner n LYS 5 Cb 0.08 -0.54 0.00 0.00 -0.02 0.00 0.00 35.03 34.54 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 -0.45 0.00 -1.71 7.82 0.00 -1.26 -5.06 120.51 119.86 1ner n ALA 6 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1ner n ALA 6 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 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 -0.05 0.00 0.00 0.00 1.74 -1.26 -5.07 116.66 112.02 1ner n ARG 7 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 1ner n ARG 7 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 1ner n ARG 7 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1ner n ASP 8 N 0.00 0.00 -4.60 0.55 8.00 -1.26 -4.88 116.55 114.35 1ner n ASP 8 Ca 0.00 0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.07 1ner n ASP 8 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.07 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 1.91 1.01 1.24 0.52 -1.23 -4.97 118.94 117.42 1ner s TRP 9 Ca 0.00 0.60 -0.17 0.00 0.02 0.00 0.00 56.10 56.55 1ner s TRP 9 Cb 0.00 -4.13 0.06 0.00 -1.15 0.00 0.00 33.47 28.25 1ner s TRP 9 CO 0.00 -2.88 -0.20 1.58 0.02 0.00 0.00 176.95 175.48 1ner n HIS 10 N 9.79 -1.73 0.26 -1.98 -0.00 -1.26 -4.45 115.22 115.85 1ner n HIS 10 Ca 0.22 0.23 0.10 0.00 0.46 0.00 0.00 57.72 58.72 1ner n HIS 10 Cb 0.47 -1.44 0.70 0.00 -0.12 0.00 0.00 29.99 29.59 1ner n HIS 10 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1ner h ARG 11 N -2.09 0.00 0.00 1.57 3.08 -2.01 -1.83 114.38 113.10 1ner h ARG 11 Ca -0.35 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.51 1ner h ARG 11 Cb 1.03 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.05 1ner h ARG 11 CO 0.23 0.04 -1.40 0.00 -1.07 0.00 0.00 179.97 177.77 1ner h ALA 12 N 1.96 0.67 0.00 0.04 0.00 -1.99 -3.17 119.26 116.77 1ner h ALA 12 Ca -0.00 -0.95 -0.03 0.00 0.00 0.00 0.00 54.91 53.93 1ner h ALA 12 Cb 0.08 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ner h ALA 12 CO 0.01 1.04 -0.14 -0.44 0.00 0.00 0.00 179.25 179.72 1ner h ASP 13 N 0.00 0.00 0.04 0.00 3.32 -1.61 0.70 116.42 118.88 1ner h ASP 13 Ca -0.17 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 1ner h ASP 13 Cb 1.66 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.21 1ner h ASP 13 CO 0.06 0.14 -0.02 0.58 -1.72 0.00 0.00 179.24 178.28 1ner h VAL 14 N 0.00 0.35 -0.12 -1.35 2.07 -1.52 -2.99 116.25 112.69 1ner h VAL 14 Ca -0.00 -1.20 -0.09 0.00 0.82 0.00 0.00 66.70 66.23 1ner h VAL 14 Cb 0.51 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 1ner h VAL 14 CO 0.02 0.11 -0.28 0.40 0.02 0.00 0.00 177.57 177.84 1ner h ILE 15 N -1.01 1.38 -0.81 4.57 2.04 -1.51 0.05 117.51 122.22 1ner h ILE 15 Ca -0.01 -1.58 0.09 0.00 1.00 0.00 0.00 64.86 64.37 1ner h ILE 15 Cb 0.23 2.09 -0.07 0.00 -0.74 0.00 0.00 36.82 38.33 1ner h ILE 15 CO 0.01 0.46 0.47 0.00 0.00 0.00 0.00 178.15 179.09 1ner h ALA 16 N 0.52 1.15 -0.01 1.87 0.00 0.24 1.02 119.26 124.05 1ner h ALA 16 Ca -0.00 0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.81 1ner h ALA 16 Cb 0.89 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 18.55 1ner h ALA 16 CO 0.06 0.10 -0.48 0.78 0.00 0.00 0.00 179.25 179.71 1ner h GLY 17 N 0.79 0.38 0.55 0.00 0.00 -1.50 -1.71 103.07 101.58 1ner h GLY 17 Ca 0.39 -0.65 -0.01 0.00 0.00 0.00 0.00 47.33 47.05 1ner h GLY 17 CO -0.24 0.57 -0.15 1.41 0.00 0.00 0.00 176.54 178.14 1ner h LEU 18 N -0.22 -0.34 -0.94 3.11 3.38 -0.64 -2.77 115.31 116.89 1ner h LEU 18 Ca -0.06 -0.20 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1ner h LEU 18 Cb 1.20 0.09 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1ner h LEU 18 CO 0.10 0.08 0.00 1.17 0.09 0.00 0.00 178.44 179.88 1ner n LYS 19 N -5.09 0.10 0.15 1.13 4.81 0.35 -1.79 118.16 117.82 1ner n LYS 19 Ca -0.09 0.57 0.19 0.00 -0.87 0.00 0.00 58.31 58.11 1ner n LYS 19 Cb 0.27 -1.81 0.78 0.00 0.02 0.00 0.00 35.03 34.28 1ner n LYS 19 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 1ner h LYS 20 N 0.00 0.00 0.00 1.64 3.11 -1.00 -3.30 116.57 117.02 1ner h LYS 20 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 1ner h LYS 20 Cb 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.27 1ner h LYS 20 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 179.45 177.18 1ner n ARG 21 N -3.62 0.00 -2.69 1.90 3.00 -0.74 -5.00 116.66 109.51 1ner n ARG 21 Ca 0.05 0.00 -0.07 0.00 -0.01 0.00 0.00 57.85 57.82 1ner n ARG 21 Cb 0.52 0.00 0.10 0.00 0.00 0.00 0.00 32.46 33.08 1ner n ARG 21 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.63 178.80 1ner n LYS 22 N 0.00 1.21 -4.30 5.56 4.81 -1.24 -5.13 118.16 119.06 1ner n LYS 22 Ca 0.00 -2.15 -0.28 0.00 -0.87 0.00 0.00 58.31 55.01 1ner n LYS 22 Cb 0.00 -0.32 -0.11 0.00 0.02 0.00 0.00 35.03 34.62 1ner n LYS 22 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1ner s LEU 23 N -3.24 2.80 -0.16 3.14 1.43 -1.25 -5.00 118.68 116.40 1ner s LEU 23 Ca 0.23 -0.58 -0.08 0.00 -1.03 0.00 0.00 54.13 52.67 1ner s LEU 23 Cb 0.42 -1.57 0.07 0.00 0.03 0.00 0.00 46.19 45.13 1ner s LEU 23 CO -0.06 0.15 0.37 -0.94 0.23 0.00 0.00 176.35 176.10 1ner s SER 24 N -2.43 -0.31 0.66 2.29 1.04 -1.26 -3.64 113.70 110.05 1ner s SER 24 Ca 0.21 0.83 0.18 0.00 0.48 0.00 0.00 55.95 57.65 1ner s SER 24 Cb -0.10 0.85 0.97 0.00 0.10 0.00 0.00 66.02 67.85 1ner s SER 24 CO 0.12 -0.20 1.54 -0.07 0.98 0.00 0.00 173.24 175.61 1ner h LEU 25 N 7.54 0.00 -0.06 2.42 3.38 -1.99 0.99 115.31 127.59 1ner h LEU 25 Ca -0.29 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.45 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 0.24 0.00 -1.03 0.28 0.09 0.00 0.00 178.44 178.03 1ner h SER 26 N 0.00 0.20 0.18 -0.43 0.02 -1.94 -2.87 113.55 108.71 1ner h SER 26 Ca 0.04 -0.19 -0.29 0.00 -0.84 0.00 0.00 61.79 60.50 1ner h SER 26 Cb 1.31 -0.06 0.02 0.00 0.14 0.00 0.00 62.40 63.81 1ner h SER 26 CO -0.00 1.10 -1.38 0.00 -1.14 0.00 0.00 176.83 175.40 1ner h ALA 27 N 0.88 0.01 -0.78 3.77 0.00 0.59 -3.03 119.26 120.71 1ner h ALA 27 Ca -0.06 -0.95 -0.05 0.00 0.00 0.00 0.00 54.91 53.86 1ner h ALA 27 Cb 1.74 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 19.79 1ner h ALA 27 CO 0.15 0.73 0.29 -0.07 0.00 0.00 0.00 179.25 180.35 1ner h LEU 28 N -0.09 1.09 -0.36 0.00 4.07 -1.42 0.31 115.31 118.92 1ner h LEU 28 Ca -0.26 -0.19 -0.04 0.00 0.08 0.00 0.00 57.88 57.47 1ner h LEU 28 Cb 1.94 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 43.38 1ner h LEU 28 CO 0.17 0.98 0.07 -1.28 -1.08 0.00 0.00 178.44 177.31 1ner h SER 29 N 1.14 0.57 0.72 -0.43 0.87 -1.62 -2.70 113.55 112.09 1ner h SER 29 Ca 0.26 -0.25 -0.08 0.00 -1.23 0.00 0.00 61.79 60.48 1ner h SER 29 Cb 0.25 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.05 1ner h SER 29 CO -0.02 0.67 -0.40 -0.09 -0.53 0.00 0.00 176.83 176.47 1ner h ARG 30 N 0.44 0.00 -0.01 2.24 2.43 -1.34 -1.46 114.38 116.67 1ner h ARG 30 Ca 0.11 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.21 1ner h ARG 30 Cb 0.34 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 1ner h ARG 30 CO 0.00 0.40 -0.32 1.96 -1.51 0.00 0.00 179.97 180.50 1ner h GLN 31 N 0.00 0.02 0.00 0.20 4.20 -0.05 -3.13 115.11 116.36 1ner h GLN 31 Ca -0.00 -0.01 -0.14 0.00 0.06 0.00 0.00 58.65 58.55 1ner h GLN 31 Cb 0.86 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.61 1ner h GLN 31 CO 0.05 0.34 -2.10 1.19 -0.67 0.00 0.00 178.83 177.64 1ner n PHE 32 N -4.16 0.00 0.00 2.96 3.72 -1.16 -5.02 117.46 113.80 1ner n PHE 32 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1ner n PHE 32 Cb 0.36 -0.67 0.00 0.00 -0.94 0.00 0.00 39.48 38.23 1ner n PHE 32 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ner n GLY 33 N 1.53 3.34 3.63 1.37 0.00 -0.56 -5.07 105.19 109.43 1ner n GLY 33 Ca -0.15 -1.05 -0.57 0.00 0.00 0.00 0.00 46.02 44.25 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 0.00 1.56 -0.90 1.61 4.01 -1.19 -4.77 117.16 117.48 1ner n TYR 34 Ca 0.00 0.75 -0.35 0.00 -0.16 0.00 0.00 57.90 58.15 1ner n TYR 34 Cb 0.00 -2.31 0.08 0.00 -0.31 0.00 0.00 39.34 36.80 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 3.44 -4.30 0.27 -0.72 0.00 -1.26 -4.18 120.51 113.76 1ner n ALA 35 Ca 0.23 -0.74 0.12 0.00 0.00 0.00 0.00 53.44 53.05 1ner n ALA 35 Cb 0.12 -1.40 0.80 0.00 0.00 0.00 0.00 19.45 18.97 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 -1.29 0.00 -0.47 0.00 0.13 -1.88 -2.18 132.00 126.31 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 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 1ner h PRO 36 CO 0.28 0.00 0.10 1.79 -0.23 0.00 0.00 178.00 179.94 1ner h THR 37 N 0.00 1.24 0.00 1.56 1.35 -1.96 -1.23 112.91 113.87 1ner h THR 37 Ca 0.01 -0.86 -0.00 0.00 -0.55 0.00 0.00 66.41 65.00 1ner h THR 37 Cb 0.04 0.91 -0.00 0.00 -1.73 0.00 0.00 68.15 67.37 1ner h THR 37 CO -0.00 0.31 -0.00 0.74 -0.25 0.00 0.00 175.52 176.31 1ner h THR 38 N 0.63 0.00 -0.73 6.82 2.02 -1.69 0.41 112.91 120.37 1ner h THR 38 Ca 0.14 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.48 1ner h THR 38 Cb 0.35 0.00 -0.11 0.00 -1.74 0.00 0.00 68.15 66.66 1ner h THR 38 CO 0.01 0.00 0.18 0.25 0.37 0.00 0.00 175.52 176.32 1ner h LEU 39 N -0.00 0.02 0.00 2.58 5.85 -1.62 0.36 115.31 122.50 1ner h LEU 39 Ca -0.00 0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1ner h LEU 39 Cb 0.00 0.19 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1ner h LEU 39 CO -0.00 -0.03 0.00 0.00 -0.34 0.00 0.00 178.44 178.07 1ner n ALA 40 N -2.65 -0.34 0.00 1.25 0.00 -0.47 -1.83 120.51 116.47 1ner n ALA 40 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1ner n ALA 40 Cb 0.45 0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1ner n ALA 40 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ner n ASN 41 N -1.97 0.00 -0.07 0.00 4.13 0.14 -2.10 115.26 115.40 1ner n ASN 41 Ca 0.00 0.37 0.00 0.00 1.68 0.00 0.00 54.58 56.63 1ner n ASN 41 Cb 0.00 -0.37 0.00 0.00 -1.54 0.00 0.00 39.78 37.87 1ner n ASN 41 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ner n ALA 42 N -1.36 2.10 0.02 5.41 0.00 0.12 -1.98 120.51 124.84 1ner n ALA 42 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 1ner n ALA 42 Cb 0.03 -1.00 -0.13 0.00 0.00 0.00 0.00 19.45 18.35 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 0.05 0.07 -0.25 0.00 3.38 -1.58 -3.40 115.31 113.58 1ner h LEU 43 Ca 0.00 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1ner h LEU 43 Cb 0.04 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1ner h LEU 43 CO 0.00 1.08 0.00 -1.84 0.09 0.00 0.00 178.44 177.77 1ner n GLU 44 N -3.23 0.53 -2.65 1.13 0.28 -1.14 -5.07 120.64 110.50 1ner n GLU 44 Ca -0.11 -0.13 -0.34 0.00 -0.16 0.00 0.00 57.16 56.43 1ner n GLU 44 Cb 1.01 -0.53 -0.05 0.00 1.43 0.00 0.00 31.44 33.30 1ner n GLU 44 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1ner s ARG 45 N -0.11 4.02 -1.13 3.44 3.52 -0.83 -4.88 118.95 122.98 1ner s ARG 45 Ca 0.00 1.30 -0.25 0.00 -0.13 0.00 0.00 55.73 56.65 1ner s ARG 45 Cb 0.00 -2.21 -0.16 0.00 -1.56 0.00 0.00 34.95 31.02 1ner s ARG 45 CO 0.00 -0.23 2.01 0.72 -0.81 0.00 0.00 175.30 176.99 1ner n HIS 46 N -0.67 1.90 -2.72 5.12 8.25 -1.26 -4.50 115.22 121.33 1ner n HIS 46 Ca 0.08 -0.90 -0.06 0.00 -0.26 0.00 0.00 57.72 56.57 1ner n HIS 46 Cb 0.52 -2.59 0.05 0.00 1.12 0.00 0.00 29.99 29.10 1ner n HIS 46 CO 0.00 0.00 0.00 1.87 0.64 0.00 0.00 176.34 178.85 1ner n TRP 47 N 16.68 -2.50 0.16 4.41 -0.00 -1.26 -4.99 117.44 129.94 1ner n TRP 47 Ca 0.43 -1.36 0.10 0.00 -0.00 0.00 0.00 57.50 56.67 1ner n TRP 47 Cb 0.47 1.41 0.52 0.00 -0.00 0.00 0.00 31.31 33.70 1ner n TRP 47 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 177.69 175.39 1ner n PRO 48 N 1.80 0.13 0.21 5.87 -0.02 -1.26 -1.66 135.00 140.07 1ner n PRO 48 Ca 0.08 0.61 0.08 0.00 -2.02 0.00 0.00 63.50 62.24 1ner n PRO 48 Cb 0.64 -1.90 0.47 0.00 -0.02 0.00 0.00 33.50 32.69 1ner n PRO 48 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 1ner h LYS 49 N 0.00 0.00 0.00 -0.52 1.63 -1.96 -1.51 116.57 114.20 1ner h LYS 49 Ca 0.00 0.00 -0.06 0.00 -0.85 0.00 0.00 60.65 59.74 1ner h LYS 49 Cb 0.02 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.64 1ner h LYS 49 CO 0.00 0.28 -0.30 0.78 -3.45 0.00 0.00 179.45 176.76 1ner h GLY 50 N 1.51 0.00 1.71 5.01 0.00 -1.66 -2.20 103.07 107.44 1ner h GLY 50 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.18 1ner h GLY 50 CO 0.04 0.00 -0.57 0.83 0.00 0.00 0.00 176.54 176.84 1ner h GLU 51 N 0.00 0.31 -0.98 4.80 4.39 -1.43 -2.85 114.58 118.82 1ner h GLU 51 Ca -0.00 -0.20 0.00 0.00 0.34 0.00 0.00 59.36 59.50 1ner h GLU 51 Cb 0.69 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 29.32 1ner h GLU 51 CO 0.04 0.79 0.63 1.96 -1.16 0.00 0.00 179.01 181.26 1ner h GLN 52 N 0.23 1.30 0.14 2.33 1.08 -1.27 0.16 115.11 119.08 1ner h GLN 52 Ca 0.00 -0.09 0.01 0.00 -1.45 0.00 0.00 58.65 57.12 1ner h GLN 52 Cb 1.06 -0.29 -0.03 0.00 -0.05 0.00 0.00 27.48 28.18 1ner h GLN 52 CO 0.09 0.88 -0.21 0.82 -0.95 0.00 0.00 178.83 179.46 1ner h ILE 53 N 1.33 0.53 0.29 2.54 2.04 -1.44 0.51 117.51 123.32 1ner h ILE 53 Ca 0.36 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.20 1ner h ILE 53 Cb -0.12 0.53 0.00 0.00 -0.74 0.00 0.00 36.82 36.49 1ner h ILE 53 CO -0.07 0.00 -0.14 0.40 0.00 0.00 0.00 178.15 178.34 1ner h ILE 54 N -0.41 0.74 -0.53 -0.67 2.04 -1.38 -2.85 117.51 114.44 1ner h ILE 54 Ca 0.02 -0.31 0.04 0.00 1.00 0.00 0.00 64.86 65.61 1ner h ILE 54 Cb 0.42 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.39 1ner h ILE 54 CO -0.10 0.07 0.35 0.00 0.00 0.00 0.00 178.15 178.47 1ner h ALA 55 N 0.10 1.76 -0.62 1.87 0.00 -0.58 -0.83 119.26 120.96 1ner h ALA 55 Ca -0.04 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.93 1ner h ALA 55 Cb 0.41 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 1ner h ALA 55 CO 0.07 0.18 0.41 -0.97 0.00 0.00 0.00 179.25 178.94 1ner h ASN 56 N 0.59 0.44 -0.37 0.00 -1.24 0.26 -0.75 115.58 114.52 1ner h ASN 56 Ca 0.22 0.01 -0.02 0.00 0.71 0.00 0.00 56.30 57.22 1ner h ASN 56 Cb 0.12 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 39.07 1ner h ASN 56 CO -0.06 0.27 0.18 0.00 -1.29 0.00 0.00 177.43 176.53 1ner h ALA 57 N 1.68 1.55 -0.25 1.57 0.00 -1.04 -0.87 119.26 121.90 1ner h ALA 57 Ca 0.28 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ner h ALA 57 Cb 0.45 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ner h ALA 57 CO -0.08 0.36 0.00 1.28 0.00 0.00 0.00 179.25 180.81 1ner n LEU 58 N -4.39 1.90 -0.94 0.00 4.77 -0.32 -4.88 117.00 113.14 1ner n LEU 58 Ca 0.03 -0.85 -0.12 0.00 -0.03 0.00 0.00 56.01 55.04 1ner n LEU 58 Cb 0.13 -0.16 -0.05 0.00 -2.33 0.00 0.00 43.42 41.01 1ner n LEU 58 CO 0.37 0.42 -0.12 1.21 -1.33 0.00 0.00 177.39 177.94 1ner n GLU 59 N 0.49 -1.61 -0.78 3.23 2.13 -0.33 -4.94 120.64 118.83 1ner n GLU 59 Ca 0.15 0.93 0.00 0.00 0.66 0.00 0.00 57.16 58.90 1ner n GLU 59 Cb 0.34 -5.32 0.00 0.00 0.27 0.00 0.00 31.44 26.74 1ner n GLU 59 CO 0.00 0.00 0.00 -2.37 -0.41 0.00 0.00 177.13 174.35 1ner n THR 60 N -2.27 0.00 -4.21 6.31 5.66 -1.11 -5.02 114.28 113.65 1ner n THR 60 Ca -0.12 0.00 -0.29 0.00 -3.05 0.00 0.00 64.05 60.59 1ner n THR 60 Cb 0.59 -0.43 -0.09 0.00 -1.55 0.00 0.00 70.33 68.85 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 -0.06 2.24 0.38 1.09 3.01 -1.26 -4.34 119.74 120.80 1ner s LYS 61 Ca 0.00 -1.02 0.05 0.00 -1.01 0.00 0.00 55.97 53.99 1ner s LYS 61 Cb 0.00 -2.35 0.74 0.00 -1.01 0.00 0.00 37.83 35.21 1ner s LYS 61 CO 0.00 0.50 2.02 -1.00 0.51 0.00 0.00 175.35 177.38 1ner h PRO 62 N 3.38 0.67 0.00 -1.68 0.13 -1.90 -1.46 132.00 131.14 1ner h PRO 62 Ca -0.48 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1ner h PRO 62 Cb 1.17 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.16 1ner h PRO 62 CO 0.55 0.46 0.03 -0.85 -0.23 0.00 0.00 178.00 177.96 1ner n GLU 63 N -4.44 0.00 -0.02 0.86 -0.00 -1.26 -1.01 120.64 114.76 1ner n GLU 63 Ca 0.04 0.21 -0.19 0.00 -0.00 0.00 0.00 57.16 57.22 1ner n GLU 63 Cb 0.07 -1.53 -0.14 0.00 -0.00 0.00 0.00 31.44 29.84 1ner n GLU 63 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 1ner n VAL 64 N -1.17 1.70 0.39 3.84 0.31 -0.55 -3.63 118.33 119.22 1ner n VAL 64 Ca 0.00 -0.67 0.12 0.00 -0.01 0.00 0.00 64.34 63.78 1ner n VAL 64 Cb 0.03 -1.56 0.14 0.00 -0.91 0.00 0.00 33.84 31.54 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 0.05 0.00 -2.05 2.52 5.03 -1.20 -3.40 117.51 118.46 1ner h ILE 65 Ca -0.44 -0.70 -0.57 0.00 -0.12 0.00 0.00 64.86 63.03 1ner h ILE 65 Cb 2.02 1.34 -0.40 0.00 -3.03 0.00 0.00 36.82 36.76 1ner h ILE 65 CO 0.06 0.00 -1.00 0.79 -0.68 0.00 0.00 178.15 177.31 1ner n TRP 66 N -2.41 0.43 0.07 1.37 8.01 -0.39 -3.49 117.44 121.03 1ner n TRP 66 Ca 0.03 -3.68 -0.11 0.00 -1.31 0.00 0.00 57.50 52.43 1ner n TRP 66 Cb 0.48 -0.38 -0.01 0.00 -2.01 0.00 0.00 31.31 29.39 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 4.06 0.33 0.00 -0.99 0.13 -1.77 -3.20 132.00 130.55 1ner h PRO 67 Ca 0.10 -0.33 0.00 0.00 -0.87 0.00 0.00 66.00 64.90 1ner h PRO 67 Cb 0.84 0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.06 1ner h PRO 67 CO 0.53 1.01 0.00 0.45 -0.23 0.00 0.00 178.00 179.77 1ner n SER 68 N -3.74 0.00 -0.05 1.44 2.88 -1.26 -2.92 113.62 109.97 1ner n SER 68 Ca -0.05 -0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.16 1ner n SER 68 Cb 0.79 -0.16 -0.16 0.00 -0.75 0.00 0.00 64.21 63.93 1ner n SER 68 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ner n ARG 69 N -1.16 0.72 -4.08 -1.46 1.74 -1.21 -4.92 116.66 106.28 1ner n ARG 69 Ca 0.14 -0.10 -0.36 0.00 -0.77 0.00 0.00 57.85 56.76 1ner n ARG 69 Cb 0.14 -1.50 -0.08 0.00 -1.02 0.00 0.00 32.46 30.00 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 -2.97 3.39 -0.51 -1.55 2.02 -1.15 -5.04 117.35 111.54 1ner s TYR 70 Ca -0.09 0.35 0.06 0.00 -0.37 0.00 0.00 57.07 57.03 1ner s TYR 70 Cb 0.10 -1.90 0.20 0.00 -0.40 0.00 0.00 41.96 39.96 1ner s TYR 70 CO 0.84 0.57 0.78 0.94 -1.57 0.00 0.00 175.55 177.10 1ner n GLN 71 N 2.23 0.59 0.06 -0.62 7.27 -1.26 -4.92 117.38 120.73 1ner n GLN 71 Ca -0.19 -1.94 0.00 0.00 0.07 0.00 0.00 57.00 54.94 1ner n GLN 71 Cb 0.54 -1.44 0.00 0.00 2.41 0.00 0.00 30.24 31.75 1ner n GLN 71 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1ner n ALA 72 N 2.61 0.00 0.00 1.69 0.00 -1.26 -5.04 120.51 118.51 1ner n ALA 72 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1ner n ALA 72 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 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 -1.39 2.14 0.63 0.00 0.00 -1.26 -5.35 105.19 99.95 1ner n GLY 73 Ca 0.00 -0.34 0.13 0.00 0.00 0.00 0.00 46.02 45.81 1ner n GLY 73 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50