#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 -3.58 -3.40 0.00 2.88 -1.26 -3.95 113.62 104.31 1ner n SER 2 Ca 0.00 0.13 -0.18 0.00 -1.33 0.00 0.00 58.87 57.49 1ner n SER 2 Cb 0.00 -1.94 0.01 0.00 -0.75 0.00 0.00 64.21 61.52 1ner n SER 2 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1ner n ASN 3 N 0.84 -6.25 -4.73 -3.46 5.03 -1.26 -4.88 115.26 100.56 1ner n ASN 3 Ca -0.07 -0.36 -0.33 0.00 0.87 0.00 0.00 54.58 54.69 1ner n ASN 3 Cb 0.30 -3.23 0.10 0.00 -1.02 0.00 0.00 39.78 35.92 1ner n ASN 3 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1ner s GLU 4 N -3.61 2.09 -0.03 3.52 2.12 -1.25 -4.52 118.70 117.01 1ner s GLU 4 Ca 0.10 1.57 -0.03 0.00 0.36 0.00 0.00 54.97 56.98 1ner s GLU 4 Cb -0.02 -1.85 0.01 0.00 0.26 0.00 0.00 34.13 32.54 1ner s GLU 4 CO 0.83 -1.84 0.06 1.63 -0.54 0.00 0.00 175.26 175.40 1ner n LYS 5 N -3.03 -3.24 -1.13 4.30 4.76 -1.26 -4.49 118.16 114.07 1ner n LYS 5 Ca 0.12 2.41 0.12 0.00 -2.87 0.00 0.00 58.31 58.09 1ner n LYS 5 Cb 0.51 -3.20 -0.05 0.00 -1.84 0.00 0.00 35.03 30.45 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 1.97 -3.15 -1.93 7.82 0.00 -1.26 -4.25 120.51 119.71 1ner n ALA 6 Ca -0.10 0.49 -0.38 0.00 0.00 0.00 0.00 53.44 53.46 1ner n ALA 6 Cb 0.15 -1.15 0.02 0.00 0.00 0.00 0.00 19.45 18.47 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 -3.59 3.07 0.00 0.00 1.74 -1.26 -4.88 116.66 111.74 1ner n ARG 7 Ca -0.03 -3.45 0.00 0.00 -0.77 0.00 0.00 57.85 53.59 1ner n ARG 7 Cb 0.59 -2.28 0.00 0.00 -1.02 0.00 0.00 32.46 29.75 1ner n ARG 7 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1ner n ASP 8 N -0.17 3.45 -4.60 0.55 9.92 -1.26 -4.39 116.55 120.05 1ner n ASP 8 Ca 0.53 0.00 -0.43 0.00 -0.53 0.00 0.00 54.79 54.36 1ner n ASP 8 Cb 0.29 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.74 1ner n ASP 8 CO 0.00 0.00 0.00 0.26 0.13 0.00 0.00 177.20 177.59 1ner s TRP 9 N 0.33 1.88 0.99 1.24 0.52 -1.21 -4.93 118.94 117.76 1ner s TRP 9 Ca 0.00 0.64 -0.16 0.00 0.02 0.00 0.00 56.10 56.61 1ner s TRP 9 Cb 0.00 -4.15 -0.01 0.00 -1.15 0.00 0.00 33.47 28.16 1ner s TRP 9 CO 0.00 -2.77 -0.08 0.72 0.02 0.00 0.00 176.95 174.83 1ner n HIS 10 N 10.28 -2.35 -0.15 -1.98 8.25 -1.26 -4.47 115.22 123.54 1ner n HIS 10 Ca 0.22 0.18 0.21 0.00 -0.26 0.00 0.00 57.72 58.07 1ner n HIS 10 Cb 0.47 -1.64 0.60 0.00 1.12 0.00 0.00 29.99 30.55 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 -1.47 0.21 0.00 -0.41 0.11 -1.84 0.28 114.38 111.25 1ner h ARG 11 Ca -0.45 -0.01 -0.19 0.00 0.10 0.00 0.00 59.98 59.43 1ner h ARG 11 Cb 1.31 -0.05 -0.03 0.00 1.11 0.00 0.00 29.97 32.31 1ner h ARG 11 CO 0.31 0.14 -0.91 0.00 0.10 0.00 0.00 179.97 179.60 1ner h ALA 12 N 1.63 0.47 0.00 0.08 0.00 -1.98 -3.11 119.26 116.35 1ner h ALA 12 Ca 0.39 -0.82 -0.03 0.00 0.00 0.00 0.00 54.91 54.45 1ner h ALA 12 Cb 1.20 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 1ner h ALA 12 CO -0.08 1.09 -0.14 -0.44 0.00 0.00 0.00 179.25 179.68 1ner h ASP 13 N 0.00 0.00 0.08 0.00 5.19 -0.73 0.88 116.42 121.85 1ner h ASP 13 Ca -0.03 0.00 -0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1ner h ASP 13 Cb 1.68 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.19 1ner h ASP 13 CO 0.11 0.14 -0.04 0.58 -3.12 0.00 0.00 179.24 176.91 1ner h VAL 14 N 0.00 0.71 0.04 -1.35 2.07 -1.33 -2.74 116.25 113.65 1ner h VAL 14 Ca -0.00 -1.35 -0.07 0.00 0.82 0.00 0.00 66.70 66.10 1ner h VAL 14 Cb 0.54 1.29 0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1ner h VAL 14 CO 0.02 0.22 -0.31 0.40 0.02 0.00 0.00 177.57 177.92 1ner h ILE 15 N -0.97 1.64 -0.61 4.57 2.04 -1.48 -1.55 117.51 121.15 1ner h ILE 15 Ca -0.01 -2.28 0.07 0.00 1.00 0.00 0.00 64.86 63.64 1ner h ILE 15 Cb 0.45 3.14 -0.06 0.00 -0.74 0.00 0.00 36.82 39.61 1ner h ILE 15 CO 0.02 0.62 0.29 0.00 0.00 0.00 0.00 178.15 179.08 1ner h ALA 16 N 0.11 0.80 0.13 1.87 0.00 0.62 0.92 119.26 123.70 1ner h ALA 16 Ca -0.05 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ner h ALA 16 Cb 1.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1ner h ALA 16 CO 0.06 -0.08 -0.06 0.78 0.00 0.00 0.00 179.25 179.95 1ner h GLY 17 N 0.54 -0.18 0.83 0.00 0.00 -1.51 -1.35 103.07 101.40 1ner h GLY 17 Ca 0.29 0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.66 1ner h GLY 17 CO -0.22 -0.07 -0.25 1.41 0.00 0.00 0.00 176.54 177.41 1ner h LEU 18 N -0.55 -0.59 -0.52 3.11 3.38 -0.97 -1.85 115.31 117.33 1ner h LEU 18 Ca -0.02 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.90 1ner h LEU 18 Cb 0.43 0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1ner h LEU 18 CO 0.03 -0.30 0.07 1.17 0.09 0.00 0.00 178.44 179.50 1ner n LYS 19 N -5.32 0.05 -0.00 1.13 4.81 0.32 -1.37 118.16 117.77 1ner n LYS 19 Ca -0.11 0.51 0.17 0.00 -0.87 0.00 0.00 58.31 58.01 1ner n LYS 19 Cb 0.32 -1.74 0.64 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 0.09 0.00 1.64 3.64 -0.35 -3.34 116.57 118.26 1ner h LYS 20 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1ner h LYS 20 Cb 0.14 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.94 1ner h LYS 20 CO 0.00 0.06 0.00 0.54 -2.27 0.00 0.00 179.45 177.78 1ner n ARG 21 N -4.42 0.00 -2.84 1.90 1.74 -0.47 -5.00 116.66 107.57 1ner n ARG 21 Ca 0.09 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.06 1ner n ARG 21 Cb 0.52 0.00 0.06 0.00 -1.02 0.00 0.00 32.46 32.02 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 1.02 -4.13 5.56 5.02 -1.25 -5.13 118.16 119.25 1ner n LYS 22 Ca 0.00 -2.29 -0.14 0.00 -2.02 0.00 0.00 58.31 53.86 1ner n LYS 22 Cb 0.00 -1.16 -0.11 0.00 -0.02 0.00 0.00 35.03 33.74 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 -2.36 2.34 -0.15 -0.35 1.43 -1.24 -4.98 118.68 113.37 1ner s LEU 23 Ca 0.26 -0.71 -0.11 0.00 -1.03 0.00 0.00 54.13 52.55 1ner s LEU 23 Cb 0.31 -0.24 0.05 0.00 0.03 0.00 0.00 46.19 46.34 1ner s LEU 23 CO -0.06 -0.25 0.38 -0.94 0.23 0.00 0.00 176.35 175.72 1ner s SER 24 N -2.09 -0.45 0.49 2.29 1.04 -1.26 -2.93 113.70 110.80 1ner s SER 24 Ca -0.01 0.81 0.33 0.00 0.48 0.00 0.00 55.95 57.56 1ner s SER 24 Cb -0.05 0.74 1.45 0.00 0.10 0.00 0.00 66.02 68.26 1ner s SER 24 CO -0.00 -0.17 1.73 -0.07 0.98 0.00 0.00 173.24 175.71 1ner h LEU 25 N 6.50 0.15 -0.61 2.42 3.38 -1.96 1.65 115.31 126.83 1ner h LEU 25 Ca -0.33 0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.53 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 0.29 -0.01 -0.66 0.77 0.09 0.00 0.00 178.44 178.92 1ner h SER 26 N 0.11 0.18 -0.28 -0.43 4.64 -1.95 -2.94 113.55 112.88 1ner h SER 26 Ca 0.67 -0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.78 1ner h SER 26 Cb 2.35 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 64.38 1ner h SER 26 CO -0.15 0.78 -0.19 0.00 -0.87 0.00 0.00 176.83 176.41 1ner h ALA 27 N 1.21 0.40 -0.01 5.18 0.00 0.20 -2.71 119.26 123.53 1ner h ALA 27 Ca -0.01 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 1ner h ALA 27 Cb 1.18 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1ner h ALA 27 CO 0.10 0.33 -0.04 -0.07 0.00 0.00 0.00 179.25 179.57 1ner h LEU 28 N 0.35 0.01 0.34 0.00 3.38 -1.28 -0.52 115.31 117.61 1ner h LEU 28 Ca 0.05 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1ner h LEU 28 Cb 0.73 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1ner h LEU 28 CO 0.05 0.05 -0.17 -1.28 0.09 0.00 0.00 178.44 177.19 1ner h SER 29 N 0.01 -0.39 0.71 -0.43 0.87 -1.30 -2.95 113.55 110.07 1ner h SER 29 Ca 0.00 -0.16 -0.04 0.00 -1.23 0.00 0.00 61.79 60.37 1ner h SER 29 Cb 0.08 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.13 1ner h SER 29 CO 0.01 -0.01 -0.18 0.08 -0.53 0.00 0.00 176.83 176.19 1ner h ARG 30 N -0.83 0.00 -0.29 2.24 0.11 -1.27 0.38 114.38 114.72 1ner h ARG 30 Ca -0.05 0.00 -0.07 0.00 0.10 0.00 0.00 59.98 59.96 1ner h ARG 30 Cb 0.53 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.59 1ner h ARG 30 CO 0.08 0.18 -0.13 1.96 0.10 0.00 0.00 179.97 182.16 1ner h GLN 31 N 0.00 0.50 0.00 0.08 4.20 -1.03 -3.12 115.11 115.74 1ner h GLN 31 Ca -0.00 -0.14 -0.04 0.00 0.06 0.00 0.00 58.65 58.53 1ner h GLN 31 Cb 0.59 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 1ner h GLN 31 CO 0.02 0.62 -1.89 1.19 -0.67 0.00 0.00 178.83 178.11 1ner n PHE 32 N -4.20 0.00 -0.65 2.96 3.01 -1.05 -5.00 117.46 112.54 1ner n PHE 32 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.47 1ner n PHE 32 Cb 0.32 -0.47 0.00 0.00 -0.01 0.00 0.00 39.48 39.32 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 1.50 0.78 0.00 1.37 0.00 0.13 -4.99 105.19 103.98 1ner n GLY 33 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.20 0.00 -3.63 1.61 4.01 -1.18 -4.97 117.16 110.80 1ner n TYR 34 Ca 0.00 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.70 1ner n TYR 34 Cb 0.00 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 38.98 1ner n TYR 34 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ner s ALA 35 N -2.08 -2.09 0.33 -0.72 0.00 -1.26 -4.96 121.76 110.97 1ner s ALA 35 Ca 0.00 1.81 0.01 0.00 0.00 0.00 0.00 51.96 53.78 1ner s ALA 35 Cb 0.00 -1.40 0.55 0.00 0.00 0.00 0.00 23.12 22.27 1ner s ALA 35 CO 0.00 -0.24 1.97 -1.00 0.00 0.00 0.00 175.76 176.49 1ner h PRO 36 N 2.33 0.89 0.00 0.00 0.13 -1.92 -1.87 132.00 131.55 1ner h PRO 36 Ca -0.13 -0.08 -0.12 0.00 -0.87 0.00 0.00 66.00 64.80 1ner h PRO 36 Cb 1.18 -0.19 -0.02 0.00 0.13 0.00 0.00 31.00 32.11 1ner h PRO 36 CO 0.23 0.63 -0.59 1.79 -0.23 0.00 0.00 178.00 179.83 1ner h THR 37 N 0.90 1.11 0.33 1.56 1.35 -1.98 -3.16 112.91 113.02 1ner h THR 37 Ca 0.24 -2.29 -0.01 0.00 -0.55 0.00 0.00 66.41 63.80 1ner h THR 37 Cb -0.03 2.36 -0.01 0.00 -1.73 0.00 0.00 68.15 68.74 1ner h THR 37 CO -0.04 0.58 -0.28 0.74 -0.25 0.00 0.00 175.52 176.27 1ner h THR 38 N 0.00 0.00 -0.59 6.82 2.02 -1.71 0.31 112.91 119.76 1ner h THR 38 Ca -0.01 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.29 1ner h THR 38 Cb 1.31 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 67.63 1ner h THR 38 CO 0.08 0.00 0.04 0.25 0.37 0.00 0.00 175.52 176.26 1ner h LEU 39 N -0.59 -0.17 0.47 2.58 7.12 -1.66 -1.54 115.31 121.52 1ner h LEU 39 Ca -0.04 0.13 -0.02 0.00 0.13 0.00 0.00 57.88 58.09 1ner h LEU 39 Cb 0.50 0.22 -0.02 0.00 -0.53 0.00 0.00 40.66 40.83 1ner h LEU 39 CO -0.00 -0.07 -0.42 0.00 -0.13 0.00 0.00 178.44 177.82 1ner h ALA 40 N 1.51 -1.11 0.00 1.25 0.00 -1.43 -1.00 119.26 118.48 1ner h ALA 40 Ca 0.31 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1ner h ALA 40 Cb 0.48 0.63 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1ner h ALA 40 CO -0.47 -1.13 0.13 0.09 0.00 0.00 0.00 179.25 177.88 1ner n ASN 41 N -4.97 0.24 0.00 0.00 3.02 0.11 -0.56 115.26 113.09 1ner n ASN 41 Ca -0.10 0.53 0.10 0.00 -0.03 0.00 0.00 54.58 55.07 1ner n ASN 41 Cb 0.39 -0.54 0.53 0.00 -0.61 0.00 0.00 39.78 39.56 1ner n ASN 41 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ner n ALA 42 N -1.54 2.12 0.08 5.41 0.00 -0.38 -0.08 120.51 126.12 1ner n ALA 42 Ca -0.01 -0.11 0.03 0.00 0.00 0.00 0.00 53.44 53.36 1ner n ALA 42 Cb 0.15 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.26 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 -0.95 -3.41 115.31 114.33 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 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1ner h LEU 43 CO 0.00 0.43 -0.40 -1.84 0.09 0.00 0.00 178.44 176.73 1ner n GLU 44 N -2.96 2.75 -2.59 1.13 0.28 -1.04 -5.06 120.64 113.14 1ner n GLU 44 Ca -0.04 0.00 -0.37 0.00 -0.16 0.00 0.00 57.16 56.59 1ner n GLU 44 Cb 0.75 -0.70 -0.05 0.00 1.43 0.00 0.00 31.44 32.87 1ner n GLU 44 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1ner s ARG 45 N -1.05 4.33 -0.63 3.44 3.52 0.88 -4.92 118.95 124.52 1ner s ARG 45 Ca 0.00 1.51 -0.26 0.00 -0.13 0.00 0.00 55.73 56.85 1ner s ARG 45 Cb 0.00 -2.70 -0.05 0.00 -1.56 0.00 0.00 34.95 30.64 1ner s ARG 45 CO 0.00 0.01 2.08 -1.01 -0.81 0.00 0.00 175.30 175.57 1ner s HIS 46 N -1.57 1.46 -0.44 5.12 3.76 -1.26 -4.72 115.29 117.63 1ner s HIS 46 Ca 0.54 1.10 0.03 0.00 -0.15 0.00 0.00 55.06 56.58 1ner s HIS 46 Cb -0.23 -3.88 0.25 0.00 1.11 0.00 0.00 32.58 29.83 1ner s HIS 46 CO 0.29 -2.24 0.99 1.87 -0.85 0.00 0.00 174.74 174.79 1ner n TRP 47 N 14.36 -2.47 0.17 1.40 -0.00 -1.26 -4.99 117.44 124.64 1ner n TRP 47 Ca 0.30 -1.38 0.10 0.00 -0.00 0.00 0.00 57.50 56.52 1ner n TRP 47 Cb 0.52 1.41 0.54 0.00 -0.00 0.00 0.00 31.31 33.77 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 3.82 0.00 0.00 5.87 0.11 -1.92 -0.81 132.00 139.07 1ner h PRO 48 Ca -0.16 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.87 1ner h PRO 48 Cb 1.09 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1ner h PRO 48 CO 0.14 0.00 -0.38 -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 -2.15 116.57 115.12 1ner h LYS 49 Ca 0.00 0.00 -0.07 0.00 -0.85 0.00 0.00 60.65 59.73 1ner h LYS 49 Cb 0.19 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.81 1ner h LYS 49 CO 0.00 0.38 -0.34 0.78 -3.45 0.00 0.00 179.45 176.81 1ner h GLY 50 N 1.74 0.00 1.74 5.01 0.00 -1.51 -2.24 103.07 107.80 1ner h GLY 50 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 47.33 47.19 1ner h GLY 50 CO 0.05 0.00 -0.57 0.83 0.00 0.00 0.00 176.54 176.85 1ner h GLU 51 N 0.00 0.28 -0.88 4.80 3.07 -1.52 -2.88 114.58 117.46 1ner h GLU 51 Ca -0.00 -0.18 -0.01 0.00 -0.50 0.00 0.00 59.36 58.67 1ner h GLU 51 Cb 0.73 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 28.62 1ner h GLU 51 CO 0.04 0.77 0.51 1.96 -1.40 0.00 0.00 179.01 180.89 1ner h GLN 52 N 0.21 1.20 -0.37 2.33 1.08 -1.27 -0.94 115.11 117.35 1ner h GLN 52 Ca -0.00 -0.12 0.03 0.00 -1.45 0.00 0.00 58.65 57.11 1ner h GLN 52 Cb 1.06 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 28.21 1ner h GLN 52 CO 0.09 0.86 0.16 0.82 -0.95 0.00 0.00 178.83 179.81 1ner h ILE 53 N 1.21 0.95 0.43 2.54 2.04 -1.41 0.43 117.51 123.69 1ner h ILE 53 Ca 0.31 -0.12 -0.02 0.00 1.00 0.00 0.00 64.86 66.03 1ner h ILE 53 Cb -0.02 0.58 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 1ner h ILE 53 CO -0.06 0.06 -0.20 0.40 0.00 0.00 0.00 178.15 178.35 1ner h ILE 54 N 0.34 0.55 -0.52 -0.67 2.04 -1.38 -2.93 117.51 114.94 1ner h ILE 54 Ca 0.16 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 1ner h ILE 54 Cb 0.10 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.86 1ner h ILE 54 CO -0.13 0.06 0.30 0.00 0.00 0.00 0.00 178.15 178.38 1ner h ALA 55 N -0.31 1.54 -0.90 1.87 0.00 -1.04 -2.26 119.26 118.15 1ner h ALA 55 Ca -0.06 -0.07 0.07 0.00 0.00 0.00 0.00 54.91 54.85 1ner h ALA 55 Cb 0.54 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.05 1ner h ALA 55 CO 0.10 0.39 0.57 -0.91 0.00 0.00 0.00 179.25 179.39 1ner h ASN 56 N 0.72 0.89 0.19 0.00 4.21 -0.03 -0.07 115.58 121.49 1ner h ASN 56 Ca 0.19 0.02 -0.03 0.00 1.21 0.00 0.00 56.30 57.68 1ner h ASN 56 Cb -0.00 -0.17 -0.00 0.00 -1.12 0.00 0.00 38.32 37.02 1ner h ASN 56 CO -0.03 0.56 -0.16 0.00 -1.29 0.00 0.00 177.43 176.51 1ner h ALA 57 N 1.43 1.65 -0.40 -0.83 0.00 -1.22 -0.80 119.26 119.09 1ner h ALA 57 Ca 0.40 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ner h ALA 57 Cb 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1ner h ALA 57 CO -0.18 0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.55 1ner n LEU 58 N -4.22 2.50 -0.64 0.00 4.77 -0.08 -4.87 117.00 114.46 1ner n LEU 58 Ca -0.02 -1.26 -0.06 0.00 -0.03 0.00 0.00 56.01 54.64 1ner n LEU 58 Cb 0.23 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 40.95 1ner n LEU 58 CO 0.35 0.54 -0.06 -0.62 -1.33 0.00 0.00 177.39 176.27 1ner n GLU 59 N 0.64 -1.67 -1.29 3.23 -0.58 -0.31 -4.88 120.64 115.78 1ner n GLU 59 Ca 0.14 0.52 0.00 0.00 -0.42 0.00 0.00 57.16 57.41 1ner n GLU 59 Cb 0.44 -4.50 0.00 0.00 -0.57 0.00 0.00 31.44 26.81 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 -1.53 0.00 -4.11 2.62 5.66 -1.02 -5.02 114.28 110.88 1ner n THR 60 Ca -0.06 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.64 1ner n THR 60 Cb 0.36 -0.43 -0.08 0.00 -1.55 0.00 0.00 70.33 68.64 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 -1.32 2.62 0.46 1.09 3.01 -1.26 -4.31 119.74 120.02 1ner s LYS 61 Ca 0.00 -0.81 0.14 0.00 -1.01 0.00 0.00 55.97 54.29 1ner s LYS 61 Cb 0.00 -2.58 1.04 0.00 -1.01 0.00 0.00 37.83 35.28 1ner s LYS 61 CO 0.00 0.55 2.04 -1.00 0.51 0.00 0.00 175.35 177.44 1ner h PRO 62 N 3.40 0.08 0.00 -1.68 0.13 -1.90 -1.56 132.00 130.47 1ner h PRO 62 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 1ner h PRO 62 Cb 1.16 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1ner h PRO 62 CO 0.61 0.17 0.01 -0.85 -0.23 0.00 0.00 178.00 177.70 1ner n GLU 63 N -4.40 0.00 -0.05 0.86 0.28 -1.26 -1.24 120.64 114.82 1ner n GLU 63 Ca -0.02 0.11 -0.09 0.00 -0.16 0.00 0.00 57.16 57.00 1ner n GLU 63 Cb 0.18 -1.51 -0.15 0.00 1.43 0.00 0.00 31.44 31.40 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 -1.09 1.52 0.04 3.84 0.31 -0.59 -3.83 118.33 118.53 1ner n VAL 64 Ca 0.00 -0.82 -0.02 0.00 -0.01 0.00 0.00 64.34 63.49 1ner n VAL 64 Cb 0.01 -0.82 -0.08 0.00 -0.91 0.00 0.00 33.84 32.03 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 0.70 -2.35 2.52 5.03 -1.34 -3.41 117.51 118.67 1ner h ILE 65 Ca -0.40 -2.28 -0.59 0.00 -0.12 0.00 0.00 64.86 61.48 1ner h ILE 65 Cb 2.11 2.22 -0.40 0.00 -3.03 0.00 0.00 36.82 37.72 1ner h ILE 65 CO 0.06 0.40 -0.86 0.79 -0.68 0.00 0.00 178.15 177.86 1ner n TRP 66 N -3.00 1.00 0.22 1.37 8.01 -1.10 -3.35 117.44 120.58 1ner n TRP 66 Ca -0.09 -3.75 0.11 0.00 -1.31 0.00 0.00 57.50 52.45 1ner n TRP 66 Cb 0.88 -0.27 0.32 0.00 -2.01 0.00 0.00 31.31 30.23 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 4.76 0.00 0.00 -0.99 0.13 -1.80 -2.92 132.00 131.19 1ner h PRO 67 Ca 0.17 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.16 1ner h PRO 67 Cb 0.82 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.93 1ner h PRO 67 CO 0.56 0.17 -0.92 1.03 -0.23 0.00 0.00 178.00 178.61 1ner h SER 68 N 0.00 0.00 0.09 1.44 0.87 -1.92 -3.30 113.55 110.73 1ner h SER 68 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1ner h SER 68 Cb 0.91 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.87 1ner h SER 68 CO 0.02 0.56 -0.61 0.54 -0.53 0.00 0.00 176.83 176.81 1ner n ARG 69 N -3.09 0.64 -4.22 2.24 5.12 -1.22 -4.87 116.66 111.26 1ner n ARG 69 Ca -0.03 -0.50 -0.34 0.00 -1.93 0.00 0.00 57.85 55.05 1ner n ARG 69 Cb 0.79 -1.49 -0.10 0.00 -1.16 0.00 0.00 32.46 30.50 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 -2.70 3.17 -0.47 -1.55 1.51 -1.10 -5.05 117.35 111.16 1ner s TYR 70 Ca 0.15 0.02 0.07 0.00 -1.01 0.00 0.00 57.07 56.30 1ner s TYR 70 Cb 0.18 -1.96 0.19 0.00 -0.11 0.00 0.00 41.96 40.25 1ner s TYR 70 CO 0.67 0.21 0.69 -1.14 -1.11 0.00 0.00 175.55 174.87 1ner s GLN 71 N -0.04 0.97 -0.50 -0.62 2.00 -1.26 -4.86 119.66 115.36 1ner s GLN 71 Ca 0.04 -0.73 0.06 0.00 -2.00 0.00 0.00 55.36 52.73 1ner s GLN 71 Cb -0.13 0.01 0.21 0.00 0.80 0.00 0.00 33.01 33.91 1ner s GLN 71 CO 0.02 -1.27 0.83 0.00 -0.50 0.00 0.00 175.29 174.36 1ner n ALA 72 N 3.56 -1.81 -0.20 1.58 0.00 -1.26 -5.13 120.51 117.25 1ner n ALA 72 Ca 0.15 -1.12 0.00 0.00 0.00 0.00 0.00 53.44 52.47 1ner n ALA 72 Cb 0.56 -1.55 0.00 0.00 0.00 0.00 0.00 19.45 18.47 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 2.34 -0.72 0.66 0.00 0.00 -1.26 -5.26 105.19 100.95 1ner n GLY 73 Ca 0.13 -1.15 0.13 0.00 0.00 0.00 0.00 46.02 45.14 1ner n GLY 73 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48