#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cpw s ARG 8 N 0.00 1.38 -0.22 5.31 1.70 -0.65 -5.00 118.95 121.48 3cpw s ARG 8 Ca 0.00 -0.70 -0.09 0.00 -0.47 0.00 0.00 55.73 54.47 3cpw s ARG 8 Cb 0.00 0.51 -0.04 0.00 -0.57 0.00 0.00 34.95 34.85 3cpw s ARG 8 CO 0.00 -0.63 0.11 0.08 -1.08 0.00 0.00 175.30 173.78 3cpw s VAL 9 N -3.58 5.01 0.08 4.99 1.01 -1.26 -1.85 120.40 124.80 3cpw s VAL 9 Ca 0.09 0.06 0.08 0.00 0.00 0.00 0.00 61.98 62.21 3cpw s VAL 9 Cb -0.03 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.01 3cpw s VAL 9 CO -0.00 0.39 -0.22 -0.69 0.00 0.00 0.00 175.10 174.58 3cpw s VAL 10 N 0.86 1.76 -0.37 2.92 1.01 0.43 -4.96 120.40 122.04 3cpw s VAL 10 Ca 0.06 -1.44 -0.08 0.00 0.00 0.00 0.00 61.98 60.52 3cpw s VAL 10 Cb -0.13 -1.57 0.05 0.00 0.00 0.00 0.00 36.38 34.73 3cpw s VAL 10 CO 0.03 0.06 0.17 -0.89 0.00 0.00 0.00 175.10 174.47 3cpw s THR 11 N -1.02 4.07 -0.26 3.92 2.01 -1.26 -0.00 115.64 123.10 3cpw s THR 11 Ca 0.08 -1.18 -0.21 0.00 0.31 0.00 0.00 61.69 60.68 3cpw s THR 11 Cb -0.10 -3.36 -0.01 0.00 0.01 0.00 0.00 72.50 69.04 3cpw s THR 11 CO 0.03 -0.30 0.68 -0.63 -0.69 0.00 0.00 174.62 173.71 3cpw s ILE 12 N 1.43 4.94 0.02 1.82 -1.09 -0.31 -4.91 121.20 123.10 3cpw s ILE 12 Ca 0.01 1.20 -0.25 0.00 -2.23 0.00 0.00 60.65 59.38 3cpw s ILE 12 Cb -0.21 -3.99 -0.05 0.00 -1.58 0.00 0.00 42.46 36.64 3cpw s ILE 12 CO 0.03 -0.02 0.76 -2.16 -1.23 0.00 0.00 174.94 172.32 3cpw s PRO 13 N 2.61 4.48 -0.29 2.79 0.04 -1.26 -2.18 135.00 141.19 3cpw s PRO 13 Ca 0.28 1.03 0.09 0.00 0.04 0.00 0.00 61.00 62.45 3cpw s PRO 13 Cb -0.15 -3.39 0.50 0.00 0.04 0.00 0.00 34.50 31.50 3cpw s PRO 13 CO 0.09 0.22 1.45 1.28 0.04 0.00 0.00 177.00 180.08 3cpw n LEU 14 N 3.07 4.02 0.19 -3.56 4.77 0.60 -4.68 117.00 121.39 3cpw n LEU 14 Ca -0.02 -3.81 0.03 0.00 -0.03 0.00 0.00 56.01 52.19 3cpw n LEU 14 Cb 0.50 -0.63 0.41 0.00 -2.33 0.00 0.00 43.42 41.37 3cpw n LEU 14 CO 0.47 1.29 0.80 0.08 -1.33 0.00 0.00 177.39 178.70 3cpw h ARG 15 N 1.00 0.02 0.00 3.23 0.11 -1.91 -2.79 114.38 114.04 3cpw h ARG 15 Ca 0.21 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.28 3cpw h ARG 15 Cb 1.61 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.69 3cpw h ARG 15 CO 0.36 0.31 0.00 -0.25 0.10 0.00 0.00 179.97 180.49 3cpw n ASP 16 N -4.19 0.00 0.14 0.08 8.00 -1.26 -2.19 116.55 117.14 3cpw n ASP 16 Ca -0.02 -0.12 0.13 0.00 0.71 0.00 0.00 54.79 55.49 3cpw n ASP 16 Cb 0.34 -0.21 0.43 0.00 -0.02 0.00 0.00 41.12 41.67 3cpw n ASP 16 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3cpw h ALA 17 N 2.87 1.00 0.00 2.24 0.00 -1.85 -2.91 119.26 120.61 3cpw h ALA 17 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3cpw h ALA 17 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 3cpw h ALA 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.25 3cpw h ARG 18 N 0.00 0.00 0.00 0.00 3.08 -1.66 -2.10 114.38 113.70 3cpw h ARG 18 Ca 0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 3cpw h ARG 18 Cb 0.62 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.67 3cpw h ARG 18 CO 0.00 0.00 -0.20 0.00 -1.07 0.00 0.00 179.97 178.70 3cpw h ALA 19 N 2.14 1.05 -2.33 0.04 0.00 -1.75 -3.44 119.26 114.98 3cpw h ALA 19 Ca 0.00 -0.18 -0.50 0.00 0.00 0.00 0.00 54.91 54.23 3cpw h ALA 19 Cb 0.36 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.13 3cpw h ALA 19 CO 0.00 0.25 0.05 -2.00 0.00 0.00 0.00 179.25 177.55 3cpw s GLU 20 N -3.73 3.66 0.35 0.00 2.56 -0.79 -5.02 118.70 115.74 3cpw s GLU 20 Ca 0.00 0.26 -0.28 0.00 0.00 0.00 0.00 54.97 54.95 3cpw s GLU 20 Cb 0.11 -2.45 -0.12 0.00 2.00 0.00 0.00 34.13 33.67 3cpw s GLU 20 CO 0.62 -0.03 1.41 -0.35 -0.56 0.00 0.00 175.26 176.36 3cpw n PRO 21 N -1.53 2.43 -0.31 4.30 -0.04 -1.26 -4.87 135.00 133.72 3cpw n PRO 21 Ca 0.01 0.85 0.20 0.00 -0.04 0.00 0.00 63.50 64.52 3cpw n PRO 21 Cb 0.54 -2.52 0.48 0.00 -0.04 0.00 0.00 33.50 31.97 3cpw n PRO 21 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 3cpw h ASN 22 N 2.94 0.48 0.07 3.54 2.35 -1.91 -1.37 115.58 121.69 3cpw h ASN 22 Ca -0.48 0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.34 3cpw h ASN 22 Cb 1.26 -0.01 0.00 0.00 0.05 0.00 0.00 38.32 39.62 3cpw h ASN 22 CO 0.65 0.13 0.00 0.00 -1.65 0.00 0.00 177.43 176.56 3cpw n HIS 23 N -4.61 0.00 -1.15 1.19 1.44 -1.26 -3.24 115.22 107.59 3cpw n HIS 23 Ca 0.23 0.00 0.05 0.00 -2.01 0.00 0.00 57.72 55.99 3cpw n HIS 23 Cb 0.79 -0.05 0.07 0.00 0.12 0.00 0.00 29.99 30.91 3cpw n HIS 23 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3cpw n LYS 24 N -1.05 1.08 -0.33 -1.40 5.02 -0.52 -4.35 118.16 116.61 3cpw n LYS 24 Ca 0.14 -1.77 0.04 0.00 -2.02 0.00 0.00 58.31 54.70 3cpw n LYS 24 Cb 0.09 -1.05 0.19 0.00 -0.02 0.00 0.00 35.03 34.24 3cpw n LYS 24 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3cpw h ARG 25 N 0.00 0.92 -0.48 1.97 3.08 -1.42 -2.51 114.38 115.94 3cpw h ARG 25 Ca 0.00 -0.06 0.10 0.00 0.07 0.00 0.00 59.98 60.09 3cpw h ARG 25 Cb 1.03 -0.21 -0.09 0.00 0.08 0.00 0.00 29.97 30.78 3cpw h ARG 25 CO 0.00 0.61 -0.14 0.00 -1.07 0.00 0.00 179.97 179.37 3cpw h ALA 26 N 1.48 0.28 0.35 0.04 0.00 -1.66 0.52 119.26 120.27 3cpw h ALA 26 Ca 0.44 0.19 -0.00 0.00 0.00 0.00 0.00 54.91 55.53 3cpw h ALA 26 Cb 0.36 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 3cpw h ALA 26 CO -0.23 -0.47 -0.29 -0.44 0.00 0.00 0.00 179.25 177.82 3cpw h ASP 27 N -0.03 -0.77 -0.68 0.00 3.45 -1.72 -1.86 116.42 114.81 3cpw h ASP 27 Ca 0.23 0.06 0.07 0.00 0.43 0.00 0.00 57.03 57.83 3cpw h ASP 27 Cb 0.38 0.25 -0.04 0.00 -0.56 0.00 0.00 39.33 39.36 3cpw h ASP 27 CO -0.51 -0.43 0.45 0.50 -1.57 0.00 0.00 179.24 177.68 3cpw h LYS 28 N -0.65 0.63 0.32 3.56 1.63 -1.32 -2.12 116.57 118.62 3cpw h LYS 28 Ca -0.03 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.72 3cpw h LYS 28 Cb 0.57 -0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.06 3cpw h LYS 28 CO -0.02 0.42 -0.15 0.00 -3.45 0.00 0.00 179.45 176.24 3cpw h ALA 29 N 1.64 -0.42 -0.16 5.00 0.00 -0.45 -0.10 119.26 124.76 3cpw h ALA 29 Ca 0.30 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.14 3cpw h ALA 29 Cb 0.33 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3cpw h ALA 29 CO -0.10 -0.70 0.32 1.98 0.00 0.00 0.00 179.25 180.75 3cpw h MET 30 N -0.49 0.00 0.10 0.00 1.85 -0.69 0.59 114.93 116.28 3cpw h MET 30 Ca -0.04 0.00 -0.20 0.00 -0.61 0.00 0.00 59.70 58.85 3cpw h MET 30 Cb 0.37 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.41 3cpw h MET 30 CO 0.07 0.00 -0.98 0.82 -0.40 0.00 0.00 176.91 176.42 3cpw h ILE 31 N 0.00 1.30 -0.80 1.77 2.04 -0.93 -3.15 117.51 117.74 3cpw h ILE 31 Ca 0.08 -2.42 0.08 0.00 1.00 0.00 0.00 64.86 63.59 3cpw h ILE 31 Cb 0.71 2.94 -0.07 0.00 -0.74 0.00 0.00 36.82 39.67 3cpw h ILE 31 CO -0.00 0.66 0.47 -0.07 0.00 0.00 0.00 178.15 179.21 3cpw h LEU 32 N -0.50 0.70 -0.55 1.44 3.38 0.86 -0.12 115.31 120.53 3cpw h LEU 32 Ca -0.21 0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.82 3cpw h LEU 32 Cb 1.57 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 42.18 3cpw h LEU 32 CO 0.06 0.43 0.34 0.40 0.09 0.00 0.00 178.44 179.76 3cpw h ILE 33 N 0.83 1.08 -0.35 1.22 2.04 -1.24 0.21 117.51 121.30 3cpw h ILE 33 Ca 0.37 -0.24 -0.11 0.00 1.00 0.00 0.00 64.86 65.89 3cpw h ILE 33 Cb 0.27 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3cpw h ILE 33 CO -0.21 0.13 -0.21 -0.09 0.00 0.00 0.00 178.15 177.76 3cpw h ARG 34 N 0.69 0.69 -0.03 2.37 2.43 -1.24 -2.22 114.38 117.06 3cpw h ARG 34 Ca 0.22 -0.26 -0.17 0.00 -0.81 0.00 0.00 59.98 58.95 3cpw h ARG 34 Cb -0.01 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 3cpw h ARG 34 CO -0.08 0.85 -0.73 0.93 -1.51 0.00 0.00 179.97 179.42 3cpw h GLU 35 N 0.60 0.21 0.08 0.20 5.08 -0.56 -2.20 114.58 118.00 3cpw h GLU 35 Ca 0.09 -0.18 -0.00 0.00 -1.00 0.00 0.00 59.36 58.26 3cpw h GLU 35 Cb 0.69 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.99 3cpw h GLU 35 CO 0.05 0.85 -0.04 1.25 -1.00 0.00 0.00 179.01 180.13 3cpw h HIS 36 N 0.14 -0.09 -0.62 4.33 2.76 -0.40 -2.40 115.15 118.86 3cpw h HIS 36 Ca -0.02 -0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.13 3cpw h HIS 36 Cb 1.30 0.03 -0.03 0.00 1.55 0.00 0.00 27.41 30.26 3cpw h HIS 36 CO 0.02 0.22 0.32 -0.07 -1.30 0.00 0.00 177.93 177.13 3cpw h LEU 37 N -0.41 0.79 -1.26 0.26 3.38 -1.45 -0.48 115.31 116.13 3cpw h LEU 37 Ca -0.01 -0.11 0.08 0.00 0.09 0.00 0.00 57.88 57.93 3cpw h LEU 37 Cb 0.35 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 3cpw h LEU 37 CO 0.02 0.67 0.54 0.00 0.09 0.00 0.00 178.44 179.76 3cpw h ALA 38 N 1.15 1.64 0.02 1.53 0.00 -1.37 -0.29 119.26 121.94 3cpw h ALA 38 Ca 0.22 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3cpw h ALA 38 Cb 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.65 3cpw h ALA 38 CO -0.03 0.22 -0.01 -0.22 0.00 0.00 0.00 179.25 179.21 3cpw h LYS 39 N 0.86 -0.02 0.00 0.00 3.64 -0.89 -0.03 116.57 120.12 3cpw h LYS 39 Ca 0.37 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.75 3cpw h LYS 39 Cb 0.31 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3cpw h LYS 39 CO -0.14 0.59 0.00 0.72 -2.27 0.00 0.00 179.45 178.35 3cpw n HIS 40 N -4.70 0.00 -0.22 1.91 8.25 -0.24 -2.22 115.22 117.99 3cpw n HIS 40 Ca -0.07 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.41 3cpw n HIS 40 Cb 0.30 -0.40 0.03 0.00 1.12 0.00 0.00 29.99 31.04 3cpw n HIS 40 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3cpw n PHE 41 N -1.40 0.00 -3.66 4.41 3.01 -0.13 -5.03 117.46 114.66 3cpw n PHE 41 Ca 0.06 -0.58 -0.20 0.00 1.01 0.00 0.00 57.45 57.73 3cpw n PHE 41 Cb 0.16 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.56 3cpw n PHE 41 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 3cpw n SER 42 N -0.67 -5.37 -3.80 4.37 7.64 -0.94 -5.00 113.62 109.85 3cpw n SER 42 Ca 0.03 -0.81 -0.10 0.00 1.01 0.00 0.00 58.87 59.01 3cpw n SER 42 Cb 0.33 -2.31 -0.06 0.00 -1.01 0.00 0.00 64.21 61.16 3cpw n SER 42 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3cpw s VAL 43 N -2.98 0.08 0.25 0.44 1.01 -0.04 -4.98 120.40 114.18 3cpw s VAL 43 Ca 0.00 -1.00 -0.30 0.00 0.00 0.00 0.00 61.98 60.68 3cpw s VAL 43 Cb -0.00 -1.46 -0.09 0.00 0.00 0.00 0.00 36.38 34.83 3cpw s VAL 43 CO 0.87 -0.38 0.98 -1.81 0.00 0.00 0.00 175.10 174.76 3cpw s ASP 44 N -2.87 7.54 0.57 3.32 1.11 -1.26 -4.48 116.67 120.59 3cpw s ASP 44 Ca 0.08 2.03 0.27 0.00 0.18 0.00 0.00 52.55 55.11 3cpw s ASP 44 Cb 0.03 -2.61 1.53 0.00 1.07 0.00 0.00 42.92 42.94 3cpw s ASP 44 CO -0.07 0.07 2.04 -0.33 1.18 0.00 0.00 175.17 178.06 3cpw h GLU 45 N 4.01 0.00 0.00 8.23 5.08 -1.90 0.25 114.58 130.25 3cpw h GLU 45 Ca -0.46 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 57.82 3cpw h GLU 45 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 3cpw h GLU 45 CO 0.68 0.00 -0.38 -0.44 -1.00 0.00 0.00 179.01 177.86 3cpw h ASP 46 N 0.00 0.00 0.49 1.42 3.32 -1.96 -2.89 116.42 116.80 3cpw h ASP 46 Ca 0.14 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.19 3cpw h ASP 46 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.26 3cpw h ASP 46 CO -0.00 0.38 -0.22 0.00 -1.72 0.00 0.00 179.24 177.68 3cpw n ALA 47 N -2.45 2.95 -2.63 3.45 0.00 0.85 -4.83 120.51 117.85 3cpw n ALA 47 Ca -0.02 -0.28 -0.42 0.00 0.00 0.00 0.00 53.44 52.72 3cpw n ALA 47 Cb 0.42 -1.27 -0.04 0.00 0.00 0.00 0.00 19.45 18.56 3cpw n ALA 47 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3cpw s VAL 48 N -2.72 4.79 -0.17 0.00 1.01 -1.09 -2.75 120.40 119.47 3cpw s VAL 48 Ca 0.21 1.43 -0.06 0.00 0.00 0.00 0.00 61.98 63.55 3cpw s VAL 48 Cb 0.19 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.38 3cpw s VAL 48 CO 0.55 -0.18 0.04 -0.60 0.00 0.00 0.00 175.10 174.92 3cpw s ARG 49 N 2.96 3.85 -0.26 2.72 3.52 0.25 -4.98 118.95 127.01 3cpw s ARG 49 Ca 0.35 -0.37 -0.05 0.00 -0.13 0.00 0.00 55.73 55.53 3cpw s ARG 49 Cb -0.15 -3.14 0.01 0.00 -1.56 0.00 0.00 34.95 30.11 3cpw s ARG 49 CO 0.10 0.32 0.01 -0.51 -0.81 0.00 0.00 175.30 174.41 3cpw s LEU 50 N 0.23 3.43 0.34 -0.88 1.43 -1.26 -0.87 118.68 121.09 3cpw s LEU 50 Ca 0.03 -0.66 -0.29 0.00 -1.03 0.00 0.00 54.13 52.19 3cpw s LEU 50 Cb -0.13 -1.79 -0.11 0.00 0.03 0.00 0.00 46.19 44.20 3cpw s LEU 50 CO 0.01 -0.13 1.46 -0.62 0.23 0.00 0.00 176.35 177.30 3cpw s ASP 51 N 1.45 6.47 0.56 2.29 -1.08 0.36 -4.83 116.67 121.90 3cpw s ASP 51 Ca 0.03 2.92 0.45 0.00 -0.52 0.00 0.00 52.55 55.43 3cpw s ASP 51 Cb -0.16 -2.65 1.62 0.00 -1.46 0.00 0.00 42.92 40.26 3cpw s ASP 51 CO -0.01 -0.79 1.60 -0.65 0.52 0.00 0.00 175.17 175.85 3cpw h PRO 52 N 3.55 0.00 -0.98 4.34 0.11 -1.98 0.27 132.00 137.31 3cpw h PRO 52 Ca -0.49 0.00 0.17 0.00 0.11 0.00 0.00 66.00 65.79 3cpw h PRO 52 Cb 1.23 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.24 3cpw h PRO 52 CO 0.68 0.00 0.58 0.66 -0.21 0.00 0.00 178.00 179.71 3cpw h SER 53 N 0.00 0.77 -0.26 -2.05 4.64 -1.93 0.26 113.55 114.98 3cpw h SER 53 Ca 0.80 0.09 -0.12 0.00 -0.47 0.00 0.00 61.79 62.09 3cpw h SER 53 Cb 3.33 -0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 65.35 3cpw h SER 53 CO -0.01 0.31 -0.26 0.40 -0.87 0.00 0.00 176.83 176.40 3cpw h ILE 54 N 0.78 1.27 0.18 0.95 2.04 -0.80 -1.86 117.51 120.08 3cpw h ILE 54 Ca 0.54 -1.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.02 3cpw h ILE 54 Cb 0.78 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.13 3cpw h ILE 54 CO -0.36 0.46 -0.09 -1.13 0.00 0.00 0.00 178.15 177.03 3cpw h ASN 55 N 0.65 -0.21 0.27 1.72 -1.24 -0.64 -2.07 115.58 114.06 3cpw h ASN 55 Ca 0.08 -0.11 -0.03 0.00 0.71 0.00 0.00 56.30 56.96 3cpw h ASN 55 Cb 0.77 0.05 -0.00 0.00 0.73 0.00 0.00 38.32 39.87 3cpw h ASN 55 CO 0.06 -0.02 -0.14 -0.33 -1.29 0.00 0.00 177.43 175.72 3cpw h GLU 56 N -0.39 0.00 -0.06 6.67 5.08 -0.95 -1.59 114.58 123.33 3cpw h GLU 56 Ca -0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 3cpw h GLU 56 Cb 0.30 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 3cpw h GLU 56 CO 0.04 0.14 -0.04 0.00 -1.00 0.00 0.00 179.01 178.15 3cpw h ALA 57 N 1.86 0.09 0.00 3.43 0.00 -1.01 -2.20 119.26 121.43 3cpw h ALA 57 Ca -0.00 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.58 3cpw h ALA 57 Cb 0.31 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 3cpw h ALA 57 CO 0.02 -0.15 -0.41 0.00 0.00 0.00 0.00 179.25 178.70 3cpw h ALA 58 N 0.61 1.14 -0.55 0.00 0.00 -0.98 -2.97 119.26 116.51 3cpw h ALA 58 Ca 0.01 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3cpw h ALA 58 Cb 0.49 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3cpw h ALA 58 CO 0.01 0.52 0.00 0.91 0.00 0.00 0.00 179.25 180.69 3cpw n TRP 59 N -3.79 0.73 -0.27 0.00 7.02 -0.64 -4.60 117.44 115.90 3cpw n TRP 59 Ca -0.01 -0.37 -0.01 0.00 -1.02 0.00 0.00 57.50 56.09 3cpw n TRP 59 Cb 0.48 0.00 0.05 0.00 -2.42 0.00 0.00 31.31 29.42 3cpw n TRP 59 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3cpw h ALA 60 N 4.22 0.21 -0.97 6.99 0.00 -1.22 -1.03 119.26 127.46 3cpw h ALA 60 Ca 0.00 0.25 -0.56 0.00 0.00 0.00 0.00 54.91 54.59 3cpw h ALA 60 Cb 0.85 0.77 -0.30 0.00 0.00 0.00 0.00 17.79 19.11 3cpw h ALA 60 CO 0.00 -0.56 0.69 0.54 0.00 0.00 0.00 179.25 179.91 3cpw n ARG 61 N -5.48 2.40 0.00 0.00 1.74 -1.26 -5.04 116.66 109.02 3cpw n ARG 61 Ca 0.08 -3.13 0.00 0.00 -0.77 0.00 0.00 57.85 54.04 3cpw n ARG 61 Cb 0.39 -2.20 0.00 0.00 -1.02 0.00 0.00 32.46 29.62 3cpw n ARG 61 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3cpw n GLY 62 N -1.07 -2.56 0.00 -0.13 0.00 -0.39 -3.93 105.19 97.11 3cpw n GLY 62 Ca 0.60 -1.87 0.13 0.00 0.00 0.00 0.00 46.02 44.88 3cpw n GLY 62 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3cpw n ARG 63 N -0.14 0.01 -0.00 1.61 0.63 -1.26 -4.07 116.66 113.44 3cpw n ARG 63 Ca 0.00 0.01 0.05 0.00 -0.92 0.00 0.00 57.85 56.99 3cpw n ARG 63 Cb 0.00 -1.51 -0.08 0.00 0.45 0.00 0.00 32.46 31.32 3cpw n ARG 63 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3cpw n ALA 64 N -1.51 2.47 -3.67 5.13 0.00 -1.26 -1.86 120.51 119.81 3cpw n ALA 64 Ca 0.06 -0.25 -0.36 0.00 0.00 0.00 0.00 53.44 52.89 3cpw n ALA 64 Cb 0.34 -0.36 -0.08 0.00 0.00 0.00 0.00 19.45 19.36 3cpw n ALA 64 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 3cpw s ASN 65 N -3.08 5.66 0.13 0.00 0.01 -1.25 -4.70 114.94 111.70 3cpw s ASN 65 Ca -0.03 -3.38 -0.05 0.00 -0.71 0.00 0.00 52.86 48.69 3cpw s ASN 65 Cb 0.07 -1.88 -0.05 0.00 0.41 0.00 0.00 41.25 39.79 3cpw s ASN 65 CO 0.43 -0.26 0.36 -0.89 -1.51 0.00 0.00 177.10 175.24 3cpw s THR 66 N -0.83 5.18 0.35 1.60 2.01 -1.26 -4.02 115.64 118.66 3cpw s THR 66 Ca 0.23 0.04 -0.27 0.00 0.31 0.00 0.00 61.69 62.00 3cpw s THR 66 Cb -0.12 -3.62 -0.09 0.00 0.01 0.00 0.00 72.50 68.67 3cpw s THR 66 CO -0.09 0.07 1.22 -2.16 -0.69 0.00 0.00 174.62 172.97 3cpw s PRO 67 N -2.57 4.28 0.50 4.92 0.04 -1.26 -4.94 135.00 135.97 3cpw s PRO 67 Ca 0.40 2.00 0.24 0.00 0.04 0.00 0.00 61.00 63.68 3cpw s PRO 67 Cb -0.12 -2.94 1.32 0.00 0.04 0.00 0.00 34.50 32.80 3cpw s PRO 67 CO 0.24 -0.17 2.04 0.66 0.04 0.00 0.00 177.00 179.81 3cpw h SER 68 N 3.17 0.00 -5.77 6.66 4.64 -1.96 -3.43 113.55 116.86 3cpw h SER 68 Ca -0.48 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.44 3cpw h SER 68 Cb 1.23 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.19 3cpw h SER 68 CO 0.64 0.15 -0.45 -0.54 -0.87 0.00 0.00 176.83 175.76 3cpw s LYS 69 N -4.27 1.69 -0.29 4.77 1.02 -1.26 -0.30 119.74 121.10 3cpw s LYS 69 Ca -0.03 -1.90 -0.15 0.00 0.02 0.00 0.00 55.97 53.92 3cpw s LYS 69 Cb 0.14 0.34 0.14 0.00 -0.52 0.00 0.00 37.83 37.93 3cpw s LYS 69 CO 0.61 -0.63 0.89 -1.50 -0.92 0.00 0.00 175.35 173.80 3cpw s ILE 70 N -3.50 -0.38 -0.21 2.17 2.07 -0.93 -4.91 121.20 115.51 3cpw s ILE 70 Ca 0.38 0.00 -0.25 0.00 -1.41 0.00 0.00 60.65 59.37 3cpw s ILE 70 Cb 0.03 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.61 3cpw s ILE 70 CO 0.24 0.00 0.84 -0.13 -1.91 0.00 0.00 174.94 173.97 3cpw s ARG 71 N 2.10 4.24 -0.02 3.50 0.52 -1.26 -1.17 118.95 126.86 3cpw s ARG 71 Ca -0.06 0.99 0.05 0.00 -0.52 0.00 0.00 55.73 56.20 3cpw s ARG 71 Cb -0.06 -3.61 -0.01 0.00 0.52 0.00 0.00 34.95 31.78 3cpw s ARG 71 CO -0.17 -0.43 -0.19 0.54 0.02 0.00 0.00 175.30 175.07 3cpw s VAL 72 N 2.54 1.48 -0.31 3.52 0.11 0.99 -3.74 120.40 124.98 3cpw s VAL 72 Ca 0.37 -0.79 -0.09 0.00 -2.93 0.00 0.00 61.98 58.54 3cpw s VAL 72 Cb -0.16 -1.24 -0.00 0.00 -1.53 0.00 0.00 36.38 33.45 3cpw s VAL 72 CO 0.10 0.42 0.15 -0.60 -3.33 0.00 0.00 175.10 171.83 3cpw s ARG 73 N -0.34 3.28 0.06 1.54 3.52 0.01 -0.43 118.95 126.60 3cpw s ARG 73 Ca 0.05 -0.75 0.08 0.00 -0.13 0.00 0.00 55.73 54.97 3cpw s ARG 73 Cb -0.08 -3.55 -0.03 0.00 -1.56 0.00 0.00 34.95 29.73 3cpw s ARG 73 CO -0.00 -0.43 -0.21 0.00 -0.81 0.00 0.00 175.30 173.85 3cpw s ALA 74 N 1.60 1.80 -0.02 6.12 0.00 -0.77 -1.58 121.76 128.89 3cpw s ALA 74 Ca 0.04 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 50.94 3cpw s ALA 74 Cb -0.17 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 3cpw s ALA 74 CO 0.06 0.39 -0.23 0.00 0.00 0.00 0.00 175.76 175.98 3cpw s ALA 75 N -0.92 1.94 -0.05 0.00 0.00 -0.33 -1.63 121.76 120.77 3cpw s ALA 75 Ca 0.07 -0.99 0.03 0.00 0.00 0.00 0.00 51.96 51.07 3cpw s ALA 75 Cb -0.09 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.49 3cpw s ALA 75 CO 0.03 0.46 -0.13 0.50 0.00 0.00 0.00 175.76 176.62 3cpw s ARG 76 N -0.48 2.53 0.00 0.00 3.52 -1.26 -1.36 118.95 121.90 3cpw s ARG 76 Ca 0.07 -0.68 0.00 0.00 -0.13 0.00 0.00 55.73 54.99 3cpw s ARG 76 Cb -0.10 -2.41 0.00 0.00 -1.56 0.00 0.00 34.95 30.88 3cpw s ARG 76 CO -0.00 0.63 0.00 1.97 -0.81 0.00 0.00 175.30 177.09 3cpw n PHE 77 N 2.26 0.00 -0.50 5.12 1.16 -0.58 -4.74 117.46 120.18 3cpw n PHE 77 Ca -0.17 0.00 0.07 0.00 -1.87 0.00 0.00 57.45 55.47 3cpw n PHE 77 Cb 0.52 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.37 3cpw n PHE 77 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 3cpw n GLU 78 N 0.00 -1.05 0.09 3.97 2.13 -1.26 -1.79 120.64 122.73 3cpw n GLU 78 Ca 0.00 0.74 0.12 0.00 0.66 0.00 0.00 57.16 58.68 3cpw n GLU 78 Cb 0.00 -1.27 0.45 0.00 0.27 0.00 0.00 31.44 30.89 3cpw n GLU 78 CO 0.00 0.00 0.00 -0.85 -0.41 0.00 0.00 177.13 175.87 3cpw n GLU 79 N -2.59 0.17 0.00 5.31 -0.00 -1.26 -3.25 120.64 119.02 3cpw n GLU 79 Ca -0.00 0.29 0.02 0.00 -0.00 0.00 0.00 57.16 57.46 3cpw n GLU 79 Cb 0.23 -1.76 -0.01 0.00 -0.00 0.00 0.00 31.44 29.90 3cpw n GLU 79 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 3cpw n GLU 80 N -2.07 3.58 -0.19 3.44 2.13 -1.26 -5.10 120.64 121.17 3cpw n GLU 80 Ca 0.04 -0.26 0.00 0.00 0.66 0.00 0.00 57.16 57.60 3cpw n GLU 80 Cb 0.30 -0.81 0.00 0.00 0.27 0.00 0.00 31.44 31.20 3cpw n GLU 80 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cpw n GLY 81 N 0.76 -2.96 3.68 8.31 0.00 -1.20 -4.99 105.19 108.78 3cpw n GLY 81 Ca 0.01 -0.93 -0.02 0.00 0.00 0.00 0.00 46.02 45.08 3cpw n GLY 81 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3cpw s GLU 82 N -3.63 0.83 -0.00 1.61 -1.05 -0.74 -4.84 118.70 110.88 3cpw s GLU 82 Ca 0.00 -0.44 0.02 0.00 -0.15 0.00 0.00 54.97 54.39 3cpw s GLU 82 Cb 0.00 0.29 -0.00 0.00 -0.44 0.00 0.00 34.13 33.98 3cpw s GLU 82 CO 0.00 -0.38 -0.05 0.00 0.95 0.00 0.00 175.26 175.78 3cpw s ALA 83 N -2.90 0.43 -0.12 -0.84 0.00 -1.11 -1.53 121.76 115.68 3cpw s ALA 83 Ca 0.12 -0.22 0.03 0.00 0.00 0.00 0.00 51.96 51.89 3cpw s ALA 83 Cb 0.01 -0.11 0.00 0.00 0.00 0.00 0.00 23.12 23.02 3cpw s ALA 83 CO -0.01 0.10 -0.21 0.42 0.00 0.00 0.00 175.76 176.06 3cpw s ILE 84 N -0.13 2.23 0.18 0.00 1.01 -0.47 -0.58 121.20 123.44 3cpw s ILE 84 Ca 0.02 -0.94 0.08 0.00 0.00 0.00 0.00 60.65 59.81 3cpw s ILE 84 Cb -0.02 -1.88 -0.04 0.00 0.01 0.00 0.00 42.46 40.52 3cpw s ILE 84 CO -0.00 0.55 -0.17 -0.69 0.00 0.00 0.00 174.94 174.63 3cpw s VAL 85 N 0.56 1.78 0.24 2.92 1.01 -0.05 -1.19 120.40 125.67 3cpw s VAL 85 Ca -0.12 -2.03 -0.19 0.00 0.00 0.00 0.00 61.98 59.64 3cpw s VAL 85 Cb -0.17 -1.91 0.03 0.00 0.00 0.00 0.00 36.38 34.33 3cpw s VAL 85 CO 0.04 -0.43 0.62 -1.83 0.00 0.00 0.00 175.10 173.49 3cpw s GLU 86 N -3.12 1.57 1.16 2.72 -1.05 -0.62 -0.48 118.70 118.88 3cpw s GLU 86 Ca 0.18 -0.92 -0.19 0.00 -0.15 0.00 0.00 54.97 53.89 3cpw s GLU 86 Cb -0.04 0.56 0.30 0.00 -0.44 0.00 0.00 34.13 34.52 3cpw s GLU 86 CO 0.07 -0.70 0.72 0.00 0.95 0.00 0.00 175.26 176.30 3cpw n ALA 87 N -0.41 -4.04 -1.29 -0.84 0.00 -1.26 -0.81 120.51 111.86 3cpw n ALA 87 Ca -0.07 -1.25 0.00 0.00 0.00 0.00 0.00 53.44 52.12 3cpw n ALA 87 Cb 0.61 -0.11 0.00 0.00 0.00 0.00 0.00 19.45 19.95 3cpw n ALA 87 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89