#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 -0.85 0.00 0.00 3.41 -1.26 -4.78 113.62 110.14 1ner n SER 2 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1ner n SER 2 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1ner n SER 2 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1ner n ASN 3 N -3.61 0.00 -4.08 4.04 2.85 -1.26 -5.11 115.26 108.10 1ner n ASN 3 Ca 0.00 0.00 -0.31 0.00 -0.11 0.00 0.00 54.58 54.16 1ner n ASN 3 Cb 0.00 0.00 0.13 0.00 1.24 0.00 0.00 39.78 41.15 1ner n ASN 3 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 1ner n GLU 4 N -0.61 -1.27 -3.15 1.20 0.28 -1.26 -4.11 120.64 111.72 1ner n GLU 4 Ca 0.00 -0.36 -0.16 0.00 -0.16 0.00 0.00 57.16 56.48 1ner n GLU 4 Cb 0.00 -1.46 0.01 0.00 1.43 0.00 0.00 31.44 31.43 1ner n GLU 4 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1ner n LYS 5 N -0.72 -1.98 0.00 3.44 4.81 -1.26 -4.89 118.16 117.57 1ner n LYS 5 Ca 0.01 1.69 0.00 0.00 -0.87 0.00 0.00 58.31 59.13 1ner n LYS 5 Cb 0.60 -4.47 0.00 0.00 0.02 0.00 0.00 35.03 31.18 1ner n LYS 5 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ner n ALA 6 N -0.82 0.00 -0.08 3.14 0.00 -1.26 -5.01 120.51 116.49 1ner n ALA 6 Ca -0.00 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.37 1ner n ALA 6 Cb 0.55 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.97 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 -1.63 0.46 0.00 0.00 5.12 -1.26 -4.99 116.66 114.36 1ner n ARG 7 Ca 0.00 0.28 0.00 0.00 -1.93 0.00 0.00 57.85 56.20 1ner n ARG 7 Cb 0.00 -1.42 0.00 0.00 -1.16 0.00 0.00 32.46 29.88 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 -4.32 -1.16 -4.62 0.55 8.00 -1.26 -4.86 116.55 108.88 1ner n ASP 8 Ca -0.11 -0.39 -0.43 0.00 0.71 0.00 0.00 54.79 54.57 1ner n ASP 8 Cb 0.41 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.48 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 -0.97 1.71 0.73 1.24 0.52 -1.12 -4.93 118.94 116.12 1ner s TRP 9 Ca 0.00 0.44 -0.17 0.00 0.02 0.00 0.00 56.10 56.39 1ner s TRP 9 Cb 0.00 -4.04 -0.11 0.00 -1.15 0.00 0.00 33.47 28.17 1ner s TRP 9 CO 0.00 -3.54 -0.11 0.72 0.02 0.00 0.00 176.95 174.04 1ner n HIS 10 N 9.56 -2.91 -0.08 -1.98 8.25 -1.26 -4.39 115.22 122.40 1ner n HIS 10 Ca 0.23 0.27 0.26 0.00 -0.26 0.00 0.00 57.72 58.21 1ner n HIS 10 Cb 0.45 -1.68 0.72 0.00 1.12 0.00 0.00 29.99 30.59 1ner n HIS 10 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ner h ARG 11 N -0.46 0.00 0.00 -0.41 3.08 -1.95 0.67 114.38 115.31 1ner h ARG 11 Ca -0.43 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.39 1ner h ARG 11 Cb 1.37 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.38 1ner h ARG 11 CO 0.36 0.00 -1.25 0.00 -1.07 0.00 0.00 179.97 178.01 1ner h ALA 12 N 1.46 0.57 0.00 0.04 0.00 -1.99 -3.13 119.26 116.21 1ner h ALA 12 Ca 0.34 -1.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.15 1ner h ALA 12 Cb 1.56 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.48 1ner h ALA 12 CO -0.00 1.29 -0.17 -0.44 0.00 0.00 0.00 179.25 179.92 1ner h ASP 13 N 0.00 0.00 0.15 0.00 3.32 0.05 0.50 116.42 120.44 1ner h ASP 13 Ca -0.12 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.92 1ner h ASP 13 Cb 1.81 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.36 1ner h ASP 13 CO 0.10 0.17 -0.07 0.58 -1.72 0.00 0.00 179.24 178.30 1ner h VAL 14 N 0.00 0.07 -0.03 -1.35 2.07 -1.30 -2.83 116.25 112.89 1ner h VAL 14 Ca -0.00 -0.90 -0.03 0.00 0.82 0.00 0.00 66.70 66.59 1ner h VAL 14 Cb 0.58 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1ner h VAL 14 CO 0.02 0.02 -0.11 0.40 0.02 0.00 0.00 177.57 177.92 1ner h ILE 15 N -1.05 1.49 -0.14 4.57 2.04 -1.52 -1.56 117.51 121.35 1ner h ILE 15 Ca -0.02 -1.62 0.04 0.00 1.00 0.00 0.00 64.86 64.26 1ner h ILE 15 Cb 0.19 2.50 -0.04 0.00 -0.74 0.00 0.00 36.82 38.72 1ner h ILE 15 CO 0.03 0.44 -0.13 0.00 0.00 0.00 0.00 178.15 178.49 1ner h ALA 16 N 0.37 -0.04 0.20 1.87 0.00 -0.18 0.80 119.26 122.29 1ner h ALA 16 Ca -0.01 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 1ner h ALA 16 Cb 0.77 0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1ner h ALA 16 CO 0.02 -0.58 -0.10 0.78 0.00 0.00 0.00 179.25 179.37 1ner h GLY 17 N -0.16 -0.28 0.76 0.00 0.00 -1.57 -2.05 103.07 99.77 1ner h GLY 17 Ca 0.09 0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.51 1ner h GLY 17 CO -0.23 -0.10 -0.15 1.41 0.00 0.00 0.00 176.54 177.46 1ner h LEU 18 N -0.28 -0.36 -0.41 3.11 3.38 -0.99 -2.26 115.31 117.49 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 0.22 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1ner h LEU 18 CO 0.05 -0.06 0.16 1.17 0.09 0.00 0.00 178.44 179.84 1ner n LYS 19 N -5.17 0.04 0.21 1.13 4.81 0.28 -0.88 118.16 118.58 1ner n LYS 19 Ca -0.10 0.45 0.11 0.00 -0.87 0.00 0.00 58.31 57.90 1ner n LYS 19 Cb 0.25 -1.79 0.67 0.00 0.02 0.00 0.00 35.03 34.18 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 -0.74 -3.36 116.57 117.76 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 0.31 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 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 -4.46 0.00 -2.74 1.90 1.74 -0.06 -5.00 116.66 108.04 1ner n ARG 21 Ca -0.01 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.99 1ner n ARG 21 Cb 0.19 0.00 0.09 0.00 -1.02 0.00 0.00 32.46 31.72 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 1.12 -4.23 5.56 2.85 -1.25 -5.13 118.16 117.07 1ner n LYS 22 Ca 0.00 -2.18 -0.18 0.00 -1.05 0.00 0.00 58.31 54.90 1ner n LYS 22 Cb 0.00 -0.63 -0.11 0.00 -0.65 0.00 0.00 35.03 33.64 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 -2.86 2.39 -0.15 -5.58 1.43 -1.25 -5.01 118.68 107.66 1ner s LEU 23 Ca 0.24 -0.80 -0.12 0.00 -1.03 0.00 0.00 54.13 52.42 1ner s LEU 23 Cb 0.37 -0.53 0.04 0.00 0.03 0.00 0.00 46.19 46.10 1ner s LEU 23 CO -0.06 -0.15 0.38 -0.94 0.23 0.00 0.00 176.35 175.82 1ner s SER 24 N -2.40 -0.42 0.62 2.29 1.04 -1.26 -3.19 113.70 110.37 1ner s SER 24 Ca 0.08 0.79 0.26 0.00 0.48 0.00 0.00 55.95 57.56 1ner s SER 24 Cb -0.05 0.76 1.26 0.00 0.10 0.00 0.00 66.02 68.09 1ner s SER 24 CO 0.03 -0.15 1.69 -0.07 0.98 0.00 0.00 173.24 175.72 1ner h LEU 25 N 6.01 0.00 0.00 2.42 3.38 -1.96 1.25 115.31 126.41 1ner h LEU 25 Ca -0.30 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.50 1ner h LEU 25 Cb 1.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.91 1ner h LEU 25 CO 0.28 0.00 -0.86 -1.28 0.09 0.00 0.00 178.44 176.67 1ner h SER 26 N 0.00 0.00 0.15 -0.43 0.87 -1.94 -2.97 113.55 109.23 1ner h SER 26 Ca 0.21 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.76 1ner h SER 26 Cb 1.53 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.49 1ner h SER 26 CO -0.00 0.82 -0.07 0.00 -0.53 0.00 0.00 176.83 177.04 1ner h ALA 27 N 1.18 -0.20 -0.40 6.23 0.00 0.12 -0.97 119.26 125.21 1ner h ALA 27 Ca -0.02 -0.18 0.02 0.00 0.00 0.00 0.00 54.91 54.73 1ner h ALA 27 Cb 1.64 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.49 1ner h ALA 27 CO 0.10 -0.43 0.27 -0.07 0.00 0.00 0.00 179.25 179.12 1ner h LEU 28 N -0.56 0.40 0.59 0.00 -0.00 -1.59 0.31 115.31 114.45 1ner h LEU 28 Ca -0.02 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.82 1ner h LEU 28 Cb 0.43 -0.10 0.01 0.00 -0.00 0.00 0.00 40.66 41.00 1ner h LEU 28 CO 0.03 0.28 -0.28 0.77 -0.00 0.00 0.00 178.44 179.24 1ner h SER 29 N 0.47 -0.67 1.06 -0.43 4.64 -1.32 -2.93 113.55 114.36 1ner h SER 29 Ca 0.16 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1ner h SER 29 Cb 0.06 0.17 -0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1ner h SER 29 CO -0.04 -0.30 -0.07 0.08 -0.87 0.00 0.00 176.83 175.63 1ner h ARG 30 N -1.10 0.00 -0.30 4.77 -0.00 -0.95 0.11 114.38 116.92 1ner h ARG 30 Ca -0.08 0.00 -0.11 0.00 -0.00 0.00 0.00 59.98 59.79 1ner h ARG 30 Cb 0.66 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.61 1ner h ARG 30 CO 0.13 0.07 -0.28 1.96 -0.00 0.00 0.00 179.97 181.86 1ner h GLN 31 N 0.00 0.61 0.00 0.08 4.20 -0.34 -3.27 115.11 116.38 1ner h GLN 31 Ca -0.00 -0.25 -0.24 0.00 0.06 0.00 0.00 58.65 58.21 1ner h GLN 31 Cb 0.62 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 28.33 1ner h GLN 31 CO 0.01 0.82 -2.16 1.19 -0.67 0.00 0.00 178.83 178.02 1ner n PHE 32 N -4.09 0.00 0.00 2.96 3.01 -1.11 -5.03 117.46 113.19 1ner n PHE 32 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 1ner n PHE 32 Cb 0.44 -0.78 0.00 0.00 -0.01 0.00 0.00 39.48 39.13 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 1.74 3.72 3.74 1.37 0.00 0.38 -5.08 105.19 111.05 1ner n GLY 33 Ca -0.23 -0.87 -0.66 0.00 0.00 0.00 0.00 46.02 44.26 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 1.77 -0.88 1.61 4.01 -1.13 -4.69 117.16 117.85 1ner n TYR 34 Ca 0.00 1.05 -0.35 0.00 -0.16 0.00 0.00 57.90 58.44 1ner n TYR 34 Cb 0.00 -2.26 0.09 0.00 -0.31 0.00 0.00 39.34 36.86 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 4.14 -4.40 0.19 -0.72 0.00 -1.26 -4.07 120.51 114.39 1ner n ALA 35 Ca 0.30 -0.89 0.06 0.00 0.00 0.00 0.00 53.44 52.91 1ner n ALA 35 Cb -0.03 -1.36 0.54 0.00 0.00 0.00 0.00 19.45 18.61 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 -1.37 0.13 -0.64 0.00 0.13 -1.89 -2.27 132.00 126.09 1ner h PRO 36 Ca -0.45 -0.01 -0.07 0.00 -0.87 0.00 0.00 66.00 64.60 1ner h PRO 36 Cb 1.32 -0.03 -0.03 0.00 0.13 0.00 0.00 31.00 32.40 1ner h PRO 36 CO 0.29 0.15 0.13 1.79 -0.23 0.00 0.00 178.00 180.12 1ner h THR 37 N 0.13 1.25 0.59 1.56 1.35 -1.97 -2.70 112.91 113.13 1ner h THR 37 Ca 0.03 -0.97 -0.02 0.00 -0.55 0.00 0.00 66.41 64.90 1ner h THR 37 Cb 0.09 0.63 -0.02 0.00 -1.73 0.00 0.00 68.15 67.12 1ner h THR 37 CO 0.00 0.36 -0.49 0.74 -0.25 0.00 0.00 175.52 175.88 1ner h THR 38 N 0.97 0.03 -0.41 6.82 2.02 -1.71 0.15 112.91 120.79 1ner h THR 38 Ca 0.20 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.47 1ner h THR 38 Cb 0.39 0.03 -0.09 0.00 -1.74 0.00 0.00 68.15 66.74 1ner h THR 38 CO 0.01 0.00 -0.17 0.25 0.37 0.00 0.00 175.52 175.97 1ner h LEU 39 N -1.06 -0.60 0.18 2.58 7.12 -1.58 -1.35 115.31 120.60 1ner h LEU 39 Ca -0.07 0.15 0.01 0.00 0.13 0.00 0.00 57.88 58.10 1ner h LEU 39 Cb 0.90 0.34 -0.03 0.00 -0.53 0.00 0.00 40.66 41.33 1ner h LEU 39 CO -0.01 -0.21 -0.30 0.00 -0.13 0.00 0.00 178.44 177.79 1ner h ALA 40 N 1.22 -0.56 0.00 1.25 0.00 -1.17 0.30 119.26 120.30 1ner h ALA 40 Ca 0.20 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ner h ALA 40 Cb 0.40 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.67 1ner h ALA 40 CO -0.47 -0.86 0.13 0.09 0.00 0.00 0.00 179.25 178.14 1ner n ASN 41 N -5.41 0.34 0.00 0.00 4.13 0.51 -0.78 115.26 114.05 1ner n ASN 41 Ca -0.07 0.60 0.09 0.00 1.68 0.00 0.00 54.58 56.88 1ner n ASN 41 Cb 0.32 -0.61 0.54 0.00 -1.54 0.00 0.00 39.78 38.49 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 -1.61 2.19 0.04 5.41 0.00 0.09 -0.01 120.51 126.63 1ner n ALA 42 Ca -0.01 -0.11 -0.01 0.00 0.00 0.00 0.00 53.44 53.30 1ner n ALA 42 Cb 0.15 -1.29 -0.08 0.00 0.00 0.00 0.00 19.45 18.23 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 0.00 0.00 3.38 -1.10 -3.41 115.31 114.18 1ner h LEU 43 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 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 0.66 -0.42 -0.62 0.09 0.00 0.00 178.44 178.14 1ner n GLU 44 N -3.00 3.37 -2.54 1.13 -0.58 -1.02 -5.06 120.64 112.93 1ner n GLU 44 Ca -0.08 0.00 -0.37 0.00 -0.42 0.00 0.00 57.16 56.29 1ner n GLU 44 Cb 0.86 -0.71 -0.04 0.00 -0.57 0.00 0.00 31.44 30.98 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 -0.88 4.28 -0.84 3.49 3.52 0.99 -4.91 118.95 124.60 1ner s ARG 45 Ca 0.00 1.56 -0.25 0.00 -0.13 0.00 0.00 55.73 56.91 1ner s ARG 45 Cb 0.00 -2.68 -0.05 0.00 -1.56 0.00 0.00 34.95 30.66 1ner s ARG 45 CO 0.00 -0.05 2.00 -3.38 -0.81 0.00 0.00 175.30 173.05 1ner s HIS 46 N -1.56 1.69 -0.46 5.12 -3.43 -1.26 -4.67 115.29 110.72 1ner s HIS 46 Ca 0.55 0.83 0.04 0.00 -0.80 0.00 0.00 55.06 55.67 1ner s HIS 46 Cb -0.24 -3.97 0.24 0.00 -1.43 0.00 0.00 32.58 27.18 1ner s HIS 46 CO 0.30 -1.83 0.94 1.87 -2.00 0.00 0.00 174.74 174.02 1ner n TRP 47 N 14.35 -2.77 0.18 0.38 -0.00 -1.26 -5.00 117.44 123.32 1ner n TRP 47 Ca 0.38 -1.44 0.11 0.00 -0.00 0.00 0.00 57.50 56.55 1ner n TRP 47 Cb 0.47 1.44 0.58 0.00 -0.00 0.00 0.00 31.31 33.81 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 -1.92 -1.06 132.00 139.01 1ner h PRO 48 Ca -0.13 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.97 1ner h PRO 48 Cb 1.08 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ner h PRO 48 CO 0.16 0.00 -0.05 -0.22 -0.21 0.00 0.00 178.00 177.68 1ner h LYS 49 N 0.00 0.00 0.00 1.05 1.63 -1.98 -2.56 116.57 114.71 1ner h LYS 49 Ca 0.00 0.00 -0.14 0.00 -0.85 0.00 0.00 60.65 59.66 1ner h LYS 49 Cb 0.19 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.80 1ner h LYS 49 CO 0.00 0.05 -0.67 0.78 -3.45 0.00 0.00 179.45 176.17 1ner h GLY 50 N 2.29 0.00 1.55 5.01 0.00 -1.55 -3.00 103.07 107.37 1ner h GLY 50 Ca -0.00 0.00 -0.16 0.00 0.00 0.00 0.00 47.33 47.17 1ner h GLY 50 CO 0.01 0.00 -0.57 0.83 0.00 0.00 0.00 176.54 176.81 1ner h GLU 51 N 0.00 0.47 -0.73 4.80 5.08 -1.60 -2.79 114.58 119.80 1ner h GLU 51 Ca -0.01 -0.31 -0.02 0.00 -1.00 0.00 0.00 59.36 58.03 1ner h GLU 51 Cb 1.27 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.52 1ner h GLU 51 CO 0.09 0.91 0.39 0.37 -1.00 0.00 0.00 179.01 179.77 1ner h GLN 52 N 0.36 1.02 -0.05 2.33 4.15 -1.44 -0.72 115.11 120.76 1ner h GLN 52 Ca 0.00 -0.11 0.03 0.00 0.77 0.00 0.00 58.65 59.34 1ner h GLN 52 Cb 1.10 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.56 1ner h GLN 52 CO 0.10 0.75 -0.11 0.82 -1.93 0.00 0.00 178.83 178.46 1ner h ILE 53 N 1.02 0.70 0.64 2.39 2.04 -1.39 0.71 117.51 123.62 1ner h ILE 53 Ca 0.26 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.09 1ner h ILE 53 Cb 0.03 0.70 0.01 0.00 -0.74 0.00 0.00 36.82 36.82 1ner h ILE 53 CO -0.04 0.00 -0.31 0.40 0.00 0.00 0.00 178.15 178.20 1ner h ILE 54 N -0.17 0.23 -0.68 -0.67 2.04 -1.39 -2.89 117.51 113.98 1ner h ILE 54 Ca 0.06 -0.28 0.08 0.00 1.00 0.00 0.00 64.86 65.72 1ner h ILE 54 Cb 0.25 0.29 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 1ner h ILE 54 CO -0.15 0.03 0.45 0.00 0.00 0.00 0.00 178.15 178.47 1ner h ALA 55 N -0.89 1.84 -0.75 1.87 0.00 -1.07 -0.01 119.26 120.25 1ner h ALA 55 Ca -0.09 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.87 1ner h ALA 55 Cb 0.70 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1ner h ALA 55 CO 0.14 0.03 0.49 -0.97 0.00 0.00 0.00 179.25 178.95 1ner h ASN 56 N 0.60 0.70 -0.39 0.00 -0.73 0.56 -0.90 115.58 115.41 1ner h ASN 56 Ca 0.31 0.00 -0.04 0.00 1.87 0.00 0.00 56.30 58.44 1ner h ASN 56 Cb 0.41 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 38.83 1ner h ASN 56 CO -0.10 0.45 0.13 0.00 -0.37 0.00 0.00 177.43 177.54 1ner h ALA 57 N 1.59 1.37 -0.13 1.57 0.00 -0.78 -0.60 119.26 122.28 1ner h ALA 57 Ca 0.32 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ner h ALA 57 Cb 0.24 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ner h ALA 57 CO -0.11 0.46 0.00 1.28 0.00 0.00 0.00 179.25 180.88 1ner n LEU 58 N -4.32 1.31 -1.17 0.00 4.77 -0.41 -4.87 117.00 112.31 1ner n LEU 58 Ca 0.03 -0.55 -0.15 0.00 -0.03 0.00 0.00 56.01 55.31 1ner n LEU 58 Cb 0.19 -0.08 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 1ner n LEU 58 CO 0.39 0.27 -0.14 1.21 -1.33 0.00 0.00 177.39 177.78 1ner n GLU 59 N 0.08 -1.37 -1.16 3.23 4.07 -0.23 -4.95 120.64 120.31 1ner n GLU 59 Ca 0.16 1.02 0.00 0.00 -0.06 0.00 0.00 57.16 58.28 1ner n GLU 59 Cb 0.27 -5.31 0.00 0.00 -0.06 0.00 0.00 31.44 26.34 1ner n GLU 59 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 1ner n THR 60 N -2.40 0.00 -4.16 6.31 5.66 -0.85 -5.00 114.28 113.84 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 0.58 -0.45 -0.09 0.00 -1.55 0.00 0.00 70.33 68.82 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 -1.03 2.42 0.38 1.09 3.01 -1.26 -4.23 119.74 120.12 1ner s LYS 61 Ca 0.00 -0.89 0.04 0.00 -1.01 0.00 0.00 55.97 54.11 1ner s LYS 61 Cb 0.00 -2.47 0.74 0.00 -1.01 0.00 0.00 37.83 35.09 1ner s LYS 61 CO 0.00 0.53 2.03 -1.00 0.51 0.00 0.00 175.35 177.42 1ner h PRO 62 N 3.49 0.69 0.00 -1.68 0.13 -1.91 -1.20 132.00 131.53 1ner h PRO 62 Ca -0.48 -0.04 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 32.14 1ner h PRO 62 CO 0.57 0.46 0.05 -0.85 -0.23 0.00 0.00 178.00 178.01 1ner n GLU 63 N -4.45 0.00 -0.03 0.86 0.28 -1.26 -0.49 120.64 115.54 1ner n GLU 63 Ca 0.05 0.20 -0.13 0.00 -0.16 0.00 0.00 57.16 57.12 1ner n GLU 63 Cb 0.06 -1.55 -0.14 0.00 1.43 0.00 0.00 31.44 31.23 1ner n GLU 63 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 177.13 177.25 1ner n VAL 64 N -1.15 1.62 0.05 3.84 0.31 -0.45 -3.58 118.33 118.96 1ner n VAL 64 Ca 0.00 -0.75 0.02 0.00 -0.01 0.00 0.00 64.34 63.60 1ner n VAL 64 Cb 0.05 -1.17 -0.06 0.00 -0.91 0.00 0.00 33.84 31.75 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 0.02 0.47 -2.07 2.52 5.03 -0.93 -3.41 117.51 119.15 1ner h ILE 65 Ca -0.39 -1.89 -0.57 0.00 -0.12 0.00 0.00 64.86 61.90 1ner h ILE 65 Cb 2.05 2.00 -0.40 0.00 -3.03 0.00 0.00 36.82 37.44 1ner h ILE 65 CO 0.06 0.27 -0.94 0.79 -0.68 0.00 0.00 178.15 177.65 1ner n TRP 66 N -2.90 1.07 0.05 1.37 8.01 -0.70 -2.81 117.44 121.54 1ner n TRP 66 Ca -0.07 -3.78 -0.09 0.00 -1.31 0.00 0.00 57.50 52.24 1ner n TRP 66 Cb 0.79 -0.42 -0.07 0.00 -2.01 0.00 0.00 31.31 29.60 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 3.97 -0.22 0.00 -0.99 0.13 -1.79 -3.09 132.00 130.01 1ner h PRO 67 Ca 0.11 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1ner h PRO 67 Cb 0.80 0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1ner h PRO 67 CO 0.59 0.17 0.00 -1.13 -0.23 0.00 0.00 178.00 177.40 1ner n SER 68 N -4.92 0.00 -0.07 1.44 3.41 -1.26 -1.16 113.62 111.06 1ner n SER 68 Ca -0.07 0.00 -0.08 0.00 -0.26 0.00 0.00 58.87 58.46 1ner n SER 68 Cb 0.24 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.11 1ner n SER 68 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1ner n ARG 69 N -0.92 1.23 -4.22 4.33 5.12 -1.22 -4.98 116.66 116.00 1ner n ARG 69 Ca 0.00 0.04 -0.36 0.00 -1.93 0.00 0.00 57.85 55.61 1ner n ARG 69 Cb 0.00 -1.31 -0.08 0.00 -1.16 0.00 0.00 32.46 29.90 1ner n ARG 69 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 1ner s TYR 70 N -2.30 3.29 -0.41 -1.55 2.02 -0.31 -5.01 117.35 113.09 1ner s TYR 70 Ca -0.13 0.29 0.08 0.00 -0.37 0.00 0.00 57.07 56.94 1ner s TYR 70 Cb 0.04 -1.84 0.38 0.00 -0.40 0.00 0.00 41.96 40.14 1ner s TYR 70 CO 0.43 0.54 1.32 0.94 -1.57 0.00 0.00 175.55 177.22 1ner n GLN 71 N 2.14 1.16 -2.92 -0.62 7.27 -1.26 -4.82 117.38 118.33 1ner n GLN 71 Ca -0.19 -1.81 0.03 0.00 0.07 0.00 0.00 57.00 55.10 1ner n GLN 71 Cb 0.54 -0.16 0.00 0.00 2.41 0.00 0.00 30.24 33.03 1ner n GLN 71 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1ner s ALA 72 N 0.21 -4.24 0.00 1.69 0.00 -1.26 -5.16 121.76 113.00 1ner s ALA 72 Ca 0.22 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.45 1ner s ALA 72 Cb 0.38 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 20.56 1ner s ALA 72 CO -0.08 -2.34 0.00 0.41 0.00 0.00 0.00 175.76 173.74 1ner n GLY 73 N 4.23 -0.87 0.00 0.00 0.00 -1.26 -5.28 105.19 102.01 1ner n GLY 73 Ca 0.07 -1.13 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1ner n GLY 73 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48