#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ner s SER 2 N 0.00 7.10 0.03 0.00 0.01 -1.26 -5.03 113.70 114.55 1ner s SER 2 Ca 0.00 1.70 -0.25 0.00 1.31 0.00 0.00 55.95 58.71 1ner s SER 2 Cb 0.00 -2.53 -0.05 0.00 0.21 0.00 0.00 66.02 63.64 1ner s SER 2 CO 0.00 -0.20 0.78 0.20 0.41 0.00 0.00 173.24 174.43 1ner s ASN 3 N -1.91 7.21 0.38 2.44 0.01 -1.26 -5.03 114.94 116.77 1ner s ASN 3 Ca 0.55 1.44 -0.26 0.00 -0.71 0.00 0.00 52.86 53.89 1ner s ASN 3 Cb -0.14 -2.47 -0.09 0.00 0.41 0.00 0.00 41.25 38.96 1ner s ASN 3 CO 0.18 -0.02 1.15 -1.61 -1.51 0.00 0.00 177.10 175.30 1ner s GLU 4 N 0.12 4.16 2.96 -0.60 8.01 -1.26 -4.77 118.70 127.32 1ner s GLU 4 Ca 0.40 1.81 0.00 0.00 0.01 0.00 0.00 54.97 57.19 1ner s GLU 4 Cb -0.20 -2.74 0.00 0.00 -4.31 0.00 0.00 34.13 26.87 1ner s GLU 4 CO 0.23 -0.22 0.00 1.63 0.01 0.00 0.00 175.26 176.91 1ner n LYS 5 N 0.24 0.00 0.00 1.61 4.76 -1.26 -4.90 118.16 118.60 1ner n LYS 5 Ca 0.03 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.47 1ner n LYS 5 Cb 0.46 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.65 1ner n LYS 5 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ner n ALA 6 N 7.53 0.00 1.07 7.82 0.00 -1.26 -4.98 120.51 130.68 1ner n ALA 6 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.56 1ner n ALA 6 Cb 0.00 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.58 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 0.53 -0.76 0.00 5.12 -1.26 -4.94 116.66 115.35 1ner n ARG 7 Ca 0.00 -0.39 -0.17 0.00 -1.93 0.00 0.00 57.85 55.36 1ner n ARG 7 Cb 0.00 -1.49 0.13 0.00 -1.16 0.00 0.00 32.46 29.94 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 -0.90 -1.06 -4.60 0.55 8.00 -1.26 -4.64 116.55 112.64 1ner n ASP 8 Ca 0.08 -1.01 -0.43 0.00 0.71 0.00 0.00 54.79 54.14 1ner n ASP 8 Cb 0.37 -0.58 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 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 -2.31 1.81 0.31 1.24 0.52 -1.17 -4.91 118.94 114.42 1ner s TRP 9 Ca 0.41 0.60 -0.21 0.00 0.02 0.00 0.00 56.10 56.93 1ner s TRP 9 Cb -0.03 -4.12 -0.14 0.00 -1.15 0.00 0.00 33.47 28.03 1ner s TRP 9 CO 0.31 -3.01 0.19 0.72 0.02 0.00 0.00 176.95 175.18 1ner n HIS 10 N 10.12 -1.46 -0.53 -1.98 8.25 -1.26 -4.26 115.22 124.09 1ner n HIS 10 Ca 0.23 0.65 0.45 0.00 -0.26 0.00 0.00 57.72 58.78 1ner n HIS 10 Cb 0.46 -1.64 0.79 0.00 1.12 0.00 0.00 29.99 30.72 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 0.47 0.01 0.00 -0.41 -0.00 -1.92 1.44 114.38 113.97 1ner h ARG 11 Ca -0.31 -0.00 -0.16 0.00 -0.00 0.00 0.00 59.98 59.51 1ner h ARG 11 Cb 1.29 -0.00 -0.03 0.00 -0.00 0.00 0.00 29.97 31.23 1ner h ARG 11 CO 0.45 0.00 -1.18 0.00 -0.00 0.00 0.00 179.97 179.24 1ner h ALA 12 N 1.21 0.65 0.00 0.08 0.00 -1.99 -3.08 119.26 116.12 1ner h ALA 12 Ca 0.77 -0.79 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1ner h ALA 12 Cb 3.05 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 21.01 1ner h ALA 12 CO -0.02 0.91 -0.11 -0.44 0.00 0.00 0.00 179.25 179.59 1ner h ASP 13 N 0.00 0.00 0.00 0.00 3.32 0.17 0.53 116.42 120.44 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 1.58 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 41.12 1ner h ASP 13 CO 0.06 0.11 -0.07 0.58 -1.72 0.00 0.00 179.24 178.19 1ner h VAL 14 N 0.00 0.61 0.11 -1.35 2.07 -1.35 -2.63 116.25 113.71 1ner h VAL 14 Ca -0.00 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.04 1ner h VAL 14 Cb 0.52 1.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.47 1ner h VAL 14 CO 0.01 0.21 -0.05 0.40 0.02 0.00 0.00 177.57 178.16 1ner h ILE 15 N -1.00 1.07 -0.72 4.57 1.08 -1.45 0.03 117.51 121.08 1ner h ILE 15 Ca -0.01 -0.72 0.12 0.00 -0.39 0.00 0.00 64.86 63.85 1ner h ILE 15 Cb 0.40 1.52 -0.08 0.00 -3.07 0.00 0.00 36.82 35.59 1ner h ILE 15 CO -0.01 0.17 0.32 0.00 -0.69 0.00 0.00 178.15 177.95 1ner h ALA 16 N 0.36 1.01 0.11 1.87 0.00 -0.11 0.65 119.26 123.14 1ner h ALA 16 Ca -0.01 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1ner h ALA 16 Cb 0.40 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1ner h ALA 16 CO 0.02 -0.13 -0.05 0.78 0.00 0.00 0.00 179.25 179.87 1ner h GLY 17 N 0.52 -0.15 0.80 0.00 0.00 -1.36 -1.74 103.07 101.13 1ner h GLY 17 Ca 0.38 0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.73 1ner h GLY 17 CO -0.33 -0.06 -0.33 1.41 0.00 0.00 0.00 176.54 177.24 1ner h LEU 18 N -0.48 -0.77 0.00 3.11 3.38 -0.43 -2.06 115.31 118.06 1ner h LEU 18 Ca -0.01 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.95 1ner h LEU 18 Cb 0.39 0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1ner h LEU 18 CO 0.02 -0.43 0.07 1.17 0.09 0.00 0.00 178.44 179.36 1ner n LYS 19 N -5.41 0.00 0.09 1.13 4.81 0.22 -1.50 118.16 117.51 1ner n LYS 19 Ca -0.13 0.37 0.17 0.00 -0.87 0.00 0.00 58.31 57.85 1ner n LYS 19 Cb 0.38 -1.57 0.70 0.00 0.02 0.00 0.00 35.03 34.56 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 1.63 -0.55 -3.34 116.57 115.95 1ner h LYS 20 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1ner h LYS 20 Cb 0.13 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.76 1ner h LYS 20 CO 0.00 0.00 0.00 0.54 -3.45 0.00 0.00 179.45 176.54 1ner n ARG 21 N -4.32 0.00 -2.85 1.90 1.74 -0.56 -5.00 116.66 107.56 1ner n ARG 21 Ca 0.05 0.00 -0.12 0.00 -0.77 0.00 0.00 57.85 57.02 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 0.93 -4.23 5.56 5.02 -1.25 -5.13 118.16 119.05 1ner n LYS 22 Ca 0.00 -2.25 -0.21 0.00 -2.02 0.00 0.00 58.31 53.84 1ner n LYS 22 Cb 0.00 -1.27 -0.12 0.00 -0.02 0.00 0.00 35.03 33.62 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 -1.82 2.29 -0.15 -0.35 1.43 -1.25 -4.99 118.68 113.84 1ner s LEU 23 Ca 0.29 -0.66 -0.09 0.00 -1.03 0.00 0.00 54.13 52.63 1ner s LEU 23 Cb 0.28 -0.69 0.05 0.00 0.03 0.00 0.00 46.19 45.86 1ner s LEU 23 CO -0.11 -0.02 0.37 -0.94 0.23 0.00 0.00 176.35 175.88 1ner s SER 24 N -1.86 -0.44 0.62 2.29 1.04 -1.26 -3.76 113.70 110.33 1ner s SER 24 Ca 0.02 0.79 0.25 0.00 0.48 0.00 0.00 55.95 57.50 1ner s SER 24 Cb -0.10 0.70 1.24 0.00 0.10 0.00 0.00 66.02 67.96 1ner s SER 24 CO 0.03 -0.17 1.69 -0.07 0.98 0.00 0.00 173.24 175.70 1ner h LEU 25 N 6.80 0.00 -0.33 2.42 4.07 -2.00 0.99 115.31 127.27 1ner h LEU 25 Ca -0.35 0.00 -0.19 0.00 0.08 0.00 0.00 57.88 57.42 1ner h LEU 25 Cb 1.18 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.90 1ner h LEU 25 CO 0.31 0.00 -0.85 -1.28 -1.08 0.00 0.00 178.44 175.54 1ner h SER 26 N 0.00 0.17 -0.03 -0.43 0.87 -1.94 -2.81 113.55 109.38 1ner h SER 26 Ca 0.17 -0.14 -0.04 0.00 -1.23 0.00 0.00 61.79 60.55 1ner h SER 26 Cb 1.43 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 63.34 1ner h SER 26 CO -0.00 0.94 -0.14 0.00 -0.53 0.00 0.00 176.83 177.10 1ner h ALA 27 N 1.05 0.06 -0.03 6.23 0.00 0.63 -2.87 119.26 124.33 1ner h ALA 27 Ca -0.03 -0.38 0.01 0.00 0.00 0.00 0.00 54.91 54.51 1ner h ALA 27 Cb 1.47 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 1ner h ALA 27 CO 0.12 -0.02 0.03 -0.07 0.00 0.00 0.00 179.25 179.32 1ner h LEU 28 N -0.43 0.00 0.25 0.00 3.38 -1.52 -0.71 115.31 116.29 1ner h LEU 28 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1ner h LEU 28 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1ner h LEU 28 CO 0.03 0.00 -0.12 0.77 0.09 0.00 0.00 178.44 179.21 1ner h SER 29 N 0.00 -0.29 0.91 -0.43 4.64 -1.39 -3.11 113.55 113.88 1ner h SER 29 Ca 0.02 -0.24 -0.00 0.00 -0.47 0.00 0.00 61.79 61.09 1ner h SER 29 Cb 0.07 0.07 -0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1ner h SER 29 CO -0.00 0.14 -0.02 0.08 -0.87 0.00 0.00 176.83 176.16 1ner h ARG 30 N -0.78 0.00 -0.52 4.77 0.11 -1.25 0.39 114.38 117.10 1ner h ARG 30 Ca -0.03 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.98 1ner h ARG 30 Cb 0.51 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.56 1ner h ARG 30 CO 0.06 0.02 0.06 1.96 0.10 0.00 0.00 179.97 182.17 1ner h GLN 31 N 0.00 0.83 0.00 0.08 4.20 -1.07 -3.26 115.11 115.89 1ner h GLN 31 Ca -0.00 -0.20 -0.30 0.00 0.06 0.00 0.00 58.65 58.20 1ner h GLN 31 Cb 0.48 -0.11 -0.06 0.00 0.30 0.00 0.00 27.48 28.10 1ner h GLN 31 CO 0.00 0.80 -2.14 1.19 -0.67 0.00 0.00 178.83 178.01 1ner n PHE 32 N -4.24 0.00 0.00 2.96 3.01 -1.08 -5.04 117.46 113.07 1ner n PHE 32 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 1ner n PHE 32 Cb 0.27 -0.81 0.00 0.00 -0.01 0.00 0.00 39.48 38.93 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 2.10 3.62 3.69 1.37 0.00 0.14 -5.08 105.19 111.03 1ner n GLY 33 Ca -0.29 -0.90 -0.64 0.00 0.00 0.00 0.00 46.02 44.19 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 1.78 -1.06 1.61 4.01 -1.22 -4.67 117.16 117.61 1ner n TYR 34 Ca 0.00 0.93 -0.36 0.00 -0.16 0.00 0.00 57.90 58.32 1ner n TYR 34 Cb 0.00 -2.30 0.07 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 4.84 -3.15 0.17 -0.72 0.00 -1.26 -4.43 120.51 115.95 1ner n ALA 35 Ca 0.32 -0.44 0.19 0.00 0.00 0.00 0.00 53.44 53.51 1ner n ALA 35 Cb -0.00 -1.58 0.79 0.00 0.00 0.00 0.00 19.45 18.66 1ner n ALA 35 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1ner h PRO 36 N -0.83 0.00 -0.28 0.00 0.11 -1.87 -1.24 132.00 127.89 1ner h PRO 36 Ca -0.44 0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.69 1ner h PRO 36 Cb 1.33 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.42 1ner h PRO 36 CO 0.35 0.00 0.13 1.79 -0.21 0.00 0.00 178.00 180.06 1ner h THR 37 N 0.00 0.98 0.36 -1.15 1.35 -1.96 -1.98 112.91 110.52 1ner h THR 37 Ca 0.13 -0.10 -0.00 0.00 -0.55 0.00 0.00 66.41 65.89 1ner h THR 37 Cb 0.83 0.67 -0.02 0.00 -1.73 0.00 0.00 68.15 67.91 1ner h THR 37 CO -0.00 0.05 -0.37 0.74 -0.25 0.00 0.00 175.52 175.69 1ner h THR 38 N 0.28 0.25 -0.01 6.82 2.02 -1.51 0.13 112.91 120.88 1ner h THR 38 Ca 0.12 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.32 1ner h THR 38 Cb 0.05 0.25 -0.06 0.00 -1.74 0.00 0.00 68.15 66.65 1ner h THR 38 CO -0.09 0.00 -0.53 0.25 0.37 0.00 0.00 175.52 175.52 1ner h LEU 39 N -0.76 -1.64 -0.34 2.58 7.12 -1.56 -1.86 115.31 118.85 1ner h LEU 39 Ca -0.03 0.19 0.06 0.00 0.13 0.00 0.00 57.88 58.23 1ner h LEU 39 Cb 0.68 0.63 -0.05 0.00 -0.53 0.00 0.00 40.66 41.39 1ner h LEU 39 CO -0.07 -0.52 0.03 0.00 -0.13 0.00 0.00 178.44 177.76 1ner h ALA 40 N -0.38 0.33 0.00 1.25 0.00 -1.26 0.14 119.26 119.35 1ner h ALA 40 Ca 0.02 0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ner h ALA 40 Cb 0.72 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1ner h ALA 40 CO -0.36 -0.37 0.05 -1.71 0.00 0.00 0.00 179.25 176.85 1ner n ASN 41 N -5.14 0.00 0.11 0.00 5.15 0.44 -1.51 115.26 114.31 1ner n ASN 41 Ca 0.01 0.27 0.12 0.00 -0.60 0.00 0.00 54.58 54.38 1ner n ASN 41 Cb 0.16 -0.27 0.46 0.00 -0.53 0.00 0.00 39.78 39.61 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 -1.24 1.77 0.75 5.20 0.00 0.50 -2.23 120.51 125.26 1ner n ALA 42 Ca 0.00 0.05 0.12 0.00 0.00 0.00 0.00 53.44 53.61 1ner n ALA 42 Cb 0.05 -1.39 0.25 0.00 0.00 0.00 0.00 19.45 18.36 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 -2.16 0.57 0.00 0.00 4.77 -0.57 -4.62 117.00 115.00 1ner n LEU 43 Ca 0.03 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.20 1ner n LEU 43 Cb 0.26 -0.24 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1ner n LEU 43 CO 0.21 0.00 0.00 -0.62 -1.33 0.00 0.00 177.39 175.65 1ner n GLU 44 N -1.86 0.00 -1.25 3.23 -0.58 -0.95 -5.02 120.64 114.21 1ner n GLU 44 Ca 0.04 0.02 -0.29 0.00 -0.42 0.00 0.00 57.16 56.51 1ner n GLU 44 Cb 0.40 -0.19 0.19 0.00 -0.57 0.00 0.00 31.44 31.26 1ner n GLU 44 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1ner s ARG 45 N -0.19 0.01 -0.40 3.49 1.70 -1.22 -4.96 118.95 117.39 1ner s ARG 45 Ca 0.00 0.23 -0.28 0.00 -0.47 0.00 0.00 55.73 55.21 1ner s ARG 45 Cb 0.00 -1.71 0.02 0.00 -0.57 0.00 0.00 34.95 32.69 1ner s ARG 45 CO 0.00 -2.95 1.03 -1.58 -1.08 0.00 0.00 175.30 170.72 1ner s HIS 46 N -3.09 3.01 -0.46 5.89 5.65 -1.26 -4.87 115.29 120.15 1ner s HIS 46 Ca 0.67 0.83 0.04 0.00 0.25 0.00 0.00 55.06 56.85 1ner s HIS 46 Cb -0.14 -3.92 0.23 0.00 -1.18 0.00 0.00 32.58 27.57 1ner s HIS 46 CO 0.56 -0.96 0.92 1.87 -0.65 0.00 0.00 174.74 176.48 1ner n TRP 47 N 7.14 -2.89 0.34 3.88 -0.00 -1.26 -5.00 117.44 119.64 1ner n TRP 47 Ca 0.10 -1.45 0.20 0.00 -0.00 0.00 0.00 57.50 56.35 1ner n TRP 47 Cb 0.48 1.45 1.08 0.00 -0.00 0.00 0.00 31.31 34.32 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 -1.92 -0.73 132.00 139.43 1ner h PRO 48 Ca -0.11 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.99 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 -0.06 -0.22 -0.21 0.00 0.00 178.00 177.67 1ner h LYS 49 N 0.00 0.00 -0.01 1.05 3.64 -1.99 -2.22 116.57 117.04 1ner h LYS 49 Ca 0.00 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.19 1ner h LYS 49 Cb 0.24 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1ner h LYS 49 CO -0.00 0.06 -0.83 0.78 -2.27 0.00 0.00 179.45 177.19 1ner h GLY 50 N 2.01 0.19 2.00 5.01 0.00 -1.51 -2.82 103.07 107.95 1ner h GLY 50 Ca -0.00 -0.33 -0.10 0.00 0.00 0.00 0.00 47.33 46.90 1ner h GLY 50 CO 0.01 0.29 -0.46 0.83 0.00 0.00 0.00 176.54 177.21 1ner h GLU 51 N 0.10 0.00 -0.51 4.80 5.08 -1.52 -2.86 114.58 119.68 1ner h GLU 51 Ca -0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1ner h GLU 51 Cb 1.44 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.67 1ner h GLU 51 CO 0.12 0.46 0.26 1.96 -1.00 0.00 0.00 179.01 180.82 1ner h GLN 52 N 0.00 0.72 -0.49 2.33 1.08 -1.22 0.21 115.11 117.74 1ner h GLN 52 Ca -0.00 -0.10 0.08 0.00 -1.45 0.00 0.00 58.65 57.18 1ner h GLN 52 Cb 0.89 -0.14 -0.07 0.00 -0.05 0.00 0.00 27.48 28.12 1ner h GLN 52 CO 0.06 0.58 0.12 0.82 -0.95 0.00 0.00 178.83 179.46 1ner h ILE 53 N 0.68 0.75 0.53 2.54 2.04 -1.44 0.58 117.51 123.18 1ner h ILE 53 Ca 0.18 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.92 1ner h ILE 53 Cb 0.08 0.47 0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1ner h ILE 53 CO -0.03 0.05 -0.25 0.40 0.00 0.00 0.00 178.15 178.32 1ner h ILE 54 N 0.26 0.33 -0.30 -0.67 2.04 -1.40 -3.00 117.51 114.78 1ner h ILE 54 Ca 0.24 -0.40 0.08 0.00 1.00 0.00 0.00 64.86 65.78 1ner h ILE 54 Cb 0.31 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.84 1ner h ILE 54 CO -0.30 0.05 0.21 0.00 0.00 0.00 0.00 178.15 178.11 1ner h ALA 55 N -0.73 2.27 -0.73 1.87 0.00 -0.33 0.36 119.26 121.98 1ner h ALA 55 Ca -0.07 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1ner h ALA 55 Cb 0.62 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 1ner h ALA 55 CO 0.12 -0.36 0.48 -0.91 0.00 0.00 0.00 179.25 178.58 1ner h ASN 56 N 0.00 0.74 -0.77 0.00 4.21 0.31 -1.76 115.58 118.31 1ner h ASN 56 Ca 0.14 -0.01 -0.01 0.00 1.21 0.00 0.00 56.30 57.64 1ner h ASN 56 Cb 0.56 -0.17 -0.04 0.00 -1.12 0.00 0.00 38.32 37.55 1ner h ASN 56 CO -0.00 0.51 0.46 0.00 -1.29 0.00 0.00 177.43 177.10 1ner h ALA 57 N 1.58 0.99 -0.27 -0.83 0.00 -0.87 -1.08 119.26 118.78 1ner h ALA 57 Ca 0.30 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ner h ALA 57 Cb 0.10 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.58 1ner h ALA 57 CO -0.09 0.47 0.00 1.28 0.00 0.00 0.00 179.25 180.91 1ner n LEU 58 N -4.47 1.70 -1.41 0.00 4.77 -0.73 -4.85 117.00 112.00 1ner n LEU 58 Ca 0.07 -0.85 -0.14 0.00 -0.03 0.00 0.00 56.01 55.07 1ner n LEU 58 Cb 0.07 -0.25 -0.06 0.00 -2.33 0.00 0.00 43.42 40.85 1ner n LEU 58 CO 0.37 0.38 -0.13 -0.62 -1.33 0.00 0.00 177.39 176.06 1ner n GLU 59 N 0.31 -1.31 -1.72 3.23 -0.58 -0.41 -4.90 120.64 115.25 1ner n GLU 59 Ca 0.10 0.80 -0.02 0.00 -0.42 0.00 0.00 57.16 57.61 1ner n GLU 59 Cb 0.29 -5.06 -0.00 0.00 -0.57 0.00 0.00 31.44 26.11 1ner n GLU 59 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 1ner n THR 60 N -1.93 0.00 -4.22 2.62 5.66 -0.87 -5.00 114.28 110.54 1ner n THR 60 Ca -0.14 -0.16 -0.30 0.00 -3.05 0.00 0.00 64.05 60.40 1ner n THR 60 Cb 0.45 -0.42 -0.09 0.00 -1.55 0.00 0.00 70.33 68.72 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 -2.16 2.44 0.58 1.09 3.01 -1.26 -4.33 119.74 119.10 1ner s LYS 61 Ca 0.02 -0.86 0.27 0.00 -1.01 0.00 0.00 55.97 54.39 1ner s LYS 61 Cb -0.00 -2.47 1.62 0.00 -1.01 0.00 0.00 37.83 35.96 1ner s LYS 61 CO 0.01 0.54 2.11 -1.00 0.51 0.00 0.00 175.35 177.53 1ner h PRO 62 N 3.71 0.00 0.00 -1.68 0.13 -1.92 0.49 132.00 132.73 1ner h PRO 62 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 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 0.56 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.72 1ner n GLU 63 N -3.92 0.00 -0.06 0.86 4.71 -1.26 -1.74 120.64 119.23 1ner n GLU 63 Ca 0.02 0.45 -0.16 0.00 -0.01 0.00 0.00 57.16 57.46 1ner n GLU 63 Cb 0.31 -1.50 -0.14 0.00 -1.01 0.00 0.00 31.44 29.10 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 -1.46 1.60 0.58 2.62 0.31 0.16 -3.99 118.33 118.15 1ner n VAL 64 Ca 0.00 -0.70 0.12 0.00 -0.01 0.00 0.00 64.34 63.76 1ner n VAL 64 Cb 0.00 -1.28 0.25 0.00 -0.91 0.00 0.00 33.84 31.90 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 0.00 -2.08 2.52 2.04 -1.46 -3.38 117.51 115.17 1ner h ILE 65 Ca -0.46 -0.50 -0.53 0.00 1.00 0.00 0.00 64.86 64.36 1ner h ILE 65 Cb 2.03 1.22 -0.40 0.00 -0.74 0.00 0.00 36.82 38.93 1ner h ILE 65 CO 0.03 0.00 -1.00 0.79 0.00 0.00 0.00 178.15 177.97 1ner n TRP 66 N -2.18 1.23 0.31 1.37 8.01 -0.81 -3.06 117.44 122.30 1ner n TRP 66 Ca 0.04 -3.83 0.16 0.00 -1.31 0.00 0.00 57.50 52.56 1ner n TRP 66 Cb 0.44 -0.43 0.62 0.00 -2.01 0.00 0.00 31.31 29.93 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 3.35 0.00 -0.83 -0.99 0.13 -1.76 -3.02 132.00 128.89 1ner h PRO 67 Ca 0.11 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.35 1ner h PRO 67 Cb 0.82 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.87 1ner h PRO 67 CO 0.59 0.00 0.46 1.03 -0.23 0.00 0.00 178.00 179.85 1ner h SER 68 N 0.00 0.63 0.25 1.44 0.87 -1.90 -2.51 113.55 112.32 1ner h SER 68 Ca 0.00 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.59 1ner h SER 68 Cb 0.50 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 1ner h SER 68 CO 0.00 0.34 -1.78 0.54 -0.53 0.00 0.00 176.83 175.40 1ner n ARG 69 N -4.78 0.65 -4.03 2.24 5.12 -1.20 -4.93 116.66 109.72 1ner n ARG 69 Ca 0.15 -0.10 -0.32 0.00 -1.93 0.00 0.00 57.85 55.65 1ner n ARG 69 Cb 0.32 -1.60 -0.06 0.00 -1.16 0.00 0.00 32.46 29.96 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 -3.40 3.31 -0.50 -1.55 2.02 -0.95 -5.06 117.35 111.22 1ner s TYR 70 Ca -0.06 0.17 0.06 0.00 -0.37 0.00 0.00 57.07 56.87 1ner s TYR 70 Cb 0.12 -1.70 0.22 0.00 -0.40 0.00 0.00 41.96 40.21 1ner s TYR 70 CO 0.87 0.55 0.84 0.94 -1.57 0.00 0.00 175.55 177.18 1ner n GLN 71 N 0.72 0.70 -3.15 -0.62 7.27 -1.26 -4.55 117.38 116.48 1ner n GLN 71 Ca -0.10 -1.84 0.06 0.00 0.07 0.00 0.00 57.00 55.19 1ner n GLN 71 Cb 0.52 -1.47 -0.00 0.00 2.41 0.00 0.00 30.24 31.70 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 0.74 -4.23 0.00 1.69 0.00 -1.26 -5.05 121.76 113.65 1ner s ALA 72 Ca 0.31 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.67 1ner s ALA 72 Cb 0.16 -2.86 0.00 0.00 0.00 0.00 0.00 23.12 20.41 1ner s ALA 72 CO -0.19 -2.11 0.00 0.41 0.00 0.00 0.00 175.76 173.88 1ner n GLY 73 N 5.09 0.00 0.00 0.00 0.00 -1.26 -5.15 105.19 103.87 1ner n GLY 73 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1ner n GLY 73 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48