#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pfm n SER 4 N 0.00 -6.41 -4.57 7.83 2.88 -1.26 -5.03 113.62 107.06 1pfm n SER 4 Ca 0.00 -0.44 -0.24 0.00 -1.33 0.00 0.00 58.87 56.86 1pfm n SER 4 Cb 0.00 -4.69 -0.09 0.00 -0.75 0.00 0.00 64.21 58.69 1pfm n SER 4 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1pfm s ALA 5 N -3.23 2.98 0.41 -1.46 0.00 -1.26 -4.97 121.76 114.23 1pfm s ALA 5 Ca 0.28 -1.70 0.00 0.00 0.00 0.00 0.00 51.96 50.54 1pfm s ALA 5 Cb -0.04 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.50 1pfm s ALA 5 CO 0.65 0.30 0.00 1.17 0.00 0.00 0.00 175.76 177.89 1pfm n LYS 6 N -0.63 -2.96 -3.56 0.00 4.81 -1.26 -4.83 118.16 109.73 1pfm n LYS 6 Ca -0.07 2.28 -0.21 0.00 -0.87 0.00 0.00 58.31 59.44 1pfm n LYS 6 Cb 0.59 -2.83 0.05 0.00 0.02 0.00 0.00 35.03 32.86 1pfm n LYS 6 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 1pfm n GLU 7 N -2.15 -3.84 -0.04 1.64 1.02 -1.26 -4.93 120.64 111.08 1pfm n GLU 7 Ca 0.00 0.67 -0.09 0.00 -0.02 0.00 0.00 57.16 57.72 1pfm n GLU 7 Cb 0.31 -5.21 -0.03 0.00 -0.02 0.00 0.00 31.44 26.49 1pfm n GLU 7 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1pfm n LEU 8 N -4.01 1.28 0.00 -4.62 0.00 -1.26 -5.06 117.00 103.34 1pfm n LEU 8 Ca -0.21 0.21 0.00 0.00 0.00 0.00 0.00 56.01 56.01 1pfm n LEU 8 Cb 0.65 -0.48 0.00 0.00 0.00 0.00 0.00 43.42 43.59 1pfm n LEU 8 CO 0.65 -0.16 0.00 0.54 0.00 0.00 0.00 177.39 178.43 1pfm n ARG 9 N -3.82 0.00 -3.85 1.96 1.74 0.31 -4.96 116.66 108.04 1pfm n ARG 9 Ca -0.16 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.56 1pfm n ARG 9 Cb 0.45 0.00 -0.13 0.00 -1.02 0.00 0.00 32.46 31.76 1pfm n ARG 9 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pfm h GLN 11 N 8.15 0.00 -2.05 0.00 4.20 -2.00 -2.37 115.11 121.03 1pfm h GLN 11 Ca -0.35 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 57.85 1pfm h GLN 11 Cb 1.13 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.51 1pfm h GLN 11 CO 0.59 0.00 -1.08 0.00 -0.67 0.00 0.00 178.83 177.67 1pfm h VAL 13 N 1.56 0.95 -2.47 0.00 3.04 -1.82 -3.43 116.25 114.07 1pfm h VAL 13 Ca 0.10 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.59 1pfm h VAL 13 Cb 0.88 0.30 0.00 0.00 -2.01 0.00 0.00 31.29 30.45 1pfm h VAL 13 CO 0.55 0.11 0.00 0.29 -1.01 0.00 0.00 177.57 177.51 1pfm n LYS 14 N -4.84 1.59 -4.90 4.17 5.02 -1.26 -5.08 118.16 112.86 1pfm n LYS 14 Ca 0.07 0.00 -0.31 0.00 -2.02 0.00 0.00 58.31 56.05 1pfm n LYS 14 Cb 0.17 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 35.01 1pfm n LYS 14 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1pfm s THR 15 N 0.78 1.89 -1.20 -0.18 2.01 -1.26 -4.92 115.64 112.76 1pfm s THR 15 Ca 0.00 -0.90 -0.05 0.00 0.31 0.00 0.00 61.69 61.05 1pfm s THR 15 Cb 0.00 -1.66 0.13 0.00 0.01 0.00 0.00 72.50 70.98 1pfm s THR 15 CO 0.00 0.52 2.37 0.41 -0.69 0.00 0.00 174.62 177.23 1pfm n THR 16 N 3.80 5.12 0.37 -0.82 -1.04 0.07 -4.65 114.28 117.13 1pfm n THR 16 Ca -0.20 -4.34 0.10 0.00 -2.04 0.00 0.00 64.05 57.57 1pfm n THR 16 Cb 0.52 -1.97 0.44 0.00 -1.82 0.00 0.00 70.33 67.50 1pfm n THR 16 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1pfm n SER 17 N 1.45 0.47 0.18 8.00 3.41 -1.25 -2.81 113.62 123.06 1pfm n SER 17 Ca 0.60 0.63 0.18 0.00 -0.26 0.00 0.00 58.87 60.02 1pfm n SER 17 Cb 0.28 -0.73 0.76 0.00 -0.26 0.00 0.00 64.21 64.26 1pfm n SER 17 CO 0.00 0.00 0.00 1.56 -0.16 0.00 0.00 175.04 176.44 1pfm h GLN 18 N 0.00 0.00 -7.11 4.33 4.20 -1.91 -3.41 115.11 111.20 1pfm h GLN 18 Ca 0.00 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.15 1pfm h GLN 18 Cb 0.28 0.00 0.16 0.00 0.30 0.00 0.00 27.48 28.22 1pfm h GLN 18 CO 0.00 0.00 0.49 1.55 -0.67 0.00 0.00 178.83 180.20 1pfm n VAL 19 N -3.39 4.68 -3.99 -0.54 3.14 -1.12 -4.99 118.33 112.12 1pfm n VAL 19 Ca 0.04 -0.47 -0.35 0.00 -2.96 0.00 0.00 64.34 60.60 1pfm n VAL 19 Cb 0.54 -1.46 -0.11 0.00 -1.06 0.00 0.00 33.84 31.75 1pfm n VAL 19 CO 0.00 0.00 0.00 -0.60 -6.46 0.00 0.00 176.83 169.77 1pfm s ARG 20 N -3.44 3.85 -0.41 1.45 3.52 -1.26 -5.06 118.95 117.59 1pfm s ARG 20 Ca 0.82 -0.40 -0.29 0.00 -0.13 0.00 0.00 55.73 55.73 1pfm s ARG 20 Cb -0.37 -3.21 0.02 0.00 -1.56 0.00 0.00 34.95 29.83 1pfm s ARG 20 CO 0.41 0.14 1.13 -1.25 -0.81 0.00 0.00 175.30 174.92 1pfm s PRO 21 N 0.72 3.85 0.00 5.12 0.04 -1.26 -4.38 135.00 139.10 1pfm s PRO 21 Ca 0.03 0.79 0.00 0.00 0.04 0.00 0.00 61.00 61.86 1pfm s PRO 21 Cb -0.13 -3.85 0.00 0.00 0.04 0.00 0.00 34.50 30.56 1pfm s PRO 21 CO 0.02 -1.20 0.00 -2.13 0.04 0.00 0.00 177.00 173.73 1pfm n ARG 22 N 7.47 0.00 -1.02 4.56 0.63 -1.26 -4.94 116.66 122.10 1pfm n ARG 22 Ca 0.12 0.00 -0.11 0.00 -0.92 0.00 0.00 57.85 56.94 1pfm n ARG 22 Cb 0.48 0.00 0.24 0.00 0.45 0.00 0.00 32.46 33.63 1pfm n ARG 22 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 1pfm n HIS 23 N 0.00 2.33 -0.73 -0.14 -0.00 -1.26 -5.00 115.22 110.41 1pfm n HIS 23 Ca 0.00 -1.49 -0.29 0.00 -0.00 0.00 0.00 57.72 55.94 1pfm n HIS 23 Cb 0.00 -0.72 0.25 0.00 -0.00 0.00 0.00 29.99 29.52 1pfm n HIS 23 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.34 174.84 1pfm s ILE 24 N -3.14 1.63 0.00 1.59 2.07 -1.26 -0.10 121.20 121.99 1pfm s ILE 24 Ca 0.53 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.77 1pfm s ILE 24 Cb 0.44 -2.25 0.00 0.00 0.13 0.00 0.00 42.46 40.78 1pfm s ILE 24 CO 0.10 0.00 0.00 1.07 -1.91 0.00 0.00 174.94 174.20 1pfm n THR 25 N -5.01 0.00 -3.54 4.00 5.66 -0.76 -4.28 114.28 110.35 1pfm n THR 25 Ca 0.09 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 61.01 1pfm n THR 25 Cb 0.58 -0.27 -0.03 0.00 -1.55 0.00 0.00 70.33 69.06 1pfm n THR 25 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1pfm s SER 26 N -3.96 -0.34 0.00 1.09 0.01 -1.17 -5.04 113.70 104.30 1pfm s SER 26 Ca 0.00 0.11 -0.07 0.00 1.31 0.00 0.00 55.95 57.30 1pfm s SER 26 Cb 0.00 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.56 1pfm s SER 26 CO 0.00 -0.49 0.14 -1.48 0.41 0.00 0.00 173.24 171.81 1pfm s LEU 27 N -2.06 1.55 0.34 2.44 0.05 -1.26 0.69 118.68 120.42 1pfm s LEU 27 Ca 0.04 -0.19 -0.04 0.00 0.05 0.00 0.00 54.13 53.98 1pfm s LEU 27 Cb -0.01 0.67 -0.05 0.00 -2.05 0.00 0.00 46.19 44.76 1pfm s LEU 27 CO -0.05 -0.36 0.60 -1.61 -0.55 0.00 0.00 176.35 174.38 1pfm s GLU 28 N -1.34 3.60 -0.28 1.48 2.02 0.67 -4.91 118.70 119.94 1pfm s GLU 28 Ca -0.14 0.01 -0.02 0.00 0.02 0.00 0.00 54.97 54.83 1pfm s GLU 28 Cb -0.07 -2.59 0.09 0.00 0.10 0.00 0.00 34.13 31.66 1pfm s GLU 28 CO 0.02 0.12 0.10 0.08 0.02 0.00 0.00 175.26 175.59 1pfm s VAL 29 N -2.25 0.48 -0.08 2.63 1.01 -1.26 -1.92 120.40 119.01 1pfm s VAL 29 Ca 0.44 -1.03 0.03 0.00 0.00 0.00 0.00 61.98 61.43 1pfm s VAL 29 Cb -0.10 -1.31 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1pfm s VAL 29 CO 0.33 -0.62 -0.16 -0.63 0.00 0.00 0.00 175.10 174.03 1pfm s ILE 30 N 1.83 2.87 0.00 2.22 1.09 -0.95 -5.02 121.20 123.25 1pfm s ILE 30 Ca 0.08 -0.77 0.00 0.00 -1.10 0.00 0.00 60.65 58.86 1pfm s ILE 30 Cb -0.17 -2.14 0.00 0.00 -1.06 0.00 0.00 42.46 39.09 1pfm s ILE 30 CO -0.26 0.57 0.00 1.17 -0.10 0.00 0.00 174.94 176.31 1pfm n LYS 31 N 2.81 0.56 -2.48 2.79 0.00 -1.26 -2.33 118.16 118.25 1pfm n LYS 31 Ca -0.17 0.00 -0.39 0.00 0.00 0.00 0.00 58.31 57.75 1pfm n LYS 31 Cb 0.52 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.52 1pfm n LYS 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1pfm s ALA 32 N -3.94 2.54 1.00 3.14 0.00 -1.23 -4.12 121.76 119.15 1pfm s ALA 32 Ca 0.00 -2.12 0.00 0.00 0.00 0.00 0.00 51.96 49.84 1pfm s ALA 32 Cb 0.00 -4.53 0.00 0.00 0.00 0.00 0.00 23.12 18.59 1pfm s ALA 32 CO 0.00 -3.81 0.00 0.41 0.00 0.00 0.00 175.76 172.36 1pfm n GLY 33 N 6.86 -1.04 0.01 0.00 0.00 0.47 -4.65 105.19 106.84 1pfm n GLY 33 Ca 0.34 -1.52 -0.00 0.00 0.00 0.00 0.00 46.02 44.83 1pfm n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pfm h PRO 34 N 0.00 -0.02 -0.92 1.61 0.13 -1.96 -2.74 132.00 128.10 1pfm h PRO 34 Ca 0.00 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 65.31 1pfm h PRO 34 Cb 0.00 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 31.06 1pfm h PRO 34 CO 0.00 -0.01 0.59 1.12 -0.23 0.00 0.00 178.00 179.47 1pfm h HIS 35 N -0.13 0.76 -3.33 1.56 2.07 -1.94 -3.11 115.15 111.03 1pfm h HIS 35 Ca -0.00 0.02 -0.66 0.00 -2.85 0.00 0.00 60.37 56.88 1pfm h HIS 35 Cb 0.02 -0.23 -0.39 0.00 2.57 0.00 0.00 27.41 29.37 1pfm h HIS 35 CO 0.02 0.22 -0.47 0.00 -3.07 0.00 0.00 177.93 174.63 1pfm n PRO 37 N 2.75 0.16 -2.97 0.00 -0.04 -1.03 0.18 135.00 134.05 1pfm n PRO 37 Ca 0.12 0.37 -0.23 0.00 -0.04 0.00 0.00 63.50 63.73 1pfm n PRO 37 Cb 0.35 -1.80 0.01 0.00 -0.04 0.00 0.00 33.50 32.02 1pfm n PRO 37 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1pfm s THR 38 N -3.24 3.87 0.09 0.52 -1.32 -1.26 -4.59 115.64 109.71 1pfm s THR 38 Ca 0.05 -0.54 -0.31 0.00 -1.21 0.00 0.00 61.69 59.69 1pfm s THR 38 Cb 0.10 -3.43 -0.06 0.00 -1.51 0.00 0.00 72.50 67.60 1pfm s THR 38 CO 0.39 -0.29 1.21 0.00 -2.21 0.00 0.00 174.62 173.71 1pfm s ALA 39 N -2.56 3.41 -0.02 11.08 0.00 -1.26 -3.57 121.76 128.85 1pfm s ALA 39 Ca 0.49 0.89 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1pfm s ALA 39 Cb -0.10 -3.44 0.03 0.00 0.00 0.00 0.00 23.12 19.60 1pfm s ALA 39 CO 0.38 -0.43 0.03 1.14 0.00 0.00 0.00 175.76 176.88 1pfm s GLN 40 N 0.79 -0.04 -0.01 0.00 0.00 -0.98 -4.87 119.66 114.56 1pfm s GLN 40 Ca 0.58 0.17 0.06 0.00 -0.00 0.00 0.00 55.36 56.18 1pfm s GLN 40 Cb -0.31 -0.23 -0.03 0.00 0.00 0.00 0.00 33.01 32.45 1pfm s GLN 40 CO 0.31 -0.16 -0.20 -1.17 0.00 0.00 0.00 175.29 174.07 1pfm s LEU 41 N 0.99 2.45 0.39 2.60 2.96 -1.21 -2.23 118.68 124.62 1pfm s LEU 41 Ca -0.08 -0.37 0.08 0.00 -0.22 0.00 0.00 54.13 53.53 1pfm s LEU 41 Cb -0.12 -1.46 -0.07 0.00 0.50 0.00 0.00 46.19 45.04 1pfm s LEU 41 CO -0.03 0.31 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.66 1pfm s ILE 42 N -0.76 2.09 0.35 6.68 -1.09 -0.81 -2.13 121.20 125.54 1pfm s ILE 42 Ca 0.12 -2.06 0.02 0.00 -2.23 0.00 0.00 60.65 56.49 1pfm s ILE 42 Cb -0.10 -2.88 -0.01 0.00 -1.58 0.00 0.00 42.46 37.89 1pfm s ILE 42 CO 0.01 -0.07 0.42 0.00 -1.23 0.00 0.00 174.94 174.08 1pfm s ALA 43 N -2.67 1.21 -0.06 9.38 0.00 -0.79 -0.24 121.76 128.59 1pfm s ALA 43 Ca 0.34 -1.76 -0.06 0.00 0.00 0.00 0.00 51.96 50.49 1pfm s ALA 43 Cb 0.07 1.27 0.02 0.00 0.00 0.00 0.00 23.12 24.48 1pfm s ALA 43 CO 0.18 -0.75 0.16 0.99 0.00 0.00 0.00 175.76 176.34 1pfm s THR 44 N -3.07 -0.00 0.16 0.00 2.01 0.22 -3.04 115.64 111.92 1pfm s THR 44 Ca 0.34 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.38 1pfm s THR 44 Cb 0.00 -0.24 0.02 0.00 0.01 0.00 0.00 72.50 72.30 1pfm s THR 44 CO 0.24 0.00 0.20 0.18 -0.69 0.00 0.00 174.62 174.56 1pfm n LEU 45 N 3.06 0.00 0.08 4.42 4.77 -1.14 -1.83 117.00 126.37 1pfm n LEU 45 Ca -0.13 -0.73 -0.06 0.00 -0.03 0.00 0.00 56.01 55.05 1pfm n LEU 45 Cb 0.59 -0.10 0.07 0.00 -2.33 0.00 0.00 43.42 41.65 1pfm n LEU 45 CO 0.21 -0.51 0.38 0.07 -1.33 0.00 0.00 177.39 176.21 1pfm h LYS 46 N 0.00 0.22 -5.41 3.23 5.09 -0.69 -3.30 116.57 115.72 1pfm h LYS 46 Ca -0.08 -0.18 -0.66 0.00 0.09 0.00 0.00 60.65 59.82 1pfm h LYS 46 Cb 0.36 0.04 -0.15 0.00 0.10 0.00 0.00 32.23 32.58 1pfm h LYS 46 CO 0.12 0.84 1.04 -0.80 -2.09 0.00 0.00 179.45 178.56 1pfm s ASN 47 N -6.91 6.56 -0.02 7.07 -0.87 -1.26 -4.84 114.94 114.68 1pfm s ASN 47 Ca -0.03 -1.79 -0.00 0.00 -1.57 0.00 0.00 52.86 49.46 1pfm s ASN 47 Cb 0.11 -2.46 -0.01 0.00 -0.02 0.00 0.00 41.25 38.88 1pfm s ASN 47 CO 0.81 -1.23 0.57 0.61 -2.57 0.00 0.00 177.10 175.29 1pfm n GLY 48 N 5.94 -0.01 1.86 0.66 0.00 -1.24 -4.74 105.19 107.66 1pfm n GLY 48 Ca 0.26 -0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.15 1pfm n GLY 48 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1pfm n ARG 49 N 2.49 0.44 -3.69 1.61 1.85 -1.26 -4.96 116.66 113.14 1pfm n ARG 49 Ca 0.01 -1.92 -0.10 0.00 -1.00 0.00 0.00 57.85 54.84 1pfm n ARG 49 Cb 0.27 1.35 -0.11 0.00 -1.05 0.00 0.00 32.46 32.92 1pfm n ARG 49 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1pfm s LYS 50 N -2.82 0.38 0.00 2.89 3.01 -1.26 -2.86 119.74 119.07 1pfm s LYS 50 Ca 0.18 0.79 0.00 0.00 -1.01 0.00 0.00 55.97 55.93 1pfm s LYS 50 Cb 0.01 -0.01 0.00 0.00 -1.01 0.00 0.00 37.83 36.81 1pfm s LYS 50 CO 0.13 -0.16 0.00 0.44 0.51 0.00 0.00 175.35 176.26 1pfm n ILE 51 N 4.33 0.00 -3.61 2.17 -6.64 -1.17 -4.91 119.36 109.52 1pfm n ILE 51 Ca -0.23 0.00 -0.11 0.00 -1.77 0.00 0.00 62.75 60.64 1pfm n ILE 51 Cb 0.55 -0.01 -0.06 0.00 -1.44 0.00 0.00 39.64 38.67 1pfm n ILE 51 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1pfm s LEU 53 N -0.21 2.02 0.67 0.00 1.43 -0.90 -0.75 118.68 120.94 1pfm s LEU 53 Ca 0.00 -1.69 0.05 0.00 -1.03 0.00 0.00 54.13 51.46 1pfm s LEU 53 Cb -0.03 -0.16 0.12 0.00 0.03 0.00 0.00 46.19 46.15 1pfm s LEU 53 CO -0.02 -0.94 0.92 -0.62 0.23 0.00 0.00 176.35 175.92 1pfm s ASP 54 N -3.64 4.62 0.00 2.29 2.15 -1.26 -3.35 116.67 117.48 1pfm s ASP 54 Ca 0.21 -0.70 0.00 0.00 0.43 0.00 0.00 52.55 52.49 1pfm s ASP 54 Cb 0.02 0.32 0.00 0.00 -0.30 0.00 0.00 42.92 42.96 1pfm s ASP 54 CO 0.13 -1.69 0.00 -0.11 -0.17 0.00 0.00 175.17 173.33 1pfm n LEU 55 N -2.59 0.00 -1.61 -1.34 0.00 -1.26 -4.57 117.00 105.64 1pfm n LEU 55 Ca 0.17 -0.11 0.01 0.00 0.00 0.00 0.00 56.01 56.08 1pfm n LEU 55 Cb 0.61 0.00 0.27 0.00 0.00 0.00 0.00 43.42 44.31 1pfm n LEU 55 CO 0.41 0.00 0.78 0.00 0.00 0.00 0.00 177.39 178.58 1pfm n GLN 56 N -1.09 3.57 -4.27 1.96 6.02 -1.26 -4.90 117.38 117.41 1pfm n GLN 56 Ca 0.00 -2.33 -0.16 0.00 -0.01 0.00 0.00 57.00 54.50 1pfm n GLN 56 Cb 0.00 -2.04 -0.10 0.00 1.02 0.00 0.00 30.24 29.12 1pfm n GLN 56 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1pfm s ALA 57 N -2.34 1.60 -1.70 -1.58 0.00 -1.26 -5.02 121.76 111.46 1pfm s ALA 57 Ca 0.41 -1.49 0.29 0.00 0.00 0.00 0.00 51.96 51.16 1pfm s ALA 57 Cb 0.32 -0.01 1.58 0.00 0.00 0.00 0.00 23.12 25.01 1pfm s ALA 57 CO 0.11 -0.02 2.03 -0.35 0.00 0.00 0.00 175.76 177.54 1pfm n PRO 58 N -0.10 0.65 0.20 0.00 -0.04 -1.26 -3.86 135.00 130.59 1pfm n PRO 58 Ca -0.11 0.01 -0.14 0.00 -0.04 0.00 0.00 63.50 63.23 1pfm n PRO 58 Cb 0.60 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.48 1pfm n PRO 58 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1pfm h LEU 59 N 0.00 -0.44 -1.45 1.53 5.85 -1.95 -2.52 115.31 116.33 1pfm h LEU 59 Ca 0.00 -0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.60 1pfm h LEU 59 Cb 0.14 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.29 1pfm h LEU 59 CO 0.00 -0.09 0.00 0.10 -0.34 0.00 0.00 178.44 178.11 1pfm h TYR 60 N -0.85 0.00 0.00 1.25 -0.00 -1.81 -1.53 116.97 114.04 1pfm h TYR 60 Ca -0.05 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.62 1pfm h TYR 60 Cb 0.54 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.26 1pfm h TYR 60 CO 0.02 0.00 -0.26 -0.22 -0.00 0.00 0.00 178.16 177.70 1pfm h LYS 61 N 0.00 0.00 0.00 0.10 3.64 -1.60 -0.33 116.57 118.38 1pfm h LYS 61 Ca 0.00 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 1pfm h LYS 61 Cb 0.40 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1pfm h LYS 61 CO 0.00 0.26 -0.23 0.87 -2.27 0.00 0.00 179.45 178.08 1pfm h LYS 62 N 0.00 0.00 0.10 1.90 1.57 -0.86 -1.63 116.57 117.65 1pfm h LYS 62 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1pfm h LYS 62 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.99 1pfm h LYS 62 CO 0.03 0.23 -0.05 0.82 -0.57 0.00 0.00 179.45 179.91 1pfm h ILE 63 N 0.00 0.81 -0.77 1.86 2.04 -1.09 -1.45 117.51 118.91 1pfm h ILE 63 Ca -0.00 -1.33 0.05 0.00 1.00 0.00 0.00 64.86 64.57 1pfm h ILE 63 Cb 0.95 1.45 -0.05 0.00 -0.74 0.00 0.00 36.82 38.42 1pfm h ILE 63 CO 0.03 0.24 0.47 0.40 0.00 0.00 0.00 178.15 179.30 1pfm h ILE 64 N -0.94 1.06 -0.71 -0.67 2.04 -1.33 0.43 117.51 117.39 1pfm h ILE 64 Ca -0.01 -0.31 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 1pfm h ILE 64 Cb 0.50 0.09 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1pfm h ILE 64 CO 0.02 0.16 0.24 0.11 0.00 0.00 0.00 178.15 178.69 1pfm h LYS 65 N 0.89 1.08 0.00 2.37 1.79 -1.37 0.11 116.57 121.45 1pfm h LYS 65 Ca 0.32 -0.21 0.00 0.00 -2.18 0.00 0.00 60.65 58.58 1pfm h LYS 65 Cb 0.10 -0.17 0.00 0.00 -1.58 0.00 0.00 32.23 30.58 1pfm h LYS 65 CO -0.14 0.91 0.00 0.87 -1.08 0.00 0.00 179.45 180.00 1pfm h LYS 66 N 1.04 0.00 0.00 3.15 1.57 -0.04 -1.99 116.57 120.30 1pfm h LYS 66 Ca 0.23 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.95 1pfm h LYS 66 Cb 0.26 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1pfm h LYS 66 CO -0.01 0.00 -1.03 -0.07 -0.57 0.00 0.00 179.45 177.77 1pfm h LEU 67 N 0.00 0.00 0.13 2.94 3.38 0.59 -3.35 115.31 119.01 1pfm h LEU 67 Ca 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 1pfm h LEU 67 Cb 0.46 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.24 1pfm h LEU 67 CO 0.00 0.24 -1.12 -0.07 0.09 0.00 0.00 178.44 177.58 1pfm h LEU 68 N 0.00 0.76 -1.80 1.67 3.38 -0.34 -3.21 115.31 115.76 1pfm h LEU 68 Ca -0.06 -0.86 0.30 0.00 0.09 0.00 0.00 57.88 57.35 1pfm h LEU 68 Cb 1.24 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.70 1pfm h LEU 68 CO 0.02 1.54 0.88 1.05 0.09 0.00 0.00 178.44 182.02 1pfm h GLU 69 N 0.08 0.00 0.00 1.13 4.11 -1.53 -3.51 114.58 114.85 1pfm h GLU 69 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.25 1pfm h GLU 69 Cb 1.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.09 1pfm h GLU 69 CO 0.21 0.00 0.00 -1.13 0.07 0.00 0.00 179.01 178.16