#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2otl s ARG 8 N 0.00 0.34 -0.17 5.31 1.70 -0.65 -4.99 118.95 120.49 2otl s ARG 8 Ca 0.00 -0.16 -0.07 0.00 -0.47 0.00 0.00 55.73 55.03 2otl s ARG 8 Cb 0.00 0.14 -0.04 0.00 -0.57 0.00 0.00 34.95 34.47 2otl s ARG 8 CO 0.00 -0.15 0.09 0.08 -1.08 0.00 0.00 175.30 174.24 2otl s VAL 9 N -2.41 5.03 0.03 4.99 1.01 -1.26 -2.03 120.40 125.75 2otl s VAL 9 Ca 0.11 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.17 2otl s VAL 9 Cb 0.01 -3.25 -0.02 0.00 0.00 0.00 0.00 36.38 33.13 2otl s VAL 9 CO -0.04 0.50 -0.10 -0.69 0.00 0.00 0.00 175.10 174.77 2otl s VAL 10 N -0.01 0.74 -0.36 2.92 1.01 0.01 -4.97 120.40 119.74 2otl s VAL 10 Ca 0.07 -0.79 -0.13 0.00 0.00 0.00 0.00 61.98 61.13 2otl s VAL 10 Cb -0.12 -0.70 0.00 0.00 0.00 0.00 0.00 36.38 35.56 2otl s VAL 10 CO 0.00 -0.07 0.24 -0.89 0.00 0.00 0.00 175.10 174.38 2otl s THR 11 N -0.79 5.08 -0.27 3.92 2.01 -1.26 0.61 115.64 124.93 2otl s THR 11 Ca -0.02 -0.45 -0.19 0.00 0.31 0.00 0.00 61.69 61.34 2otl s THR 11 Cb -0.07 -3.69 -0.02 0.00 0.01 0.00 0.00 72.50 68.73 2otl s THR 11 CO 0.01 -0.11 0.59 -0.63 -0.69 0.00 0.00 174.62 173.79 2otl s ILE 12 N 1.67 5.00 -0.20 1.82 -1.09 0.16 -4.88 121.20 123.68 2otl s ILE 12 Ca 0.05 0.98 -0.26 0.00 -2.23 0.00 0.00 60.65 59.19 2otl s ILE 12 Cb -0.18 -3.91 -0.01 0.00 -1.58 0.00 0.00 42.46 36.78 2otl s ILE 12 CO 0.09 0.01 0.87 -2.16 -1.23 0.00 0.00 174.94 172.51 2otl s PRO 13 N 2.46 4.26 -0.47 2.79 0.04 -1.26 -1.52 135.00 141.29 2otl s PRO 13 Ca 0.24 1.05 0.03 0.00 0.04 0.00 0.00 61.00 62.36 2otl s PRO 13 Cb -0.15 -3.61 0.50 0.00 0.04 0.00 0.00 34.50 31.28 2otl s PRO 13 CO 0.09 -0.43 1.71 1.28 0.04 0.00 0.00 177.00 179.69 2otl n LEU 14 N 5.64 6.20 0.11 -3.56 4.77 0.22 -4.64 117.00 125.74 2otl n LEU 14 Ca 0.06 -4.20 -0.03 0.00 -0.03 0.00 0.00 56.01 51.80 2otl n LEU 14 Cb 0.48 -0.74 0.16 0.00 -2.33 0.00 0.00 43.42 40.99 2otl n LEU 14 CO 0.49 1.52 0.51 0.08 -1.33 0.00 0.00 177.39 178.66 2otl h ARG 15 N 1.70 0.16 0.00 3.23 0.11 -1.91 -3.17 114.38 114.49 2otl h ARG 15 Ca 0.48 -0.10 0.00 0.00 0.10 0.00 0.00 59.98 60.46 2otl h ARG 15 Cb 1.46 0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.56 2otl h ARG 15 CO 1.09 0.69 0.00 -0.25 0.10 0.00 0.00 179.97 181.59 2otl n ASP 16 N -3.88 0.00 0.00 0.08 8.00 -1.26 -2.63 116.55 116.86 2otl n ASP 16 Ca -0.02 0.22 0.10 0.00 0.71 0.00 0.00 54.79 55.80 2otl n ASP 16 Cb 0.59 -0.35 0.48 0.00 -0.02 0.00 0.00 41.12 41.82 2otl n ASP 16 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2otl n ALA 17 N -1.35 2.01 0.86 2.24 0.00 -1.20 -2.59 120.51 120.49 2otl n ALA 17 Ca 0.06 -0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.55 2otl n ALA 17 Cb 0.13 -1.34 0.54 0.00 0.00 0.00 0.00 19.45 18.78 2otl n ALA 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2otl n ARG 18 N -1.42 0.07 0.16 0.00 1.74 -1.08 -2.73 116.66 113.40 2otl n ARG 18 Ca 0.07 0.08 0.04 0.00 -0.77 0.00 0.00 57.85 57.27 2otl n ARG 18 Cb 0.22 -1.59 0.11 0.00 -1.02 0.00 0.00 32.46 30.18 2otl n ARG 18 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2otl h ALA 19 N 2.83 0.75 -2.62 7.54 0.00 -1.75 -3.44 119.26 122.57 2otl h ALA 19 Ca 0.00 -0.41 -0.55 0.00 0.00 0.00 0.00 54.91 53.95 2otl h ALA 19 Cb 0.55 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 2otl h ALA 19 CO 0.00 0.57 -0.02 -2.00 0.00 0.00 0.00 179.25 177.80 2otl s GLU 20 N -3.12 4.13 0.14 0.00 2.56 -1.11 -5.00 118.70 116.30 2otl s GLU 20 Ca 0.03 0.68 -0.34 0.00 0.00 0.00 0.00 54.97 55.33 2otl s GLU 20 Cb 0.08 -3.03 -0.16 0.00 2.00 0.00 0.00 34.13 33.03 2otl s GLU 20 CO 0.73 0.51 1.26 -0.35 -0.56 0.00 0.00 175.26 176.85 2otl n PRO 21 N 1.10 1.22 -0.35 4.30 -0.04 -1.26 -4.78 135.00 135.18 2otl n PRO 21 Ca -0.06 0.44 0.07 0.00 -0.04 0.00 0.00 63.50 63.91 2otl n PRO 21 Cb 0.51 -2.01 0.17 0.00 -0.04 0.00 0.00 33.50 32.13 2otl n PRO 21 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2otl h ASN 22 N 3.97 -0.81 0.00 3.54 2.35 -1.90 -0.02 115.58 122.72 2otl h ASN 22 Ca -0.45 0.29 0.00 0.00 -0.55 0.00 0.00 56.30 55.59 2otl h ASN 22 Cb 1.33 0.58 0.00 0.00 0.05 0.00 0.00 38.32 40.28 2otl h ASN 22 CO 0.74 -0.33 0.00 0.00 -1.65 0.00 0.00 177.43 176.19 2otl n HIS 23 N -5.59 0.00 -1.84 1.19 1.44 -1.26 -2.19 115.22 106.97 2otl n HIS 23 Ca 0.17 0.00 0.04 0.00 -2.01 0.00 0.00 57.72 55.92 2otl n HIS 23 Cb 0.55 0.00 0.06 0.00 0.12 0.00 0.00 29.99 30.72 2otl n HIS 23 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 2otl n LYS 24 N -0.96 0.47 -0.22 -1.40 5.02 -0.02 -4.54 118.16 116.51 2otl n LYS 24 Ca 0.06 -1.83 -0.06 0.00 -2.02 0.00 0.00 58.31 54.46 2otl n LYS 24 Cb 0.03 -0.75 0.04 0.00 -0.02 0.00 0.00 35.03 34.33 2otl n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2otl h ARG 25 N 0.32 0.83 -0.51 1.97 3.08 -1.13 -3.00 114.38 115.94 2otl h ARG 25 Ca -0.05 -0.05 0.08 0.00 0.07 0.00 0.00 59.98 60.03 2otl h ARG 25 Cb 1.37 -0.19 -0.06 0.00 0.08 0.00 0.00 29.97 31.17 2otl h ARG 25 CO 0.02 0.56 0.14 0.00 -1.07 0.00 0.00 179.97 179.62 2otl h ALA 26 N 1.23 0.60 -0.06 0.04 0.00 -1.16 0.27 119.26 120.17 2otl h ALA 26 Ca 0.23 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.25 2otl h ALA 26 Cb -0.09 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2otl h ALA 26 CO -0.05 -0.26 -0.05 -0.44 0.00 0.00 0.00 179.25 178.45 2otl h ASP 27 N 0.30 -0.16 -0.34 0.00 3.45 -1.79 -0.16 116.42 117.72 2otl h ASP 27 Ca 0.25 0.04 -0.06 0.00 0.43 0.00 0.00 57.03 57.69 2otl h ASP 27 Cb 0.31 0.08 -0.02 0.00 -0.56 0.00 0.00 39.33 39.14 2otl h ASP 27 CO -0.29 -0.07 0.03 0.50 -1.57 0.00 0.00 179.24 177.83 2otl h LYS 28 N -0.06 0.68 -0.16 3.56 1.63 -1.25 -2.30 116.57 118.66 2otl h LYS 28 Ca 0.04 -0.15 -0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2otl h LYS 28 Cb 0.13 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 31.66 2otl h LYS 28 CO -0.10 0.67 0.10 0.00 -3.45 0.00 0.00 179.45 176.67 2otl h ALA 29 N 1.39 0.21 -0.47 5.00 0.00 0.14 -0.39 119.26 125.14 2otl h ALA 29 Ca 0.14 -0.04 0.10 0.00 0.00 0.00 0.00 54.91 55.10 2otl h ALA 29 Cb 0.36 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2otl h ALA 29 CO 0.01 -0.27 0.32 1.98 0.00 0.00 0.00 179.25 181.29 2otl h MET 30 N 0.18 0.20 0.07 0.00 1.85 -0.52 -1.06 114.93 115.65 2otl h MET 30 Ca 0.06 -0.01 -0.20 0.00 -0.61 0.00 0.00 59.70 58.93 2otl h MET 30 Cb 0.04 -0.04 0.02 0.00 0.43 0.00 0.00 31.60 32.05 2otl h MET 30 CO -0.01 0.13 -0.84 0.82 -0.40 0.00 0.00 176.91 176.60 2otl h ILE 31 N 0.20 1.41 -0.95 1.77 2.04 -0.89 -3.23 117.51 117.87 2otl h ILE 31 Ca 0.22 -2.32 0.09 0.00 1.00 0.00 0.00 64.86 63.85 2otl h ILE 31 Cb 0.59 2.80 -0.07 0.00 -0.74 0.00 0.00 36.82 39.40 2otl h ILE 31 CO -0.04 0.68 0.59 -0.07 0.00 0.00 0.00 178.15 179.31 2otl h LEU 32 N -0.07 0.90 -0.25 1.44 3.38 0.15 -0.98 115.31 119.87 2otl h LEU 32 Ca -0.13 0.03 0.03 0.00 0.09 0.00 0.00 57.88 57.90 2otl h LEU 32 Cb 1.58 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 42.15 2otl h LEU 32 CO 0.16 0.53 0.08 0.40 0.09 0.00 0.00 178.44 179.70 2otl h ILE 33 N 1.00 0.93 -0.33 1.22 2.04 -1.41 -0.11 117.51 120.86 2otl h ILE 33 Ca 0.44 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 66.22 2otl h ILE 33 Cb 0.32 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 2otl h ILE 33 CO -0.22 0.04 0.17 -0.09 0.00 0.00 0.00 178.15 178.05 2otl h ARG 34 N 0.20 0.46 -0.54 2.37 2.43 -1.38 -1.69 114.38 116.24 2otl h ARG 34 Ca 0.11 -0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 2otl h ARG 34 Cb 0.08 -0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 29.51 2otl h ARG 34 CO -0.11 0.41 0.21 0.93 -1.51 0.00 0.00 179.97 179.89 2otl h GLU 35 N 0.40 0.77 0.45 0.20 5.08 -0.89 -1.33 114.58 119.27 2otl h GLU 35 Ca 0.11 -0.12 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2otl h GLU 35 Cb 0.08 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.20 2otl h GLU 35 CO -0.02 0.64 -0.22 1.25 -1.00 0.00 0.00 179.01 179.67 2otl h HIS 36 N 0.77 -0.56 -0.85 4.33 2.76 -0.69 -2.00 115.15 118.90 2otl h HIS 36 Ca 0.18 -0.01 0.05 0.00 -2.20 0.00 0.00 60.37 58.40 2otl h HIS 36 Cb 0.16 0.19 -0.06 0.00 1.55 0.00 0.00 27.41 29.25 2otl h HIS 36 CO 0.01 -0.25 0.53 -0.07 -1.30 0.00 0.00 177.93 176.85 2otl h LEU 37 N -0.87 0.84 -0.55 0.26 3.38 -1.20 0.41 115.31 117.58 2otl h LEU 37 Ca -0.06 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2otl h LEU 37 Cb 0.57 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 2otl h LEU 37 CO 0.10 0.55 0.30 0.00 0.09 0.00 0.00 178.44 179.49 2otl h ALA 38 N 1.39 0.71 -0.02 1.53 0.00 -1.24 0.11 119.26 121.74 2otl h ALA 38 Ca 0.36 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2otl h ALA 38 Cb 0.13 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 2otl h ALA 38 CO -0.16 0.22 -0.00 -0.22 0.00 0.00 0.00 179.25 179.09 2otl h LYS 39 N 0.74 0.04 0.00 0.00 3.64 -0.63 -1.95 116.57 118.41 2otl h LYS 39 Ca 0.19 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 2otl h LYS 39 Cb 0.04 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2otl h LYS 39 CO -0.03 0.38 0.00 0.45 -2.27 0.00 0.00 179.45 177.98 2otl h HIS 40 N -0.31 0.00 -0.30 1.91 3.86 -0.86 -3.15 115.15 116.30 2otl h HIS 40 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2otl h HIS 40 Cb 0.37 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.84 2otl h HIS 40 CO 0.05 0.00 0.00 1.19 0.86 0.00 0.00 177.93 180.03 2otl n PHE 41 N -2.80 0.40 -3.35 2.45 3.01 0.39 -4.99 117.46 112.57 2otl n PHE 41 Ca 0.03 -0.36 -0.24 0.00 1.01 0.00 0.00 57.45 57.89 2otl n PHE 41 Cb 0.40 -0.02 0.02 0.00 -0.01 0.00 0.00 39.48 39.87 2otl n PHE 41 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 2otl n SER 42 N 0.74 -4.84 -4.76 4.37 7.64 -0.87 -4.99 113.62 110.90 2otl n SER 42 Ca 0.12 -0.43 -0.30 0.00 1.01 0.00 0.00 58.87 59.27 2otl n SER 42 Cb 0.43 -3.93 -0.07 0.00 -1.01 0.00 0.00 64.21 59.63 2otl n SER 42 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2otl s VAL 43 N -3.09 1.50 0.18 0.44 1.01 -0.79 -5.05 120.40 114.59 2otl s VAL 43 Ca 0.42 -1.88 -0.14 0.00 0.00 0.00 0.00 61.98 60.38 2otl s VAL 43 Cb -0.21 -2.38 -0.07 0.00 0.00 0.00 0.00 36.38 33.72 2otl s VAL 43 CO 0.52 0.00 0.57 -1.81 0.00 0.00 0.00 175.10 174.38 2otl s ASP 44 N -3.92 6.80 0.63 3.32 1.11 -1.26 -4.54 116.67 118.81 2otl s ASP 44 Ca 0.19 1.08 0.35 0.00 0.18 0.00 0.00 52.55 54.35 2otl s ASP 44 Cb 0.03 -2.29 2.01 0.00 1.07 0.00 0.00 42.92 43.74 2otl s ASP 44 CO 0.10 0.05 2.23 -0.33 1.18 0.00 0.00 175.17 178.41 2otl h GLU 45 N 3.29 0.00 0.00 8.23 5.08 -1.91 0.12 114.58 129.38 2otl h GLU 45 Ca -0.48 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.80 2otl h GLU 45 Cb 1.19 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.43 2otl h GLU 45 CO 0.66 0.00 -0.38 -0.44 -1.00 0.00 0.00 179.01 177.86 2otl h ASP 46 N 0.00 0.00 -0.33 1.42 3.32 -1.97 -3.12 116.42 115.74 2otl h ASP 46 Ca 0.02 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.07 2otl h ASP 46 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2otl h ASP 46 CO -0.00 0.38 0.00 0.00 -1.72 0.00 0.00 179.24 177.90 2otl n ALA 47 N -2.23 2.46 -2.54 3.45 0.00 0.39 -4.86 120.51 117.17 2otl n ALA 47 Ca 0.01 -0.80 -0.41 0.00 0.00 0.00 0.00 53.44 52.23 2otl n ALA 47 Cb 0.59 -0.97 -0.08 0.00 0.00 0.00 0.00 19.45 18.99 2otl n ALA 47 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2otl s VAL 48 N -1.57 5.07 -0.20 0.00 1.01 -1.16 -1.65 120.40 121.91 2otl s VAL 48 Ca 0.35 0.12 -0.10 0.00 0.00 0.00 0.00 61.98 62.36 2otl s VAL 48 Cb 0.20 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.60 2otl s VAL 48 CO 0.28 -0.22 0.12 -0.60 0.00 0.00 0.00 175.10 174.69 2otl s ARG 49 N 2.23 4.14 -0.31 2.72 3.52 0.88 -4.98 118.95 127.15 2otl s ARG 49 Ca 0.15 -0.25 -0.05 0.00 -0.13 0.00 0.00 55.73 55.46 2otl s ARG 49 Cb -0.16 -3.40 0.03 0.00 -1.56 0.00 0.00 34.95 29.86 2otl s ARG 49 CO 0.13 0.26 0.06 -0.51 -0.81 0.00 0.00 175.30 174.43 2otl s LEU 50 N 0.46 4.01 0.28 -0.88 1.43 -1.26 -1.22 118.68 121.51 2otl s LEU 50 Ca 0.07 -1.06 -0.30 0.00 -1.03 0.00 0.00 54.13 51.81 2otl s LEU 50 Cb -0.12 -1.81 -0.12 0.00 0.03 0.00 0.00 46.19 44.18 2otl s LEU 50 CO -0.01 -0.27 1.63 -0.62 0.23 0.00 0.00 176.35 177.32 2otl s ASP 51 N 1.38 6.35 0.65 2.29 -1.08 0.78 -4.82 116.67 122.21 2otl s ASP 51 Ca -0.02 2.97 0.06 0.00 -0.52 0.00 0.00 52.55 55.04 2otl s ASP 51 Cb -0.19 -2.63 0.31 0.00 -1.46 0.00 0.00 42.92 38.95 2otl s ASP 51 CO 0.01 -0.94 1.17 -0.65 0.52 0.00 0.00 175.17 175.27 2otl h PRO 52 N 5.13 0.00 -0.57 4.34 0.11 -1.98 0.76 132.00 139.80 2otl h PRO 52 Ca -0.46 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.63 2otl h PRO 52 Cb 1.22 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.30 2otl h PRO 52 CO 0.82 0.00 0.27 0.66 -0.21 0.00 0.00 178.00 179.54 2otl h SER 53 N 0.00 0.71 -0.24 -2.05 4.64 -1.93 -0.53 113.55 114.15 2otl h SER 53 Ca 0.00 -0.07 -0.07 0.00 -0.47 0.00 0.00 61.79 61.18 2otl h SER 53 Cb 1.72 -0.18 -0.01 0.00 -0.31 0.00 0.00 62.40 63.62 2otl h SER 53 CO 0.00 0.61 -0.14 0.40 -0.87 0.00 0.00 176.83 176.82 2otl h ILE 54 N 0.80 1.31 -0.57 0.95 2.04 -1.18 -1.89 117.51 118.97 2otl h ILE 54 Ca 0.20 -1.24 0.04 0.00 1.00 0.00 0.00 64.86 64.86 2otl h ILE 54 Cb 0.08 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.72 2otl h ILE 54 CO -0.03 0.38 0.31 -1.13 0.00 0.00 0.00 178.15 177.69 2otl h ASN 55 N 0.23 0.46 0.09 1.72 -1.24 -1.50 -1.60 115.58 113.74 2otl h ASN 55 Ca 0.05 0.02 -0.10 0.00 0.71 0.00 0.00 56.30 56.99 2otl h ASN 55 Cb 0.66 -0.07 -0.01 0.00 0.73 0.00 0.00 38.32 39.63 2otl h ASN 55 CO 0.04 0.31 -0.32 -0.33 -1.29 0.00 0.00 177.43 175.85 2otl h GLU 56 N 0.59 0.34 0.39 6.67 5.08 -1.08 -1.16 114.58 125.41 2otl h GLU 56 Ca 0.25 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 2otl h GLU 56 Cb 0.12 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.36 2otl h GLU 56 CO -0.15 0.63 -0.19 0.00 -1.00 0.00 0.00 179.01 178.30 2otl h ALA 57 N 1.37 -0.52 -0.57 3.43 0.00 -0.48 0.67 119.26 123.16 2otl h ALA 57 Ca 0.04 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2otl h ALA 57 Cb 0.71 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 2otl h ALA 57 CO 0.05 -0.73 0.29 0.00 0.00 0.00 0.00 179.25 178.86 2otl h ALA 58 N -0.06 1.43 -0.01 0.00 0.00 -1.18 -2.36 119.26 117.07 2otl h ALA 58 Ca -0.05 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2otl h ALA 58 Cb 0.46 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2otl h ALA 58 CO 0.09 0.46 -0.01 0.91 0.00 0.00 0.00 179.25 180.70 2otl n TRP 59 N -4.37 0.00 -0.29 0.00 7.02 -0.45 -4.53 117.44 114.82 2otl n TRP 59 Ca 0.05 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.64 2otl n TRP 59 Cb 0.12 -0.00 0.25 0.00 -2.42 0.00 0.00 31.31 29.26 2otl n TRP 59 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2otl h ALA 60 N 4.32 1.14 -0.63 6.99 0.00 -0.29 -0.88 119.26 129.90 2otl h ALA 60 Ca 0.00 0.23 -0.14 0.00 0.00 0.00 0.00 54.91 55.00 2otl h ALA 60 Cb 0.47 0.35 -0.08 0.00 0.00 0.00 0.00 17.79 18.53 2otl h ALA 60 CO 0.00 -0.45 0.16 0.54 0.00 0.00 0.00 179.25 179.50 2otl n ARG 61 N -5.26 3.84 0.00 0.00 1.74 -1.26 -5.06 116.66 110.66 2otl n ARG 61 Ca 0.19 -3.09 0.00 0.00 -0.77 0.00 0.00 57.85 54.18 2otl n ARG 61 Cb 0.63 -2.17 0.00 0.00 -1.02 0.00 0.00 32.46 29.89 2otl n ARG 61 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2otl n GLY 62 N -0.06 -3.75 0.22 -0.13 0.00 -0.34 -4.13 105.19 97.00 2otl n GLY 62 Ca 0.36 -2.14 0.11 0.00 0.00 0.00 0.00 46.02 44.34 2otl n GLY 62 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2otl h ARG 63 N 0.91 0.00 0.00 1.61 2.43 -1.90 -3.35 114.38 114.09 2otl h ARG 63 Ca 0.00 0.00 -0.37 0.00 -0.81 0.00 0.00 59.98 58.80 2otl h ARG 63 Cb 0.00 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.48 2otl h ARG 63 CO 0.00 0.19 -2.39 0.00 -1.51 0.00 0.00 179.97 176.26 2otl n ALA 64 N -2.18 1.47 -2.70 2.80 0.00 -1.26 -0.62 120.51 118.02 2otl n ALA 64 Ca 0.01 -1.23 -0.43 0.00 0.00 0.00 0.00 53.44 51.79 2otl n ALA 64 Cb 0.46 -0.19 0.01 0.00 0.00 0.00 0.00 19.45 19.73 2otl n ALA 64 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2otl n ASN 65 N -2.94 5.69 -4.80 0.00 3.02 -1.26 -4.68 115.26 110.29 2otl n ASN 65 Ca -0.37 -3.23 -0.38 0.00 -0.03 0.00 0.00 54.58 50.58 2otl n ASN 65 Cb 1.10 -1.39 -0.06 0.00 -0.61 0.00 0.00 39.78 38.82 2otl n ASN 65 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2otl s THR 66 N -0.98 4.51 0.38 3.41 2.01 -1.26 -4.35 115.64 119.36 2otl s THR 66 Ca 0.36 1.44 -0.27 0.00 0.31 0.00 0.00 61.69 63.52 2otl s THR 66 Cb 0.06 -3.97 -0.10 0.00 0.01 0.00 0.00 72.50 68.50 2otl s THR 66 CO 0.04 0.38 1.34 -2.16 -0.69 0.00 0.00 174.62 173.53 2otl s PRO 67 N -1.53 4.11 0.48 4.92 0.04 -1.26 -4.94 135.00 136.82 2otl s PRO 67 Ca 0.38 2.25 0.15 0.00 0.04 0.00 0.00 61.00 63.82 2otl s PRO 67 Cb -0.20 -2.89 1.13 0.00 0.04 0.00 0.00 34.50 32.58 2otl s PRO 67 CO 0.23 -0.41 2.07 0.66 0.04 0.00 0.00 177.00 179.59 2otl h SER 68 N 2.95 0.02 -4.61 6.66 4.64 -1.95 -3.43 113.55 117.83 2otl h SER 68 Ca -0.50 -0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.43 2otl h SER 68 Cb 1.24 -0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.18 2otl h SER 68 CO 0.64 0.10 -0.58 -0.54 -0.87 0.00 0.00 176.83 175.57 2otl s LYS 69 N -4.89 1.52 -0.30 4.77 1.02 -1.26 0.72 119.74 121.33 2otl s LYS 69 Ca -0.05 -1.85 -0.11 0.00 0.02 0.00 0.00 55.97 53.98 2otl s LYS 69 Cb 0.16 -0.17 0.16 0.00 -0.52 0.00 0.00 37.83 37.46 2otl s LYS 69 CO 0.68 -0.39 0.81 -1.50 -0.92 0.00 0.00 175.35 174.03 2otl s ILE 70 N -3.67 -0.75 -0.06 2.17 2.07 -0.58 -4.89 121.20 115.49 2otl s ILE 70 Ca 0.36 0.00 -0.30 0.00 -1.41 0.00 0.00 60.65 59.30 2otl s ILE 70 Cb 0.06 -1.00 -0.03 0.00 0.13 0.00 0.00 42.46 41.62 2otl s ILE 70 CO 0.16 0.00 1.16 -0.13 -1.91 0.00 0.00 174.94 174.22 2otl s ARG 71 N 2.73 4.37 -0.04 3.50 0.52 -1.26 -0.67 118.95 128.10 2otl s ARG 71 Ca -0.00 1.62 0.03 0.00 -0.52 0.00 0.00 55.73 56.86 2otl s ARG 71 Cb -0.10 -3.55 0.00 0.00 0.52 0.00 0.00 34.95 31.82 2otl s ARG 71 CO -0.18 -0.42 -0.13 0.54 0.02 0.00 0.00 175.30 175.13 2otl s VAL 72 N 2.16 1.12 -0.40 3.52 0.11 0.20 -4.21 120.40 122.90 2otl s VAL 72 Ca 0.54 -0.53 -0.14 0.00 -2.93 0.00 0.00 61.98 58.92 2otl s VAL 72 Cb -0.24 -0.98 0.01 0.00 -1.53 0.00 0.00 36.38 33.65 2otl s VAL 72 CO 0.21 0.33 0.29 -0.60 -3.33 0.00 0.00 175.10 172.00 2otl s ARG 73 N 0.18 3.04 0.25 1.54 3.52 -0.19 -0.81 118.95 126.48 2otl s ARG 73 Ca -0.05 -0.96 0.10 0.00 -0.13 0.00 0.00 55.73 54.69 2otl s ARG 73 Cb -0.11 -3.94 -0.05 0.00 -1.56 0.00 0.00 34.95 29.30 2otl s ARG 73 CO 0.02 -0.70 -0.11 0.00 -0.81 0.00 0.00 175.30 173.70 2otl s ALA 74 N 1.68 2.93 -0.02 6.12 0.00 -0.86 -1.57 121.76 130.04 2otl s ALA 74 Ca 0.05 -1.68 -0.01 0.00 0.00 0.00 0.00 51.96 50.32 2otl s ALA 74 Cb -0.19 -0.57 0.01 0.00 0.00 0.00 0.00 23.12 22.38 2otl s ALA 74 CO 0.10 0.33 0.04 0.00 0.00 0.00 0.00 175.76 176.23 2otl s ALA 75 N -2.19 -0.04 -0.11 0.00 0.00 -0.47 -1.64 121.76 117.31 2otl s ALA 75 Ca 0.29 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.47 2otl s ALA 75 Cb -0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 2otl s ALA 75 CO 0.16 -0.06 -0.15 0.50 0.00 0.00 0.00 175.76 176.21 2otl s ARG 76 N 0.47 3.17 0.00 0.00 3.52 -1.26 -1.57 118.95 123.27 2otl s ARG 76 Ca -0.04 -0.73 -0.00 0.00 -0.13 0.00 0.00 55.73 54.83 2otl s ARG 76 Cb -0.05 -2.52 0.00 0.00 -1.56 0.00 0.00 34.95 30.81 2otl s ARG 76 CO -0.02 0.28 0.02 1.97 -0.81 0.00 0.00 175.30 176.74 2otl n PHE 77 N 3.31 -0.36 0.00 5.12 1.16 -0.80 -4.67 117.46 121.23 2otl n PHE 77 Ca -0.18 -0.01 0.00 0.00 -1.87 0.00 0.00 57.45 55.39 2otl n PHE 77 Cb 0.53 0.01 0.00 0.00 -1.61 0.00 0.00 39.48 38.40 2otl n PHE 77 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 2otl n GLU 78 N -0.01 0.00 0.19 3.97 2.13 -1.26 -1.40 120.64 124.25 2otl n GLU 78 Ca 0.00 0.00 0.05 0.00 0.66 0.00 0.00 57.16 57.87 2otl n GLU 78 Cb 0.01 0.00 0.48 0.00 0.27 0.00 0.00 31.44 32.20 2otl n GLU 78 CO 0.00 0.00 0.00 1.05 -0.41 0.00 0.00 177.13 177.77 2otl h GLU 79 N 0.00 0.09 0.00 5.31 -0.00 -2.03 -3.15 114.58 114.80 2otl h GLU 79 Ca 0.00 -0.02 -0.07 0.00 -0.00 0.00 0.00 59.36 59.27 2otl h GLU 79 Cb 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 28.75 28.72 2otl h GLU 79 CO 0.00 0.23 -1.85 -1.91 -0.00 0.00 0.00 179.01 175.47 2otl n GLU 80 N -4.34 0.73 -0.25 1.06 2.13 -1.26 -5.09 120.64 113.63 2otl n GLU 80 Ca -0.02 -0.12 0.00 0.00 0.66 0.00 0.00 57.16 57.68 2otl n GLU 80 Cb 0.23 -1.41 0.00 0.00 0.27 0.00 0.00 31.44 30.53 2otl n GLU 80 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2otl n GLY 81 N 1.65 -0.19 3.57 8.31 0.00 -1.19 -5.05 105.19 112.29 2otl n GLY 81 Ca -0.09 -0.93 -0.11 0.00 0.00 0.00 0.00 46.02 44.89 2otl n GLY 81 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2otl s GLU 82 N -1.65 1.78 -0.02 1.61 4.04 -0.50 -4.75 118.70 119.22 2otl s GLU 82 Ca 0.00 -1.50 -0.00 0.00 0.04 0.00 0.00 54.97 53.50 2otl s GLU 82 Cb 0.00 0.47 0.02 0.00 0.02 0.00 0.00 34.13 34.65 2otl s GLU 82 CO 0.00 -0.75 0.04 0.00 -1.84 0.00 0.00 175.26 172.70 2otl s ALA 83 N -3.39 0.01 -0.13 -0.84 0.00 -0.66 -1.90 121.76 114.85 2otl s ALA 83 Ca 0.25 0.26 -0.02 0.00 0.00 0.00 0.00 51.96 52.46 2otl s ALA 83 Cb -0.01 -0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.89 2otl s ALA 83 CO 0.14 -0.08 -0.08 0.42 0.00 0.00 0.00 175.76 176.16 2otl s ILE 84 N 0.76 3.50 0.10 0.00 1.01 -0.61 -0.08 121.20 125.88 2otl s ILE 84 Ca -0.06 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.11 2otl s ILE 84 Cb -0.09 -2.49 -0.04 0.00 0.01 0.00 0.00 42.46 39.85 2otl s ILE 84 CO -0.02 0.52 -0.09 -0.69 0.00 0.00 0.00 174.94 174.66 2otl s VAL 85 N 0.19 0.87 0.32 2.92 1.01 -0.36 -1.37 120.40 123.98 2otl s VAL 85 Ca -0.05 -1.70 -0.10 0.00 0.00 0.00 0.00 61.98 60.13 2otl s VAL 85 Cb -0.14 -1.41 0.01 0.00 0.00 0.00 0.00 36.38 34.84 2otl s VAL 85 CO 0.04 -0.63 0.57 -1.83 0.00 0.00 0.00 175.10 173.25 2otl s GLU 86 N -3.01 1.87 0.00 2.72 -1.05 -0.61 -0.16 118.70 118.46 2otl s GLU 86 Ca 0.07 -1.46 0.00 0.00 -0.15 0.00 0.00 54.97 53.42 2otl s GLU 86 Cb -0.01 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.19 2otl s GLU 86 CO -0.01 -0.81 0.00 0.00 0.95 0.00 0.00 175.26 175.39 2otl n ALA 87 N -0.49 0.00 -1.08 -0.84 0.00 -1.26 -1.03 120.51 115.82 2otl n ALA 87 Ca -0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2otl n ALA 87 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.06 2otl n ALA 87 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89