#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 0.00 0.00 7.64 -1.26 -4.81 113.62 115.19 1ner n SER 2 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1ner n SER 2 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 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 3.15 0.00 0.00 6.43 2.85 -1.26 -4.25 115.26 122.18 1ner n ASN 3 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1ner n ASN 3 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1ner n ASN 3 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 1ner n GLU 4 N 6.75 0.00 0.00 1.20 2.13 -1.26 -4.93 120.64 124.53 1ner n GLU 4 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1ner n GLU 4 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1ner n GLU 4 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 1ner n LYS 5 N 0.00 0.85 0.00 5.31 -0.00 -1.26 -4.55 118.16 118.51 1ner n LYS 5 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1ner n LYS 5 Cb 0.06 -1.09 0.00 0.00 -0.00 0.00 0.00 35.03 34.01 1ner n LYS 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ner n ALA 6 N 0.56 0.00 0.15 0.58 0.00 -1.26 -4.72 120.51 115.82 1ner n ALA 6 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.52 1ner n ALA 6 Cb 0.42 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.75 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 0.76 -1.13 0.00 5.12 -1.26 -5.00 116.66 115.15 1ner n ARG 7 Ca 0.00 -0.12 -0.29 0.00 -1.93 0.00 0.00 57.85 55.51 1ner n ARG 7 Cb 0.00 -1.36 0.16 0.00 -1.16 0.00 0.00 32.46 30.10 1ner n ARG 7 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1ner s ASP 8 N -3.60 2.88 -0.22 0.55 1.01 -1.26 -4.81 116.67 111.21 1ner s ASP 8 Ca -0.03 1.36 -0.29 0.00 0.71 0.00 0.00 52.55 54.30 1ner s ASP 8 Cb 0.11 -2.04 -0.03 0.00 1.01 0.00 0.00 42.92 41.97 1ner s ASP 8 CO 0.68 -2.99 1.65 0.26 0.21 0.00 0.00 175.17 174.97 1ner s TRP 9 N -2.91 2.05 1.00 4.23 0.52 -1.22 -4.89 118.94 117.72 1ner s TRP 9 Ca 0.65 0.53 -0.19 0.00 0.02 0.00 0.00 56.10 57.10 1ner s TRP 9 Cb -0.19 -4.00 -0.14 0.00 -1.15 0.00 0.00 33.47 27.99 1ner s TRP 9 CO 0.58 -3.01 -0.89 0.72 0.02 0.00 0.00 176.95 174.37 1ner n HIS 10 N 8.62 -3.96 -0.05 -1.98 8.25 -1.26 -4.34 115.22 120.51 1ner n HIS 10 Ca 0.19 0.15 0.14 0.00 -0.26 0.00 0.00 57.72 57.94 1ner n HIS 10 Cb 0.45 -1.44 0.55 0.00 1.12 0.00 0.00 29.99 30.67 1ner n HIS 10 CO 0.00 0.00 0.00 0.07 0.64 0.00 0.00 176.34 177.05 1ner h ARG 11 N -1.06 0.28 0.00 -0.41 0.11 -1.92 0.13 114.38 111.50 1ner h ARG 11 Ca -0.43 -0.02 -0.17 0.00 0.10 0.00 0.00 59.98 59.46 1ner h ARG 11 Cb 1.32 -0.06 -0.03 0.00 1.11 0.00 0.00 29.97 32.31 1ner h ARG 11 CO 0.24 0.18 -1.18 0.00 0.10 0.00 0.00 179.97 179.31 1ner h ALA 12 N 1.72 0.64 0.00 0.08 0.00 -1.99 -3.17 119.26 116.55 1ner h ALA 12 Ca 0.26 -0.83 -0.03 0.00 0.00 0.00 0.00 54.91 54.31 1ner h ALA 12 Cb 0.64 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.59 1ner h ALA 12 CO -0.06 0.95 -0.14 -0.44 0.00 0.00 0.00 179.25 179.56 1ner h ASP 13 N 0.00 0.00 0.05 0.00 3.32 -1.26 0.75 116.42 119.28 1ner h ASP 13 Ca -0.12 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.92 1ner h ASP 13 Cb 1.60 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.15 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 0.08 -0.03 -1.35 2.07 -1.36 -2.81 116.25 112.85 1ner h VAL 14 Ca -0.00 -1.01 -0.03 0.00 0.82 0.00 0.00 66.70 66.48 1ner h VAL 14 Cb 0.52 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1ner h VAL 14 CO 0.02 0.03 -0.11 0.40 0.02 0.00 0.00 177.57 177.92 1ner h ILE 15 N -1.02 1.47 -0.45 4.57 2.04 -1.52 -0.03 117.51 122.58 1ner h ILE 15 Ca -0.01 -1.56 0.06 0.00 1.00 0.00 0.00 64.86 64.35 1ner h ILE 15 Cb 0.10 2.42 -0.05 0.00 -0.74 0.00 0.00 36.82 38.55 1ner h ILE 15 CO 0.01 0.42 0.15 0.00 0.00 0.00 0.00 178.15 178.73 1ner h ALA 16 N 0.40 0.54 0.27 1.87 0.00 0.32 1.44 119.26 124.09 1ner h ALA 16 Ca -0.01 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ner h ALA 16 Cb 0.75 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.59 1ner h ALA 16 CO 0.02 -0.25 -0.13 0.78 0.00 0.00 0.00 179.25 179.68 1ner h GLY 17 N 0.31 -0.38 0.69 0.00 0.00 -1.52 -0.22 103.07 101.95 1ner h GLY 17 Ca 0.22 0.14 -0.03 0.00 0.00 0.00 0.00 47.33 47.65 1ner h GLY 17 CO -0.23 -0.14 -0.33 1.41 0.00 0.00 0.00 176.54 177.25 1ner h LEU 18 N -0.57 -0.78 -0.11 3.11 3.38 -0.65 -2.02 115.31 117.67 1ner h LEU 18 Ca -0.04 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1ner h LEU 18 Cb 0.42 0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1ner h LEU 18 CO 0.06 -0.48 0.18 1.17 0.09 0.00 0.00 178.44 179.47 1ner n LYS 19 N -4.96 0.01 0.09 1.13 4.81 0.49 -0.86 118.16 118.87 1ner n LYS 19 Ca -0.11 0.36 0.20 0.00 -0.87 0.00 0.00 58.31 57.88 1ner n LYS 19 Cb 0.36 -1.72 0.75 0.00 0.02 0.00 0.00 35.03 34.44 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 3.64 -0.24 -3.30 116.57 118.31 1ner h LYS 20 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 1ner h LYS 20 Cb 0.36 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.18 1ner h LYS 20 CO 0.00 0.00 0.00 0.54 -2.27 0.00 0.00 179.45 177.72 1ner n ARG 21 N -3.96 0.00 -2.70 1.90 1.74 -0.04 -4.99 116.66 108.61 1ner n ARG 21 Ca 0.07 0.00 -0.08 0.00 -0.77 0.00 0.00 57.85 57.07 1ner n ARG 21 Cb 0.55 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 32.08 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 1.17 -4.35 5.56 5.02 -1.24 -5.13 118.16 119.19 1ner n LYS 22 Ca 0.00 -2.20 -0.29 0.00 -2.02 0.00 0.00 58.31 53.80 1ner n LYS 22 Cb 0.00 -0.43 -0.12 0.00 -0.02 0.00 0.00 35.03 34.46 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 -3.10 2.57 -0.16 -0.35 1.43 -1.26 -4.98 118.68 112.83 1ner s LEU 23 Ca 0.24 -0.68 -0.10 0.00 -1.03 0.00 0.00 54.13 52.57 1ner s LEU 23 Cb 0.41 -1.39 0.05 0.00 0.03 0.00 0.00 46.19 45.29 1ner s LEU 23 CO -0.06 0.16 0.39 -0.94 0.23 0.00 0.00 176.35 176.13 1ner s SER 24 N -2.28 -0.47 0.49 2.29 1.04 -1.26 -3.41 113.70 110.09 1ner s SER 24 Ca 0.18 0.84 0.32 0.00 0.48 0.00 0.00 55.95 57.76 1ner s SER 24 Cb -0.10 0.74 1.42 0.00 0.10 0.00 0.00 66.02 68.18 1ner s SER 24 CO 0.09 -0.18 1.75 -0.07 0.98 0.00 0.00 173.24 175.81 1ner h LEU 25 N 6.86 0.16 -1.38 2.42 3.38 -1.99 0.94 115.31 125.70 1ner h LEU 25 Ca -0.35 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.59 1ner h LEU 25 Cb 1.18 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 1ner h LEU 25 CO 0.30 -0.00 -0.31 0.28 0.09 0.00 0.00 178.44 178.80 1ner h SER 26 N 0.13 0.00 0.07 -0.43 0.02 -1.96 -1.22 113.55 110.15 1ner h SER 26 Ca 0.64 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.48 1ner h SER 26 Cb 2.23 0.00 0.01 0.00 0.14 0.00 0.00 62.40 64.77 1ner h SER 26 CO -0.15 0.31 -0.49 0.00 -1.14 0.00 0.00 176.83 175.36 1ner h ALA 27 N 1.69 -0.02 -0.04 3.77 0.00 0.49 -3.05 119.26 122.11 1ner h ALA 27 Ca -0.00 -0.65 -0.02 0.00 0.00 0.00 0.00 54.91 54.23 1ner h ALA 27 Cb 0.55 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1ner h ALA 27 CO 0.04 0.24 -0.09 -0.07 0.00 0.00 0.00 179.25 179.38 1ner h LEU 28 N -0.68 0.05 0.60 0.00 3.38 -1.34 0.67 115.31 117.98 1ner h LEU 28 Ca -0.10 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 1ner h LEU 28 Cb 1.34 -0.01 0.01 0.00 0.09 0.00 0.00 40.66 42.08 1ner h LEU 28 CO 0.06 0.14 -0.29 -1.28 0.09 0.00 0.00 178.44 177.17 1ner h SER 29 N 0.05 -0.68 0.93 -0.43 0.87 -1.29 -3.21 113.55 109.80 1ner h SER 29 Ca 0.01 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1ner h SER 29 Cb 0.19 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1ner h SER 29 CO 0.01 -0.30 0.00 0.08 -0.53 0.00 0.00 176.83 176.09 1ner h ARG 30 N -1.18 0.00 0.00 2.24 0.11 -1.44 -2.08 114.38 112.03 1ner h ARG 30 Ca -0.08 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.94 1ner h ARG 30 Cb 0.62 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.69 1ner h ARG 30 CO 0.14 0.00 -0.25 1.96 0.10 0.00 0.00 179.97 181.91 1ner h GLN 31 N 0.00 0.00 0.00 0.08 4.20 -0.86 -3.14 115.11 115.40 1ner h GLN 31 Ca 0.00 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.53 1ner h GLN 31 Cb 0.47 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.21 1ner h GLN 31 CO 0.00 0.25 -1.94 1.19 -0.67 0.00 0.00 178.83 177.67 1ner n PHE 32 N -4.24 0.00 0.00 2.96 3.01 -1.12 -5.03 117.46 113.04 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 0.31 -0.62 0.00 0.00 -0.01 0.00 0.00 39.48 39.16 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 1.89 3.64 3.62 1.37 0.00 -0.80 -5.09 105.19 109.82 1ner n GLY 33 Ca -0.17 -0.92 -0.57 0.00 0.00 0.00 0.00 46.02 44.36 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 1.48 -0.72 1.61 4.01 -1.21 -4.74 117.16 117.59 1ner n TYR 34 Ca 0.00 0.76 -0.32 0.00 -0.16 0.00 0.00 57.90 58.18 1ner n TYR 34 Cb 0.00 -2.30 0.15 0.00 -0.31 0.00 0.00 39.34 36.88 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 3.16 -3.11 -0.15 -0.72 0.00 -1.26 -4.04 120.51 114.40 1ner n ALA 35 Ca 0.22 -0.90 0.03 0.00 0.00 0.00 0.00 53.44 52.79 1ner n ALA 35 Cb 0.12 -1.73 0.33 0.00 0.00 0.00 0.00 19.45 18.17 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 -1.85 0.79 -0.42 0.00 0.13 -1.89 -2.59 132.00 126.17 1ner h PRO 36 Ca -0.48 -0.05 0.05 0.00 -0.87 0.00 0.00 66.00 64.65 1ner h PRO 36 Cb 1.31 -0.18 -0.05 0.00 0.13 0.00 0.00 31.00 32.22 1ner h PRO 36 CO 0.37 0.52 0.16 1.79 -0.23 0.00 0.00 178.00 180.61 1ner h THR 37 N 0.82 0.88 0.19 1.56 1.35 -1.98 0.20 112.91 115.92 1ner h THR 37 Ca 0.25 -0.11 -0.01 0.00 -0.55 0.00 0.00 66.41 65.99 1ner h THR 37 Cb -0.00 0.52 -0.01 0.00 -1.73 0.00 0.00 68.15 66.93 1ner h THR 37 CO -0.06 0.06 -0.20 0.74 -0.25 0.00 0.00 175.52 175.81 1ner h THR 38 N 0.33 0.00 -0.74 6.82 2.02 -1.78 -0.54 112.91 119.01 1ner h THR 38 Ca 0.20 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.53 1ner h THR 38 Cb 0.18 0.00 -0.10 0.00 -1.74 0.00 0.00 68.15 66.48 1ner h THR 38 CO -0.19 0.00 0.22 0.25 0.37 0.00 0.00 175.52 176.17 1ner h LEU 39 N -0.39 0.11 0.00 2.58 5.85 -1.52 -0.42 115.31 121.53 1ner h LEU 39 Ca -0.02 0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1ner h LEU 39 Cb 0.34 0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.53 1ner h LEU 39 CO -0.03 0.01 0.00 0.00 -0.34 0.00 0.00 178.44 178.08 1ner n ALA 40 N -2.60 -0.23 0.00 1.25 0.00 0.69 -1.63 120.51 117.98 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 0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.98 1ner n ALA 40 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1ner n ASN 41 N -1.56 0.00 0.00 0.00 4.05 -0.24 -1.99 115.26 115.52 1ner n ASN 41 Ca 0.00 0.04 0.09 0.00 0.45 0.00 0.00 54.58 55.17 1ner n ASN 41 Cb 0.00 -0.04 0.55 0.00 1.23 0.00 0.00 39.78 41.52 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 -0.96 2.18 0.79 5.20 0.00 -0.18 -2.56 120.51 124.98 1ner n ALA 42 Ca 0.00 -0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.45 1ner n ALA 42 Cb 0.01 -1.31 0.32 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.04 0.52 0.00 0.00 4.77 -0.84 -4.43 117.00 115.97 1ner n LEU 43 Ca 0.14 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.39 1ner n LEU 43 Cb 0.08 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1ner n LEU 43 CO 0.11 -0.01 -0.33 -0.62 -1.33 0.00 0.00 177.39 175.21 1ner n GLU 44 N -1.84 1.62 -2.44 3.23 1.02 -1.06 -5.04 120.64 116.14 1ner n GLU 44 Ca 0.05 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.77 1ner n GLU 44 Cb 0.39 -0.83 -0.03 0.00 -0.02 0.00 0.00 31.44 30.95 1ner n GLU 44 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1ner s ARG 45 N -1.65 4.48 -0.61 3.49 0.52 -1.12 -4.89 118.95 119.18 1ner s ARG 45 Ca 0.00 1.76 -0.27 0.00 -0.52 0.00 0.00 55.73 56.71 1ner s ARG 45 Cb 0.00 -3.32 -0.11 0.00 0.52 0.00 0.00 34.95 32.05 1ner s ARG 45 CO 0.00 -0.15 2.46 -2.39 0.02 0.00 0.00 175.30 175.24 1ner n HIS 46 N 3.35 1.24 -2.75 -0.53 1.44 -1.26 -4.71 115.22 112.00 1ner n HIS 46 Ca 0.07 0.15 -0.08 0.00 -2.01 0.00 0.00 57.72 55.85 1ner n HIS 46 Cb 0.46 -2.56 0.05 0.00 0.12 0.00 0.00 29.99 28.06 1ner n HIS 46 CO 0.00 0.00 0.00 1.87 -2.81 0.00 0.00 176.34 175.40 1ner n TRP 47 N 15.09 -3.26 0.19 -1.40 -0.00 -1.26 -5.00 117.44 121.80 1ner n TRP 47 Ca 0.43 -1.69 0.11 0.00 -0.00 0.00 0.00 57.50 56.36 1ner n TRP 47 Cb 0.44 1.55 0.60 0.00 -0.00 0.00 0.00 31.31 33.90 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 4.01 0.00 0.00 5.87 0.11 -1.93 -1.32 132.00 138.74 1ner h PRO 48 Ca -0.14 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 65.86 1ner h PRO 48 Cb 1.04 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 1ner h PRO 48 CO 0.29 0.00 -0.52 -0.22 -0.21 0.00 0.00 178.00 177.34 1ner h LYS 49 N 0.00 0.00 0.00 1.05 1.63 -1.98 -2.32 116.57 114.95 1ner h LYS 49 Ca 0.00 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.67 1ner h LYS 49 Cb 0.22 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.83 1ner h LYS 49 CO 0.00 0.52 -0.62 0.78 -3.45 0.00 0.00 179.45 176.68 1ner h GLY 50 N 1.69 0.00 1.86 5.01 0.00 -1.62 -2.71 103.07 107.31 1ner h GLY 50 Ca -0.01 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 1ner h GLY 50 CO 0.07 0.00 -0.52 0.83 0.00 0.00 0.00 176.54 176.92 1ner h GLU 51 N 0.00 0.15 -0.62 4.80 5.08 -1.51 -2.43 114.58 120.05 1ner h GLU 51 Ca -0.01 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1ner h GLU 51 Cb 1.18 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 1ner h GLU 51 CO 0.08 0.64 0.32 1.96 -1.00 0.00 0.00 179.01 181.00 1ner h GLN 52 N 0.12 0.87 0.04 2.33 1.08 -1.10 0.52 115.11 118.97 1ner h GLN 52 Ca 0.00 -0.10 0.02 0.00 -1.45 0.00 0.00 58.65 57.12 1ner h GLN 52 Cb 0.96 -0.17 -0.02 0.00 -0.05 0.00 0.00 27.48 28.20 1ner h GLN 52 CO 0.08 0.66 -0.13 0.82 -0.95 0.00 0.00 178.83 179.30 1ner h ILE 53 N 0.87 0.68 0.24 2.54 2.04 -1.36 0.74 117.51 123.26 1ner h ILE 53 Ca 0.22 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.07 1ner h ILE 53 Cb 0.06 0.68 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1ner h ILE 53 CO -0.03 0.00 -0.11 0.40 0.00 0.00 0.00 178.15 178.40 1ner h ILE 54 N -0.25 0.83 -0.54 -0.67 2.04 -1.37 -2.95 117.51 114.60 1ner h ILE 54 Ca 0.03 -0.53 0.02 0.00 1.00 0.00 0.00 64.86 65.39 1ner h ILE 54 Cb 0.28 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.46 1ner h ILE 54 CO -0.10 0.11 0.36 0.00 0.00 0.00 0.00 178.15 178.52 1ner h ALA 55 N 0.08 1.68 -0.75 1.87 0.00 -0.81 -0.43 119.26 120.90 1ner h ALA 55 Ca -0.03 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 54.98 1ner h ALA 55 Cb 0.43 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.98 1ner h ALA 55 CO 0.05 0.28 0.50 -0.97 0.00 0.00 0.00 179.25 179.11 1ner h ASN 56 N 0.67 0.45 -0.71 0.00 -0.73 0.67 -0.27 115.58 115.66 1ner h ASN 56 Ca 0.21 0.02 -0.03 0.00 1.87 0.00 0.00 56.30 58.37 1ner h ASN 56 Cb 0.01 -0.07 -0.03 0.00 0.27 0.00 0.00 38.32 38.50 1ner h ASN 56 CO -0.05 0.24 0.35 0.00 -0.37 0.00 0.00 177.43 177.60 1ner h ALA 57 N 1.64 0.92 -0.22 1.57 0.00 -0.95 -1.43 119.26 120.79 1ner h ALA 57 Ca 0.36 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1ner h ALA 57 Cb 0.73 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1ner h ALA 57 CO -0.12 0.48 0.00 1.28 0.00 0.00 0.00 179.25 180.89 1ner n LEU 58 N -4.43 1.45 -1.63 0.00 4.77 -0.22 -4.86 117.00 112.08 1ner n LEU 58 Ca 0.06 -0.67 -0.16 0.00 -0.03 0.00 0.00 56.01 55.21 1ner n LEU 58 Cb 0.13 -0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.02 1ner n LEU 58 CO 0.39 0.34 -0.16 -0.62 -1.33 0.00 0.00 177.39 176.00 1ner n GLU 59 N 0.23 -1.46 -1.49 3.23 1.02 -0.54 -4.92 120.64 116.71 1ner n GLU 59 Ca 0.12 0.91 0.00 0.00 -0.02 0.00 0.00 57.16 58.17 1ner n GLU 59 Cb 0.26 -5.26 0.00 0.00 -0.02 0.00 0.00 31.44 26.42 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 -2.32 0.00 -4.08 2.62 5.66 -1.00 -5.00 114.28 110.15 1ner n THR 60 Ca -0.16 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.53 1ner n THR 60 Cb 0.54 -0.48 -0.07 0.00 -1.55 0.00 0.00 70.33 68.77 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 -1.93 2.89 0.62 1.09 3.01 -1.26 -4.39 119.74 119.76 1ner s LYS 61 Ca 0.00 -0.65 0.34 0.00 -1.01 0.00 0.00 55.97 54.64 1ner s LYS 61 Cb 0.00 -2.74 1.98 0.00 -1.01 0.00 0.00 37.83 36.06 1ner s LYS 61 CO 0.00 0.58 2.26 -1.00 0.51 0.00 0.00 175.35 177.71 1ner h PRO 62 N 3.53 0.00 0.00 -1.68 0.13 -1.92 0.10 132.00 132.15 1ner h PRO 62 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.64 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.80 1ner n GLU 63 N -3.60 0.00 -0.03 0.86 4.71 -1.26 -1.56 120.64 119.76 1ner n GLU 63 Ca -0.02 0.43 -0.09 0.00 -0.01 0.00 0.00 57.16 57.47 1ner n GLU 63 Cb 0.11 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 28.90 1ner n GLU 63 CO 0.00 0.00 0.00 0.28 0.09 0.00 0.00 177.13 177.50 1ner n VAL 64 N -1.48 1.60 0.11 2.62 0.31 0.02 -3.57 118.33 117.93 1ner n VAL 64 Ca 0.01 -0.80 0.10 0.00 -0.01 0.00 0.00 64.34 63.64 1ner n VAL 64 Cb 0.04 -1.01 0.01 0.00 -0.91 0.00 0.00 33.84 31.97 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 0.00 0.08 -2.35 2.52 2.04 -1.43 -3.39 117.51 114.98 1ner h ILE 65 Ca -0.31 -1.15 -0.59 0.00 1.00 0.00 0.00 64.86 63.81 1ner h ILE 65 Cb 2.04 1.63 -0.40 0.00 -0.74 0.00 0.00 36.82 39.35 1ner h ILE 65 CO 0.07 0.05 -0.84 0.79 0.00 0.00 0.00 178.15 178.22 1ner n TRP 66 N -2.76 1.23 0.09 1.37 8.01 -0.76 -3.44 117.44 121.18 1ner n TRP 66 Ca -0.01 -3.80 -0.04 0.00 -1.31 0.00 0.00 57.50 52.34 1ner n TRP 66 Cb 0.59 -0.31 -0.02 0.00 -2.01 0.00 0.00 31.31 29.56 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 4.72 -0.26 0.00 -0.99 0.13 -1.77 -3.25 132.00 130.57 1ner h PRO 67 Ca 0.17 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1ner h PRO 67 Cb 0.81 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1ner h PRO 67 CO 0.59 -0.18 0.00 0.45 -0.23 0.00 0.00 178.00 178.63 1ner n SER 68 N -3.78 0.00 -0.08 1.44 2.88 -1.26 -1.06 113.62 111.75 1ner n SER 68 Ca -0.03 0.00 -0.07 0.00 -1.33 0.00 0.00 58.87 57.43 1ner n SER 68 Cb 0.11 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.42 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 -0.66 0.97 -1.57 -1.46 5.12 -1.23 -5.00 116.66 112.84 1ner n ARG 69 Ca 0.00 -0.03 -0.03 0.00 -1.93 0.00 0.00 57.85 55.87 1ner n ARG 69 Cb 0.00 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 29.83 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 -2.63 -2.00 -3.19 -1.55 4.01 -0.23 -5.12 117.16 106.45 1ner n TYR 70 Ca -0.27 -0.27 0.02 0.00 -0.16 0.00 0.00 57.90 57.21 1ner n TYR 70 Cb 1.04 -0.06 -0.01 0.00 -0.31 0.00 0.00 39.34 40.00 1ner n TYR 70 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1ner s GLN 71 N -2.29 0.72 0.00 -0.72 2.00 -1.26 -4.88 119.66 113.22 1ner s GLN 71 Ca 0.05 0.04 0.00 0.00 -2.00 0.00 0.00 55.36 53.45 1ner s GLN 71 Cb -0.00 0.14 0.00 0.00 0.80 0.00 0.00 33.01 33.94 1ner s GLN 71 CO 0.03 -1.14 0.00 0.00 -0.50 0.00 0.00 175.29 173.69 1ner n ALA 72 N 4.80 0.00 -0.58 1.58 0.00 -1.26 -4.89 120.51 120.16 1ner n ALA 72 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.23 1ner n ALA 72 Cb 0.56 -0.90 0.21 0.00 0.00 0.00 0.00 19.45 19.32 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 -0.68 -1.90 0.61 0.00 0.00 -1.26 -5.27 105.19 96.69 1ner n GLY 73 Ca 0.00 -0.98 0.13 0.00 0.00 0.00 0.00 46.02 45.17 1ner n GLY 73 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11