#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 6.64 0.67 0.00 1.04 -1.26 -5.03 113.70 115.76 1ner s SER 2 Ca 0.00 0.47 -0.11 0.00 0.48 0.00 0.00 55.95 56.79 1ner s SER 2 Cb 0.00 -2.47 -0.01 0.00 0.10 0.00 0.00 66.02 63.65 1ner s SER 2 CO 0.00 -0.93 1.06 0.21 0.98 0.00 0.00 173.24 174.56 1ner s ASN 3 N 2.01 5.67 0.61 7.02 3.84 -1.26 -4.47 114.94 128.35 1ner s ASN 3 Ca 0.39 1.41 0.00 0.00 0.21 0.00 0.00 52.86 54.87 1ner s ASN 3 Cb -0.11 -2.34 0.00 0.00 -0.55 0.00 0.00 41.25 38.25 1ner s ASN 3 CO 0.21 -1.23 0.00 1.21 -2.79 0.00 0.00 177.10 174.50 1ner n GLU 4 N -2.97 -3.70 -1.38 0.43 4.07 -1.26 -4.56 120.64 111.25 1ner n GLU 4 Ca 0.07 2.95 -0.10 0.00 -0.06 0.00 0.00 57.16 60.02 1ner n GLU 4 Cb 0.55 -3.94 -0.04 0.00 -0.06 0.00 0.00 31.44 27.95 1ner n GLU 4 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1ner n LYS 5 N -3.51 -1.31 -1.07 5.31 4.76 -1.26 -4.62 118.16 116.45 1ner n LYS 5 Ca -0.05 0.58 0.00 0.00 -2.87 0.00 0.00 58.31 55.97 1ner n LYS 5 Cb 0.59 -4.80 -0.01 0.00 -1.84 0.00 0.00 35.03 28.97 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 -0.06 2.59 -1.87 7.82 0.00 -1.26 -4.94 120.51 122.80 1ner n ALA 6 Ca -0.10 -1.43 0.00 0.00 0.00 0.00 0.00 53.44 51.91 1ner n ALA 6 Cb 0.35 -0.51 0.00 0.00 0.00 0.00 0.00 19.45 19.29 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 0.23 0.00 0.00 0.00 3.00 -1.26 -5.03 116.66 113.60 1ner n ARG 7 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.80 1ner n ARG 7 Cb 0.88 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.34 1ner n ARG 7 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1ner n ASP 8 N 0.00 0.00 -4.59 0.55 8.00 -1.26 -4.84 116.55 114.42 1ner n ASP 8 Ca 0.00 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.08 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 1.62 1.00 1.24 0.52 -1.22 -4.94 118.94 117.16 1ner s TRP 9 Ca 0.00 0.72 -0.17 0.00 0.02 0.00 0.00 56.10 56.67 1ner s TRP 9 Cb 0.00 -4.04 -0.07 0.00 -1.15 0.00 0.00 33.47 28.20 1ner s TRP 9 CO 0.00 -2.98 -0.46 0.72 0.02 0.00 0.00 176.95 174.25 1ner n HIS 10 N 11.39 -3.11 0.10 -1.98 8.25 -1.26 -4.35 115.22 124.26 1ner n HIS 10 Ca 0.25 0.17 0.20 0.00 -0.26 0.00 0.00 57.72 58.07 1ner n HIS 10 Cb 0.48 -1.54 0.76 0.00 1.12 0.00 0.00 29.99 30.80 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 -1.29 0.00 0.00 -0.41 3.08 -1.94 0.13 114.38 113.96 1ner h ARG 11 Ca -0.44 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.38 1ner h ARG 11 Cb 1.32 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.33 1ner h ARG 11 CO 0.28 0.00 -1.49 0.00 -1.07 0.00 0.00 179.97 177.69 1ner h ALA 12 N 1.59 0.70 0.00 0.04 0.00 -1.99 -3.18 119.26 116.42 1ner h ALA 12 Ca 0.18 -1.13 -0.04 0.00 0.00 0.00 0.00 54.91 53.93 1ner h ALA 12 Cb 0.95 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1ner h ALA 12 CO -0.00 1.24 -0.17 -0.44 0.00 0.00 0.00 179.25 179.88 1ner h ASP 13 N 0.00 0.00 0.19 0.00 5.19 -1.02 0.70 116.42 121.47 1ner h ASP 13 Ca -0.21 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.20 1ner h ASP 13 Cb 1.79 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.30 1ner h ASP 13 CO 0.07 0.17 -0.09 0.58 -3.12 0.00 0.00 179.24 176.85 1ner h VAL 14 N 0.00 0.11 -0.05 -1.35 2.07 -1.41 -2.73 116.25 112.88 1ner h VAL 14 Ca -0.00 -0.88 -0.10 0.00 0.82 0.00 0.00 66.70 66.55 1ner h VAL 14 Cb 0.54 0.19 0.01 0.00 -1.52 0.00 0.00 31.29 30.50 1ner h VAL 14 CO 0.02 0.03 -0.34 0.40 0.02 0.00 0.00 177.57 177.71 1ner h ILE 15 N -1.05 1.44 -0.70 4.57 2.04 -1.52 -1.24 117.51 121.05 1ner h ILE 15 Ca -0.03 -1.79 0.09 0.00 1.00 0.00 0.00 64.86 64.13 1ner h ILE 15 Cb 0.24 2.41 -0.07 0.00 -0.74 0.00 0.00 36.82 38.67 1ner h ILE 15 CO 0.04 0.51 0.35 0.00 0.00 0.00 0.00 178.15 179.06 1ner h ALA 16 N 0.40 0.96 0.07 1.87 0.00 0.24 1.12 119.26 123.90 1ner h ALA 16 Ca -0.03 0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ner h ALA 16 Cb 1.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1ner h ALA 16 CO 0.07 -0.03 -0.03 0.78 0.00 0.00 0.00 179.25 180.04 1ner h GLY 17 N 0.61 -0.09 0.82 0.00 0.00 -1.49 -1.58 103.07 101.34 1ner h GLY 17 Ca 0.34 0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.68 1ner h GLY 17 CO -0.25 -0.03 -0.21 1.41 0.00 0.00 0.00 176.54 177.45 1ner h LEU 18 N -0.40 -0.50 -0.54 3.11 3.38 -0.69 -1.93 115.31 117.74 1ner h LEU 18 Ca -0.01 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.89 1ner h LEU 18 Cb 0.35 0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1ner h LEU 18 CO 0.01 -0.22 0.11 1.17 0.09 0.00 0.00 178.44 179.61 1ner n LYS 19 N -5.27 0.05 0.00 1.13 4.81 0.38 -1.60 118.16 117.67 1ner n LYS 19 Ca -0.11 0.50 0.22 0.00 -0.87 0.00 0.00 58.31 58.05 1ner n LYS 19 Cb 0.29 -1.79 0.72 0.00 0.02 0.00 0.00 35.03 34.27 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 -0.44 -3.31 116.57 118.09 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 0.23 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 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 -4.07 0.00 -2.86 1.90 3.00 -0.63 -5.00 116.66 109.00 1ner n ARG 21 Ca 0.10 0.00 -0.12 0.00 -0.01 0.00 0.00 57.85 57.83 1ner n ARG 21 Cb 0.68 0.00 0.05 0.00 0.00 0.00 0.00 32.46 33.19 1ner n ARG 21 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1ner n LYS 22 N 0.00 0.97 -4.28 5.56 5.02 -1.25 -5.13 118.16 119.05 1ner n LYS 22 Ca 0.00 -2.32 -0.22 0.00 -2.02 0.00 0.00 58.31 53.76 1ner n LYS 22 Cb 0.00 -1.25 -0.12 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 -2.10 2.27 -0.17 -0.35 1.43 -1.25 -4.98 118.68 113.53 1ner s LEU 23 Ca 0.28 -0.63 -0.09 0.00 -1.03 0.00 0.00 54.13 52.66 1ner s LEU 23 Cb 0.29 -0.74 0.06 0.00 0.03 0.00 0.00 46.19 45.83 1ner s LEU 23 CO -0.08 0.02 0.40 -0.94 0.23 0.00 0.00 176.35 175.98 1ner s SER 24 N -1.72 -0.48 0.42 2.29 1.04 -1.26 -3.55 113.70 110.44 1ner s SER 24 Ca 0.03 0.87 0.09 0.00 0.48 0.00 0.00 55.95 57.42 1ner s SER 24 Cb -0.10 0.78 0.49 0.00 0.10 0.00 0.00 66.02 67.29 1ner s SER 24 CO 0.03 -0.19 1.15 -0.07 0.98 0.00 0.00 173.24 175.14 1ner h LEU 25 N 7.20 0.00 0.21 2.42 3.38 -1.98 1.29 115.31 127.84 1ner h LEU 25 Ca -0.36 0.00 -0.32 0.00 0.09 0.00 0.00 57.88 57.29 1ner h LEU 25 Cb 1.18 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.96 1ner h LEU 25 CO 0.29 0.00 -1.40 0.77 0.09 0.00 0.00 178.44 178.19 1ner h SER 26 N 0.00 0.79 0.35 -0.43 4.64 -1.94 -2.94 113.55 114.02 1ner h SER 26 Ca 0.00 -0.82 -0.32 0.00 -0.47 0.00 0.00 61.79 60.18 1ner h SER 26 Cb 1.12 -0.25 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 1ner h SER 26 CO 0.00 1.63 -1.62 0.00 -0.87 0.00 0.00 176.83 175.98 1ner h ALA 27 N 0.25 0.22 -0.64 5.18 0.00 0.12 -2.95 119.26 121.45 1ner h ALA 27 Ca -0.22 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.57 1ner h ALA 27 Cb 2.09 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 20.20 1ner h ALA 27 CO 0.26 1.09 0.41 -0.07 0.00 0.00 0.00 179.25 180.94 1ner h LEU 28 N 0.08 0.75 -0.20 0.00 3.38 -1.02 0.65 115.31 118.95 1ner h LEU 28 Ca -0.28 -0.03 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 1ner h LEU 28 Cb 2.05 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 42.61 1ner h LEU 28 CO 0.17 0.56 -0.10 -1.28 0.09 0.00 0.00 178.44 177.88 1ner h SER 29 N 0.87 0.43 0.77 -0.43 0.87 -1.63 -3.06 113.55 111.37 1ner h SER 29 Ca 0.23 -0.41 -0.07 0.00 -1.23 0.00 0.00 61.79 60.32 1ner h SER 29 Cb -0.08 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.76 1ner h SER 29 CO -0.05 0.74 -0.32 -0.09 -0.53 0.00 0.00 176.83 176.59 1ner h ARG 30 N 0.11 0.00 0.00 2.24 2.43 -1.30 -1.46 114.38 116.40 1ner h ARG 30 Ca 0.04 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1ner h ARG 30 Cb 0.58 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.13 1ner h ARG 30 CO 0.03 0.32 -0.03 1.96 -1.51 0.00 0.00 179.97 180.74 1ner h GLN 31 N 0.00 0.00 0.00 0.20 4.20 0.42 -3.09 115.11 116.84 1ner h GLN 31 Ca -0.00 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.51 1ner h GLN 31 Cb 0.79 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.53 1ner h GLN 31 CO 0.04 0.03 -1.76 1.19 -0.67 0.00 0.00 178.83 177.67 1ner n PHE 32 N -3.22 0.00 0.00 2.96 3.01 -1.10 -5.05 117.46 114.05 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 0.21 -0.54 0.00 0.00 -0.01 0.00 0.00 39.48 39.14 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 2.33 3.68 3.65 1.37 0.00 -0.57 -5.09 105.19 110.56 1ner n GLY 33 Ca -0.18 -0.81 -0.61 0.00 0.00 0.00 0.00 46.02 44.42 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 1.47 -0.84 1.61 4.01 -1.21 -4.75 117.16 117.46 1ner n TYR 34 Ca 0.00 0.91 -0.34 0.00 -0.16 0.00 0.00 57.90 58.31 1ner n TYR 34 Cb 0.00 -2.26 0.10 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 3.36 -4.13 0.03 -0.72 0.00 -1.26 -4.09 120.51 113.71 1ner n ALA 35 Ca 0.25 -0.91 0.04 0.00 0.00 0.00 0.00 53.44 52.82 1ner n ALA 35 Cb 0.06 -1.43 0.45 0.00 0.00 0.00 0.00 19.45 18.52 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 -1.48 0.47 -0.53 0.00 0.13 -1.89 -2.60 132.00 126.10 1ner h PRO 36 Ca -0.46 -0.03 0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1ner h PRO 36 Cb 1.32 -0.11 -0.03 0.00 0.13 0.00 0.00 31.00 32.32 1ner h PRO 36 CO 0.31 0.32 0.35 1.79 -0.23 0.00 0.00 178.00 180.54 1ner h THR 37 N 0.49 1.13 0.21 1.56 1.35 -1.95 -1.18 112.91 114.53 1ner h THR 37 Ca 0.13 -0.25 -0.00 0.00 -0.55 0.00 0.00 66.41 65.74 1ner h THR 37 Cb -0.04 0.35 -0.01 0.00 -1.73 0.00 0.00 68.15 66.72 1ner h THR 37 CO -0.03 0.13 -0.25 0.74 -0.25 0.00 0.00 175.52 175.86 1ner h THR 38 N 0.72 0.00 -0.50 6.82 2.02 -1.77 0.23 112.91 120.43 1ner h THR 38 Ca 0.20 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.48 1ner h THR 38 Cb -0.08 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.24 1ner h THR 38 CO -0.04 0.00 -0.09 0.25 0.37 0.00 0.00 175.52 176.00 1ner h LEU 39 N -0.48 -0.40 0.22 2.58 5.85 -1.58 0.14 115.31 121.65 1ner h LEU 39 Ca -0.03 0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.83 1ner h LEU 39 Cb 0.42 0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 1ner h LEU 39 CO -0.05 -0.14 -0.23 0.00 -0.34 0.00 0.00 178.44 177.67 1ner h ALA 40 N 1.49 -0.92 0.00 1.25 0.00 -0.90 -0.16 119.26 120.01 1ner h ALA 40 Ca 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ner h ALA 40 Cb 0.38 0.48 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1ner h ALA 40 CO -0.49 -0.94 0.05 -1.71 0.00 0.00 0.00 179.25 176.16 1ner n ASN 41 N -3.73 0.00 0.00 0.00 4.05 0.78 -1.66 115.26 114.70 1ner n ASN 41 Ca -0.05 0.32 0.09 0.00 0.45 0.00 0.00 54.58 55.38 1ner n ASN 41 Cb 0.21 -0.32 0.52 0.00 1.23 0.00 0.00 39.78 41.43 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 -1.30 2.21 0.16 5.20 0.00 0.45 -1.33 120.51 125.90 1ner n ALA 42 Ca 0.00 -0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.45 1ner n ALA 42 Cb 0.05 -1.29 0.08 0.00 0.00 0.00 0.00 19.45 18.29 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 -1.45 -3.40 115.31 113.84 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 0.00 -0.40 -0.62 0.09 0.00 0.00 178.44 177.51 1ner n GLU 44 N -2.87 3.39 -2.53 1.13 1.02 -1.04 -5.06 120.64 114.68 1ner n GLU 44 Ca 0.02 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.75 1ner n GLU 44 Cb 0.54 -0.70 -0.04 0.00 -0.02 0.00 0.00 31.44 31.22 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 -0.86 4.65 -0.61 3.49 6.06 -0.44 -4.91 118.95 126.32 1ner s ARG 45 Ca 0.00 1.72 -0.26 0.00 -2.50 0.00 0.00 55.73 54.69 1ner s ARG 45 Cb 0.00 -3.25 -0.06 0.00 0.06 0.00 0.00 34.95 31.70 1ner s ARG 45 CO 0.00 0.18 2.21 -1.58 -2.50 0.00 0.00 175.30 173.62 1ner s HIS 46 N -0.70 1.32 -0.44 5.12 5.65 -1.26 -4.69 115.29 120.28 1ner s HIS 46 Ca 0.46 1.33 0.03 0.00 0.25 0.00 0.00 55.06 57.13 1ner s HIS 46 Cb -0.30 -3.74 0.24 0.00 -1.18 0.00 0.00 32.58 27.60 1ner s HIS 46 CO 0.37 -2.23 0.98 1.87 -0.65 0.00 0.00 174.74 175.07 1ner n TRP 47 N 15.31 -2.48 0.27 3.88 -0.00 -1.26 -5.00 117.44 128.15 1ner n TRP 47 Ca 0.34 -1.35 0.15 0.00 -0.00 0.00 0.00 57.50 56.64 1ner n TRP 47 Cb 0.51 1.40 0.82 0.00 -0.00 0.00 0.00 31.31 34.05 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 3.90 0.00 0.00 5.87 0.11 -1.94 -0.18 132.00 139.76 1ner h PRO 48 Ca -0.14 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.95 1ner h PRO 48 Cb 1.10 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1ner h PRO 48 CO 0.12 0.00 -0.09 -0.22 -0.21 0.00 0.00 178.00 177.61 1ner h LYS 49 N 0.00 0.00 -0.00 1.05 1.63 -1.98 -2.54 116.57 114.73 1ner h LYS 49 Ca 0.00 0.00 -0.16 0.00 -0.85 0.00 0.00 60.65 59.64 1ner h LYS 49 Cb 0.28 0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.89 1ner h LYS 49 CO 0.00 0.09 -0.77 0.78 -3.45 0.00 0.00 179.45 176.10 1ner h GLY 50 N 2.30 0.05 1.93 5.01 0.00 -1.40 -2.85 103.07 108.11 1ner h GLY 50 Ca -0.00 -0.08 -0.11 0.00 0.00 0.00 0.00 47.33 47.14 1ner h GLY 50 CO 0.01 0.07 -0.50 0.83 0.00 0.00 0.00 176.54 176.95 1ner h GLU 51 N 0.03 0.08 -0.71 4.80 4.39 -1.57 -2.71 114.58 118.89 1ner h GLU 51 Ca -0.01 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1ner h GLU 51 Cb 1.35 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.97 1ner h GLU 51 CO 0.10 0.56 0.37 1.96 -1.16 0.00 0.00 179.01 180.85 1ner h GLN 52 N 0.06 0.99 -0.31 2.33 4.20 -1.35 -0.78 115.11 120.26 1ner h GLN 52 Ca -0.00 -0.13 0.05 0.00 0.06 0.00 0.00 58.65 58.64 1ner h GLN 52 Cb 0.91 -0.19 -0.05 0.00 0.30 0.00 0.00 27.48 28.45 1ner h GLN 52 CO 0.07 0.76 -0.00 0.82 -0.67 0.00 0.00 178.83 179.80 1ner h ILE 53 N 0.98 0.77 0.24 2.54 2.04 -1.41 0.58 117.51 123.25 1ner h ILE 53 Ca 0.25 -0.03 -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 -0.04 0.02 -0.11 0.40 0.00 0.00 0.00 178.15 178.41 1ner h ILE 54 N 0.09 0.81 0.00 -0.67 2.04 -1.42 -2.54 117.51 115.82 1ner h ILE 54 Ca 0.15 -0.29 -0.00 0.00 1.00 0.00 0.00 64.86 65.71 1ner h ILE 54 Cb 0.20 0.99 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 1ner h ILE 54 CO -0.25 0.07 -0.01 0.00 0.00 0.00 0.00 178.15 177.95 1ner h ALA 55 N 0.26 1.97 -1.00 1.87 0.00 -0.79 -1.84 119.26 119.74 1ner h ALA 55 Ca -0.03 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 54.92 1ner h ALA 55 Cb 0.35 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.08 1ner h ALA 55 CO 0.05 0.02 0.65 -0.97 0.00 0.00 0.00 179.25 179.00 1ner h ASN 56 N 0.00 1.05 -0.72 0.00 -0.73 0.61 -0.46 115.58 115.33 1ner h ASN 56 Ca -0.00 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.16 1ner h ASN 56 Cb 0.03 -0.23 -0.04 0.00 0.27 0.00 0.00 38.32 38.35 1ner h ASN 56 CO 0.00 0.69 0.42 0.00 -0.37 0.00 0.00 177.43 178.17 1ner h ALA 57 N 1.44 1.35 -0.11 1.57 0.00 -1.22 0.33 119.26 122.62 1ner h ALA 57 Ca 0.42 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1ner h ALA 57 Cb 0.10 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1ner h ALA 57 CO -0.15 0.54 0.00 1.28 0.00 0.00 0.00 179.25 180.92 1ner n LEU 58 N -4.37 1.25 -1.80 0.00 4.77 -0.56 -4.87 117.00 111.42 1ner n LEU 58 Ca 0.08 -0.51 -0.17 0.00 -0.03 0.00 0.00 56.01 55.38 1ner n LEU 58 Cb 0.09 -0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.06 1ner n LEU 58 CO 0.38 0.25 -0.18 1.21 -1.33 0.00 0.00 177.39 177.72 1ner n GLU 59 N 0.03 -1.55 -1.20 3.23 2.13 0.11 -4.93 120.64 118.46 1ner n GLU 59 Ca 0.16 0.95 0.00 0.00 0.66 0.00 0.00 57.16 58.93 1ner n GLU 59 Cb 0.27 -5.37 0.00 0.00 0.27 0.00 0.00 31.44 26.61 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 -2.65 0.00 -4.24 6.31 5.66 -0.61 -4.99 114.28 113.76 1ner n THR 60 Ca -0.18 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.52 1ner n THR 60 Cb 0.59 -0.43 -0.10 0.00 -1.55 0.00 0.00 70.33 68.84 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 -1.08 2.13 0.43 1.09 3.01 -1.26 -4.35 119.74 119.71 1ner s LYS 61 Ca 0.00 -1.02 0.11 0.00 -1.01 0.00 0.00 55.97 54.06 1ner s LYS 61 Cb 0.00 -2.31 0.93 0.00 -1.01 0.00 0.00 37.83 35.45 1ner s LYS 61 CO 0.00 0.51 2.00 -1.00 0.51 0.00 0.00 175.35 177.37 1ner h PRO 62 N 3.64 0.19 0.00 -1.68 0.13 -1.92 -2.05 132.00 130.30 1ner h PRO 62 Ca -0.49 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1ner h PRO 62 Cb 1.17 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1ner h PRO 62 CO 0.52 0.26 0.05 -0.85 -0.23 0.00 0.00 178.00 177.76 1ner n GLU 63 N -4.37 0.00 -0.05 0.86 0.28 -1.26 -0.84 120.64 115.26 1ner n GLU 63 Ca -0.01 0.32 -0.13 0.00 -0.16 0.00 0.00 57.16 57.18 1ner n GLU 63 Cb 0.20 -1.55 -0.14 0.00 1.43 0.00 0.00 31.44 31.37 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 -1.30 1.57 0.39 3.84 0.31 -0.77 -3.72 118.33 118.65 1ner n VAL 64 Ca 0.00 -0.76 0.12 0.00 -0.01 0.00 0.00 64.34 63.69 1ner n VAL 64 Cb 0.05 -1.07 0.14 0.00 -0.91 0.00 0.00 33.84 32.05 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 0.01 0.00 -2.02 2.52 2.04 -1.13 -3.39 117.51 115.54 1ner h ILE 65 Ca -0.42 -0.70 -0.56 0.00 1.00 0.00 0.00 64.86 64.17 1ner h ILE 65 Cb 2.07 1.35 -0.39 0.00 -0.74 0.00 0.00 36.82 39.11 1ner h ILE 65 CO 0.05 0.00 -1.07 0.79 0.00 0.00 0.00 178.15 177.92 1ner n TRP 66 N -2.42 0.02 0.09 1.37 8.01 -0.67 -3.43 117.44 120.41 1ner n TRP 66 Ca 0.03 -3.62 -0.06 0.00 -1.31 0.00 0.00 57.50 52.53 1ner n TRP 66 Cb 0.48 -0.37 0.06 0.00 -2.01 0.00 0.00 31.31 29.47 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 0.19 0.00 -0.99 0.13 -1.77 -2.97 132.00 130.56 1ner h PRO 67 Ca 0.08 -0.17 0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1ner h PRO 67 Cb 0.86 0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1ner h PRO 67 CO 0.50 0.84 0.00 0.43 -0.23 0.00 0.00 178.00 179.54 1ner n SER 68 N -3.76 0.00 -0.08 1.44 7.64 -1.26 -3.01 113.62 114.59 1ner n SER 68 Ca -0.03 -0.13 -0.08 0.00 1.01 0.00 0.00 58.87 59.65 1ner n SER 68 Cb 0.71 -0.24 -0.12 0.00 -1.01 0.00 0.00 64.21 63.55 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 -1.24 1.42 -3.88 1.43 5.12 -1.16 -4.99 116.66 113.36 1ner n ARG 69 Ca 0.11 -0.00 -0.21 0.00 -1.93 0.00 0.00 57.85 55.82 1ner n ARG 69 Cb 0.16 -1.40 -0.02 0.00 -1.16 0.00 0.00 32.46 30.04 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 -2.37 3.25 -0.41 -1.55 2.02 -1.13 -5.09 117.35 112.06 1ner s TYR 70 Ca -0.09 -0.11 0.07 0.00 -0.37 0.00 0.00 57.07 56.58 1ner s TYR 70 Cb 0.05 -1.64 0.18 0.00 -0.40 0.00 0.00 41.96 40.14 1ner s TYR 70 CO 0.62 0.34 0.60 -1.14 -1.57 0.00 0.00 175.55 174.40 1ner s GLN 71 N -3.99 0.81 0.00 -0.62 0.74 -1.26 -4.85 119.66 110.49 1ner s GLN 71 Ca 0.37 -0.40 0.00 0.00 0.05 0.00 0.00 55.36 55.37 1ner s GLN 71 Cb -0.09 -0.03 0.00 0.00 1.10 0.00 0.00 33.01 34.00 1ner s GLN 71 CO 0.28 -1.20 0.00 0.00 -0.55 0.00 0.00 175.29 173.82 1ner n ALA 72 N 4.29 0.00 0.00 1.58 0.00 -1.26 -5.19 120.51 119.93 1ner n ALA 72 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1ner n ALA 72 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 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 0.09 0.00 0.00 0.00 -1.26 -5.32 105.19 98.71 1ner n GLY 73 Ca 0.00 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.43 1ner n GLY 73 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50