#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 -0.99 0.02 0.00 7.64 -1.26 -4.92 113.62 114.12 1ner n SER 2 Ca 0.00 -2.07 0.11 0.00 1.01 0.00 0.00 58.87 57.92 1ner n SER 2 Cb 0.00 0.38 -0.00 0.00 -1.01 0.00 0.00 64.21 63.58 1ner n SER 2 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1ner n ASN 3 N -0.52 0.60 -4.79 6.43 2.04 -1.26 -4.90 115.26 112.86 1ner n ASN 3 Ca -0.22 -0.24 -0.31 0.00 -0.44 0.00 0.00 54.58 53.37 1ner n ASN 3 Cb 0.79 0.90 0.08 0.00 -2.53 0.00 0.00 39.78 39.01 1ner n ASN 3 CO 0.00 0.00 0.00 -1.83 -0.44 0.00 0.00 177.26 174.99 1ner s GLU 4 N -3.21 2.51 -1.53 -3.83 1.03 -1.26 -3.53 118.70 108.88 1ner s GLU 4 Ca 0.03 1.06 -0.14 0.00 0.03 0.00 0.00 54.97 55.95 1ner s GLU 4 Cb 0.14 -1.93 0.09 0.00 -0.80 0.00 0.00 34.13 31.63 1ner s GLU 4 CO 0.81 -1.43 0.91 1.63 -1.33 0.00 0.00 175.26 175.85 1ner n LYS 5 N -3.37 -5.09 0.00 -4.83 4.01 -1.26 -4.94 118.16 102.68 1ner n LYS 5 Ca 0.08 0.58 0.00 0.00 -0.51 0.00 0.00 58.31 58.46 1ner n LYS 5 Cb 0.53 -5.44 0.00 0.00 -0.51 0.00 0.00 35.03 29.61 1ner n LYS 5 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1ner n ALA 6 N -4.50 0.00 1.45 7.82 0.00 -1.23 -4.64 120.51 119.40 1ner n ALA 6 Ca 0.04 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.62 1ner n ALA 6 Cb 0.53 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.46 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 1.66 -2.26 0.00 1.74 -1.26 -4.91 116.66 111.63 1ner n ARG 7 Ca 0.00 -1.00 -0.33 0.00 -0.77 0.00 0.00 57.85 55.74 1ner n ARG 7 Cb 0.00 -1.48 -0.01 0.00 -1.02 0.00 0.00 32.46 29.95 1ner n ARG 7 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ner s ASP 8 N -2.03 6.00 -0.24 0.55 1.01 -1.26 -4.27 116.67 116.42 1ner s ASP 8 Ca 0.36 1.89 -0.29 0.00 0.71 0.00 0.00 52.55 55.22 1ner s ASP 8 Cb 0.21 -2.55 -0.03 0.00 1.01 0.00 0.00 42.92 41.56 1ner s ASP 8 CO 0.35 -1.02 1.74 0.26 0.21 0.00 0.00 175.17 176.70 1ner s TRP 9 N -2.22 1.89 0.39 4.23 0.52 -1.06 -4.88 118.94 117.82 1ner s TRP 9 Ca 0.66 0.50 -0.21 0.00 0.02 0.00 0.00 56.10 57.08 1ner s TRP 9 Cb -0.17 -4.04 -0.15 0.00 -1.15 0.00 0.00 33.47 27.96 1ner s TRP 9 CO 0.29 -3.19 0.09 1.58 0.02 0.00 0.00 176.95 175.74 1ner n HIS 10 N 9.19 -2.03 -0.28 -1.98 -0.00 -1.26 -4.32 115.22 114.54 1ner n HIS 10 Ca 0.21 0.61 0.34 0.00 0.46 0.00 0.00 57.72 59.33 1ner n HIS 10 Cb 0.45 -1.72 0.70 0.00 -0.12 0.00 0.00 29.99 29.30 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 0.32 0.00 0.00 1.57 3.08 -2.01 1.54 114.38 118.88 1ner h ARG 11 Ca -0.36 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.49 1ner h ARG 11 Cb 1.40 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.42 1ner h ARG 11 CO 0.45 0.00 -1.23 0.00 -1.07 0.00 0.00 179.97 178.12 1ner h ALA 12 N 1.17 0.61 0.00 0.04 0.00 -1.99 -3.15 119.26 115.95 1ner h ALA 12 Ca 0.54 -0.99 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1ner h ALA 12 Cb 2.42 0.16 -0.00 0.00 0.00 0.00 0.00 17.79 20.37 1ner h ALA 12 CO -0.01 1.16 -0.09 -0.44 0.00 0.00 0.00 179.25 179.88 1ner h ASP 13 N 0.00 0.00 0.12 0.00 3.32 0.19 0.93 116.42 120.99 1ner h ASP 13 Ca -0.13 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 1ner h ASP 13 Cb 1.73 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.28 1ner h ASP 13 CO 0.08 0.09 -0.06 0.58 -1.72 0.00 0.00 179.24 178.22 1ner h VAL 14 N 0.00 0.00 -0.04 -1.35 2.07 -1.34 -2.59 116.25 113.00 1ner h VAL 14 Ca -0.00 -0.83 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 1ner h VAL 14 Cb 0.48 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 1ner h VAL 14 CO 0.01 0.00 -0.12 0.40 0.02 0.00 0.00 177.57 177.88 1ner h ILE 15 N -0.99 1.46 -0.25 4.57 2.04 -1.50 0.19 117.51 123.03 1ner h ILE 15 Ca -0.02 -1.55 0.05 0.00 1.00 0.00 0.00 64.86 64.34 1ner h ILE 15 Cb 0.12 2.40 -0.04 0.00 -0.74 0.00 0.00 36.82 38.56 1ner h ILE 15 CO 0.03 0.42 -0.03 0.00 0.00 0.00 0.00 178.15 178.56 1ner h ALA 16 N 0.41 0.19 0.32 1.87 0.00 0.72 1.38 119.26 124.16 1ner h ALA 16 Ca -0.00 0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ner h ALA 16 Cb 0.75 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1ner h ALA 16 CO 0.02 -0.45 -0.16 0.78 0.00 0.00 0.00 179.25 179.45 1ner h GLY 17 N 0.03 -0.45 0.76 0.00 0.00 -1.49 -0.98 103.07 100.94 1ner h GLY 17 Ca 0.12 0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.58 1ner h GLY 17 CO -0.24 -0.16 -0.35 1.41 0.00 0.00 0.00 176.54 177.20 1ner h LEU 18 N -0.58 -0.83 -0.19 3.11 3.38 -0.68 -2.24 115.31 117.28 1ner h LEU 18 Ca -0.04 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1ner h LEU 18 Cb 0.42 0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.39 1ner h LEU 18 CO 0.07 -0.46 0.18 1.17 0.09 0.00 0.00 178.44 179.49 1ner n LYS 19 N -5.43 0.02 -0.10 1.13 4.81 0.47 -1.14 118.16 117.92 1ner n LYS 19 Ca -0.12 0.39 0.14 0.00 -0.87 0.00 0.00 58.31 57.84 1ner n LYS 19 Cb 0.39 -1.74 0.52 0.00 0.02 0.00 0.00 35.03 34.22 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 0.36 0.00 1.64 1.63 -0.53 -3.34 116.57 116.33 1ner h LYS 20 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1ner h LYS 20 Cb 0.35 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.90 1ner h LYS 20 CO 0.00 0.24 0.00 0.54 -3.45 0.00 0.00 179.45 176.78 1ner n ARG 21 N -4.46 0.00 -2.85 1.90 1.74 -0.29 -4.99 116.66 107.71 1ner n ARG 21 Ca 0.11 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.08 1ner n ARG 21 Cb 0.44 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.93 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 0.94 -4.21 5.56 5.02 -1.25 -5.13 118.16 119.08 1ner n LYS 22 Ca 0.00 -2.23 -0.18 0.00 -2.02 0.00 0.00 58.31 53.89 1ner n LYS 22 Cb 0.00 -1.26 -0.11 0.00 -0.02 0.00 0.00 35.03 33.64 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 -1.88 2.36 -0.15 -0.35 1.43 -1.26 -5.00 118.68 113.84 1ner s LEU 23 Ca 0.28 -0.75 -0.07 0.00 -1.03 0.00 0.00 54.13 52.56 1ner s LEU 23 Cb 0.28 -0.51 0.06 0.00 0.03 0.00 0.00 46.19 46.05 1ner s LEU 23 CO -0.10 -0.14 0.35 -0.94 0.23 0.00 0.00 176.35 175.75 1ner s SER 24 N -2.21 -0.28 0.63 2.29 1.04 -1.26 -3.63 113.70 110.28 1ner s SER 24 Ca 0.05 0.78 0.21 0.00 0.48 0.00 0.00 55.95 57.47 1ner s SER 24 Cb -0.06 0.77 0.96 0.00 0.10 0.00 0.00 66.02 67.79 1ner s SER 24 CO 0.02 -0.20 1.48 -0.07 0.98 0.00 0.00 173.24 175.46 1ner h LEU 25 N 7.50 0.00 -0.07 2.42 3.38 -1.98 1.15 115.31 127.72 1ner h LEU 25 Ca -0.31 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.42 1ner h LEU 25 Cb 1.15 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1ner h LEU 25 CO 0.26 0.00 -1.05 0.77 0.09 0.00 0.00 178.44 178.51 1ner h SER 26 N 0.00 0.41 0.11 -0.43 4.64 -1.96 -3.01 113.55 113.31 1ner h SER 26 Ca 0.21 -0.38 -0.26 0.00 -0.47 0.00 0.00 61.79 60.90 1ner h SER 26 Cb 1.87 -0.13 0.03 0.00 -0.31 0.00 0.00 62.40 63.85 1ner h SER 26 CO -0.00 1.23 -1.07 0.00 -0.87 0.00 0.00 176.83 176.11 1ner h ALA 27 N 0.73 -0.02 0.00 5.18 0.00 0.93 -3.13 119.26 122.96 1ner h ALA 27 Ca -0.09 -0.73 -0.04 0.00 0.00 0.00 0.00 54.91 54.06 1ner h ALA 27 Cb 1.73 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.62 1ner h ALA 27 CO 0.17 0.57 -0.17 -0.07 0.00 0.00 0.00 179.25 179.75 1ner h LEU 28 N 0.09 0.00 0.36 0.00 4.07 -1.46 -0.12 115.31 118.24 1ner h LEU 28 Ca -0.16 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.78 1ner h LEU 28 Cb 1.78 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.52 1ner h LEU 28 CO 0.20 0.17 -0.17 -1.28 -1.08 0.00 0.00 178.44 176.28 1ner h SER 29 N 0.00 -0.40 0.83 -0.43 0.87 -1.54 -3.20 113.55 109.67 1ner h SER 29 Ca -0.00 -0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.40 1ner h SER 29 Cb 0.35 0.10 -0.00 0.00 -0.44 0.00 0.00 62.40 62.41 1ner h SER 29 CO 0.02 0.04 -0.11 0.08 -0.53 0.00 0.00 176.83 176.33 1ner h ARG 30 N -0.98 0.00 -0.07 2.24 0.11 -1.47 -1.48 114.38 112.72 1ner h ARG 30 Ca -0.05 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.97 1ner h ARG 30 Cb 0.52 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.59 1ner h ARG 30 CO 0.08 0.11 -0.24 1.96 0.10 0.00 0.00 179.97 181.98 1ner h GLN 31 N 0.00 0.12 0.00 0.08 4.20 -1.03 -3.16 115.11 115.32 1ner h GLN 31 Ca -0.00 -0.04 -0.27 0.00 0.06 0.00 0.00 58.65 58.40 1ner h GLN 31 Cb 0.55 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.27 1ner h GLN 31 CO 0.01 0.36 -2.19 1.19 -0.67 0.00 0.00 178.83 177.54 1ner n PHE 32 N -4.21 0.00 0.00 2.96 3.72 -1.09 -5.03 117.46 113.80 1ner n PHE 32 Ca -0.01 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.39 1ner n PHE 32 Cb 0.32 -0.82 0.00 0.00 -0.94 0.00 0.00 39.48 38.04 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 1.78 3.57 3.64 1.37 0.00 -0.58 -5.08 105.19 109.90 1ner n GLY 33 Ca -0.25 -0.94 -0.58 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 -0.82 1.61 4.01 -1.23 -4.76 117.16 117.53 1ner n TYR 34 Ca 0.00 0.80 -0.34 0.00 -0.16 0.00 0.00 57.90 58.20 1ner n TYR 34 Cb 0.00 -2.30 0.11 0.00 -0.31 0.00 0.00 39.34 36.84 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 3.51 -4.00 -0.00 -0.72 0.00 -1.26 -4.22 120.51 113.82 1ner n ALA 35 Ca 0.24 -0.94 0.03 0.00 0.00 0.00 0.00 53.44 52.77 1ner n ALA 35 Cb 0.10 -1.47 0.40 0.00 0.00 0.00 0.00 19.45 18.47 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 -1.56 0.54 -0.61 0.00 0.13 -1.89 -2.51 132.00 126.10 1ner h PRO 36 Ca -0.46 -0.05 0.03 0.00 -0.87 0.00 0.00 66.00 64.65 1ner h PRO 36 Cb 1.32 -0.11 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 1ner h PRO 36 CO 0.32 0.40 0.38 1.79 -0.23 0.00 0.00 178.00 180.66 1ner h THR 37 N 0.55 1.08 0.00 1.56 1.35 -1.98 0.29 112.91 115.76 1ner h THR 37 Ca 0.14 -0.26 0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1ner h THR 37 Cb 0.01 0.27 0.00 0.00 -1.73 0.00 0.00 68.15 66.70 1ner h THR 37 CO -0.02 0.14 0.00 0.41 -0.25 0.00 0.00 175.52 175.79 1ner n THR 38 N -4.72 0.00 -0.23 6.82 -1.04 -0.95 0.17 114.28 114.32 1ner n THR 38 Ca 0.06 1.45 0.04 0.00 -2.04 0.00 0.00 64.05 63.55 1ner n THR 38 Cb 0.08 -2.33 0.16 0.00 -1.82 0.00 0.00 70.33 66.41 1ner n THR 38 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1ner h LEU 39 N 0.00 0.04 0.14 -4.42 5.85 -1.56 0.25 115.31 115.61 1ner h LEU 39 Ca 0.00 0.13 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1ner h LEU 39 Cb 0.00 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1ner h LEU 39 CO 0.00 -0.01 -0.14 0.00 -0.34 0.00 0.00 178.44 177.95 1ner h ALA 40 N 1.56 -0.87 0.00 1.25 0.00 -0.19 -1.14 119.26 119.87 1ner h ALA 40 Ca 0.38 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1ner h ALA 40 Cb 0.62 0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1ner h ALA 40 CO -0.47 -0.88 0.00 0.09 0.00 0.00 0.00 179.25 177.99 1ner n ASN 41 N -3.14 0.00 0.00 0.00 4.13 0.13 -2.13 115.26 114.25 1ner n ASN 41 Ca -0.03 0.37 0.04 0.00 1.68 0.00 0.00 54.58 56.63 1ner n ASN 41 Cb 0.13 -0.37 0.23 0.00 -1.54 0.00 0.00 39.78 38.22 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 -1.37 2.13 0.06 5.41 0.00 0.85 -0.75 120.51 126.84 1ner n ALA 42 Ca 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 53.44 53.40 1ner n ALA 42 Cb 0.01 -1.13 -0.05 0.00 0.00 0.00 0.00 19.45 18.28 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 -1.56 -3.40 115.31 113.73 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 0.55 -0.23 -0.62 0.09 0.00 0.00 178.44 178.24 1ner n GLU 44 N -2.99 3.24 -2.51 1.13 1.02 -1.02 -5.05 120.64 114.47 1ner n GLU 44 Ca -0.06 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.67 1ner n GLU 44 Cb 0.81 -0.48 -0.04 0.00 -0.02 0.00 0.00 31.44 31.71 1ner n GLU 44 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1ner s ARG 45 N -0.65 4.54 -0.53 3.49 6.06 0.07 -4.90 118.95 127.03 1ner s ARG 45 Ca 0.00 1.70 -0.26 0.00 -2.50 0.00 0.00 55.73 54.67 1ner s ARG 45 Cb 0.00 -3.32 -0.07 0.00 0.06 0.00 0.00 34.95 31.62 1ner s ARG 45 CO 0.00 -0.05 2.40 -1.58 -2.50 0.00 0.00 175.30 173.57 1ner s HIS 46 N 0.32 1.09 -0.43 5.12 5.65 -1.26 -4.70 115.29 121.08 1ner s HIS 46 Ca 0.53 1.60 0.02 0.00 0.25 0.00 0.00 55.06 57.46 1ner s HIS 46 Cb -0.28 -3.58 0.23 0.00 -1.18 0.00 0.00 32.58 27.77 1ner s HIS 46 CO 0.32 -2.42 0.97 1.87 -0.65 0.00 0.00 174.74 174.83 1ner n TRP 47 N 16.16 -2.35 0.27 3.88 -0.00 -1.26 -5.00 117.44 129.12 1ner n TRP 47 Ca 0.37 -1.21 0.14 0.00 -0.00 0.00 0.00 57.50 56.81 1ner n TRP 47 Cb 0.54 1.35 0.77 0.00 -0.00 0.00 0.00 31.31 33.96 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 4.10 0.00 0.00 5.87 0.11 -1.94 0.40 132.00 140.53 1ner h PRO 48 Ca -0.09 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.93 1ner h PRO 48 Cb 1.12 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 1ner h PRO 48 CO 0.05 0.00 -0.43 -0.22 -0.21 0.00 0.00 178.00 177.18 1ner h LYS 49 N 0.00 0.00 0.00 1.05 1.63 -1.97 -2.63 116.57 114.64 1ner h LYS 49 Ca 0.00 0.00 -0.11 0.00 -0.85 0.00 0.00 60.65 59.69 1ner h LYS 49 Cb 0.39 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 32.00 1ner h LYS 49 CO 0.00 0.43 -0.51 0.78 -3.45 0.00 0.00 179.45 176.71 1ner h GLY 50 N 2.05 0.00 1.81 5.01 0.00 -1.27 -2.51 103.07 108.15 1ner h GLY 50 Ca -0.00 0.00 -0.12 0.00 0.00 0.00 0.00 47.33 47.20 1ner h GLY 50 CO 0.06 0.00 -0.50 0.83 0.00 0.00 0.00 176.54 176.92 1ner h GLU 51 N 0.00 0.21 -0.90 4.80 5.08 -1.55 -2.73 114.58 119.48 1ner h GLU 51 Ca -0.01 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1ner h GLU 51 Cb 0.92 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.14 1ner h GLU 51 CO 0.07 0.67 0.50 1.96 -1.00 0.00 0.00 179.01 181.20 1ner h GLN 52 N 0.16 1.24 0.08 2.33 1.08 -1.31 0.72 115.11 119.41 1ner h GLN 52 Ca 0.01 -0.14 0.02 0.00 -1.45 0.00 0.00 58.65 57.08 1ner h GLN 52 Cb 0.95 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 28.10 1ner h GLN 52 CO 0.08 0.90 -0.21 0.82 -0.95 0.00 0.00 178.83 179.47 1ner h ILE 53 N 1.25 0.52 0.17 2.54 2.04 -1.40 0.62 117.51 123.25 1ner h ILE 53 Ca 0.32 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.17 1ner h ILE 53 Cb 0.02 0.52 0.00 0.00 -0.74 0.00 0.00 36.82 36.62 1ner h ILE 53 CO -0.05 0.00 -0.08 0.40 0.00 0.00 0.00 178.15 178.42 1ner h ILE 54 N -0.38 0.93 -0.31 -0.67 2.04 -1.43 -2.71 117.51 114.98 1ner h ILE 54 Ca 0.04 -0.47 0.04 0.00 1.00 0.00 0.00 64.86 65.47 1ner h ILE 54 Cb 0.41 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1ner h ILE 54 CO -0.14 0.11 0.21 0.00 0.00 0.00 0.00 178.15 178.33 1ner h ALA 55 N 0.33 1.97 -0.74 1.87 0.00 -0.70 -0.63 119.26 121.36 1ner h ALA 55 Ca -0.02 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1ner h ALA 55 Cb 0.35 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 1ner h ALA 55 CO 0.04 -0.02 0.48 -0.97 0.00 0.00 0.00 179.25 178.78 1ner h ASN 56 N 0.26 0.69 -0.93 0.00 -1.24 0.58 -1.19 115.58 113.74 1ner h ASN 56 Ca 0.13 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.15 1ner h ASN 56 Cb 0.21 -0.15 -0.05 0.00 0.73 0.00 0.00 38.32 39.06 1ner h ASN 56 CO -0.03 0.45 0.59 0.00 -1.29 0.00 0.00 177.43 177.15 1ner h ALA 57 N 1.60 1.18 -0.21 1.57 0.00 -1.00 -0.56 119.26 121.84 1ner h ALA 57 Ca 0.32 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1ner h ALA 57 Cb 0.24 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ner h ALA 57 CO -0.11 0.61 0.00 1.28 0.00 0.00 0.00 179.25 181.03 1ner n LEU 58 N -4.40 1.62 -1.95 0.00 4.77 -0.60 -4.87 117.00 111.56 1ner n LEU 58 Ca 0.10 -0.73 -0.17 0.00 -0.03 0.00 0.00 56.01 55.18 1ner n LEU 58 Cb 0.04 -0.14 -0.04 0.00 -2.33 0.00 0.00 43.42 40.95 1ner n LEU 58 CO 0.37 0.36 -0.19 1.21 -1.33 0.00 0.00 177.39 177.81 1ner n GLU 59 N 0.32 -1.64 -2.98 3.23 2.13 -0.22 -4.94 120.64 116.54 1ner n GLU 59 Ca 0.14 0.94 -0.16 0.00 0.66 0.00 0.00 57.16 58.74 1ner n GLU 59 Cb 0.30 -5.42 -0.00 0.00 0.27 0.00 0.00 31.44 26.59 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 -2.94 0.00 -4.01 6.31 5.66 -0.65 -4.99 114.28 113.65 1ner n THR 60 Ca -0.19 -1.35 -0.30 0.00 -3.05 0.00 0.00 64.05 59.16 1ner n THR 60 Cb 0.61 -0.17 -0.05 0.00 -1.55 0.00 0.00 70.33 69.17 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 -3.36 3.08 0.55 1.09 1.02 -1.26 -4.30 119.74 116.55 1ner s LYS 61 Ca 0.18 -0.63 0.21 0.00 0.02 0.00 0.00 55.97 55.75 1ner s LYS 61 Cb -0.01 -2.82 1.48 0.00 -0.52 0.00 0.00 37.83 35.95 1ner s LYS 61 CO 0.11 0.57 2.19 -1.00 -0.92 0.00 0.00 175.35 176.30 1ner h PRO 62 N 3.07 0.00 0.00 -1.68 0.13 -1.93 -0.65 132.00 130.94 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 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.85 1ner n GLU 63 N -4.28 0.10 -0.03 0.86 1.02 -1.26 -1.69 120.64 115.36 1ner n GLU 63 Ca -0.03 0.57 -0.10 0.00 -0.02 0.00 0.00 57.16 57.59 1ner n GLU 63 Cb 0.09 -1.80 -0.14 0.00 -0.02 0.00 0.00 31.44 29.56 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 -2.01 1.60 0.06 2.62 0.31 -0.25 -3.86 118.33 116.80 1ner n VAL 64 Ca -0.01 -0.79 0.05 0.00 -0.01 0.00 0.00 64.34 63.58 1ner n VAL 64 Cb 0.04 -1.05 -0.05 0.00 -0.91 0.00 0.00 33.84 31.87 1ner n VAL 64 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1ner n ILE 65 N -3.06 0.96 -3.28 2.52 5.41 -0.68 -4.55 119.36 116.68 1ner n ILE 65 Ca -0.20 -0.63 -0.25 0.00 1.00 0.00 0.00 62.75 62.67 1ner n ILE 65 Cb 1.06 -0.58 -0.07 0.00 -0.71 0.00 0.00 39.64 39.34 1ner n ILE 65 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1ner n TRP 66 N -2.80 0.90 0.32 1.39 8.01 -0.70 -2.56 117.44 122.00 1ner n TRP 66 Ca -0.06 -3.75 0.14 0.00 -1.31 0.00 0.00 57.50 52.52 1ner n TRP 66 Cb 0.72 -0.40 0.39 0.00 -2.01 0.00 0.00 31.31 30.01 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 4.13 0.00 0.00 -0.99 0.13 -1.75 -3.26 132.00 130.26 1ner h PRO 67 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1ner h PRO 67 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1ner h PRO 67 CO 0.58 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.78 1ner n SER 68 N -2.88 0.00 0.00 1.44 7.64 -1.26 -1.75 113.62 116.81 1ner n SER 68 Ca 0.03 -0.32 0.00 0.00 1.01 0.00 0.00 58.87 59.59 1ner n SER 68 Cb 0.42 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 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 -0.55 0.12 0.00 1.43 1.74 -1.23 -4.90 116.66 113.28 1ner n ARG 69 Ca 0.00 -0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.06 1ner n ARG 69 Cb 0.00 -0.35 0.00 0.00 -1.02 0.00 0.00 32.46 31.09 1ner n ARG 69 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1ner n TYR 70 N -0.02 0.00 0.00 -1.55 4.01 -0.72 -5.14 117.16 113.74 1ner n TYR 70 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1ner n TYR 70 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.18 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 0.00 0.00 -0.51 -0.72 7.27 -1.25 -5.03 117.38 117.14 1ner n GLN 71 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.06 1ner n GLN 71 Cb 0.00 0.00 -0.01 0.00 2.41 0.00 0.00 30.24 32.64 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 -2.38 1.88 0.00 1.69 0.00 -1.26 -4.95 120.51 115.48 1ner n ALA 72 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1ner n ALA 72 Cb 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.39 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 0.00 0.71 0.54 0.00 0.00 -1.26 -5.19 105.19 100.00 1ner n GLY 73 Ca -0.04 0.08 0.14 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