#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pfm s SER 4 N 0.00 6.34 -0.30 7.83 1.04 -1.26 -5.10 113.70 122.26 1pfm s SER 4 Ca 0.00 0.24 -0.17 0.00 0.48 0.00 0.00 55.95 56.50 1pfm s SER 4 Cb 0.00 -1.94 0.18 0.00 0.10 0.00 0.00 66.02 64.36 1pfm s SER 4 CO 0.00 -0.06 1.14 0.00 0.98 0.00 0.00 173.24 175.30 1pfm s ALA 5 N -1.93 -2.77 0.00 5.32 0.00 -1.26 -5.01 121.76 116.11 1pfm s ALA 5 Ca 0.36 1.99 0.00 0.00 0.00 0.00 0.00 51.96 54.31 1pfm s ALA 5 Cb -0.10 -2.03 0.00 0.00 0.00 0.00 0.00 23.12 20.98 1pfm s ALA 5 CO 0.30 -0.67 0.00 1.17 0.00 0.00 0.00 175.76 176.56 1pfm n LYS 6 N 4.10 0.00 -0.80 0.00 4.81 -1.26 -4.99 118.16 120.02 1pfm n LYS 6 Ca -0.12 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 56.98 1pfm n LYS 6 Cb 0.55 0.00 0.12 0.00 0.02 0.00 0.00 35.03 35.72 1pfm n LYS 6 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1pfm n GLU 7 N 0.00 -0.47 0.00 1.64 0.28 -1.26 -4.57 120.64 116.26 1pfm n GLU 7 Ca 0.00 -0.11 0.00 0.00 -0.16 0.00 0.00 57.16 56.89 1pfm n GLU 7 Cb 0.00 -1.71 0.00 0.00 1.43 0.00 0.00 31.44 31.16 1pfm n GLU 7 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 177.13 176.86 1pfm n LEU 8 N -0.73 0.00 -1.84 -1.84 0.00 -1.26 -4.99 117.00 106.34 1pfm n LEU 8 Ca 0.05 0.00 -0.01 0.00 0.00 0.00 0.00 56.01 56.05 1pfm n LEU 8 Cb 0.56 0.00 0.01 0.00 0.00 0.00 0.00 43.42 43.99 1pfm n LEU 8 CO 0.51 0.00 0.36 -1.14 0.00 0.00 0.00 177.39 177.12 1pfm n ARG 9 N 0.00 0.20 -1.99 1.96 0.63 -0.84 -5.00 116.66 111.62 1pfm n ARG 9 Ca 0.00 -0.27 -0.31 0.00 -0.92 0.00 0.00 57.85 56.35 1pfm n ARG 9 Cb 0.00 0.05 0.00 0.00 0.45 0.00 0.00 32.46 32.96 1pfm n ARG 9 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1pfm h GLN 11 N 0.00 0.48 -3.12 0.00 5.75 -2.01 -3.41 115.11 112.81 1pfm h GLN 11 Ca -0.45 -0.59 -0.59 0.00 -0.15 0.00 0.00 58.65 56.87 1pfm h GLN 11 Cb 1.19 0.19 -0.40 0.00 1.07 0.00 0.00 27.48 29.53 1pfm h GLN 11 CO 0.61 1.23 -0.77 0.00 -2.65 0.00 0.00 178.83 177.25 1pfm n VAL 13 N 4.34 0.00 0.00 0.00 0.31 -1.26 -4.81 118.33 116.91 1pfm n VAL 13 Ca 0.03 0.36 0.00 0.00 -0.01 0.00 0.00 64.34 64.73 1pfm n VAL 13 Cb 0.39 -1.35 0.00 0.00 -0.91 0.00 0.00 33.84 31.97 1pfm n VAL 13 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1pfm n LYS 14 N 0.00 0.94 -4.83 5.55 4.81 -1.26 -4.98 118.16 118.39 1pfm n LYS 14 Ca 0.00 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.11 1pfm n LYS 14 Cb 0.00 0.00 -0.14 0.00 0.02 0.00 0.00 35.03 34.91 1pfm n LYS 14 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1pfm s THR 15 N -0.08 3.01 -1.29 3.15 2.01 -1.26 -4.97 115.64 116.21 1pfm s THR 15 Ca 0.00 -0.70 -0.05 0.00 0.31 0.00 0.00 61.69 61.25 1pfm s THR 15 Cb 0.00 -2.24 0.14 0.00 0.01 0.00 0.00 72.50 70.42 1pfm s THR 15 CO 0.00 0.54 2.30 0.41 -0.69 0.00 0.00 174.62 177.19 1pfm n THR 16 N 3.18 5.29 1.55 -0.82 -1.04 -0.02 -4.64 114.28 117.77 1pfm n THR 16 Ca -0.18 -4.50 0.13 0.00 -2.04 0.00 0.00 64.05 57.47 1pfm n THR 16 Cb 0.53 -2.04 0.76 0.00 -1.82 0.00 0.00 70.33 67.75 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 1.66 0.00 0.23 8.00 3.41 -1.26 -3.56 113.62 122.10 1pfm n SER 17 Ca 0.60 -0.62 0.18 0.00 -0.26 0.00 0.00 58.87 58.77 1pfm n SER 17 Cb 0.25 -0.08 0.83 0.00 -0.26 0.00 0.00 64.21 64.94 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 -6.98 4.33 1.08 -1.92 -3.40 115.11 108.22 1pfm h GLN 18 Ca 0.00 0.00 -0.46 0.00 -1.45 0.00 0.00 58.65 56.74 1pfm h GLN 18 Cb 0.07 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.48 1pfm h GLN 18 CO 0.00 0.00 0.27 0.08 -0.95 0.00 0.00 178.83 178.23 1pfm s VAL 19 N -4.36 4.49 -0.05 -0.54 1.01 -1.23 -5.06 120.40 114.65 1pfm s VAL 19 Ca -0.04 1.30 -0.01 0.00 0.00 0.00 0.00 61.98 63.22 1pfm s VAL 19 Cb 0.12 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 1pfm s VAL 19 CO 0.42 -0.33 0.03 -0.60 0.00 0.00 0.00 175.10 174.62 1pfm s ARG 20 N -3.24 3.00 -0.07 2.72 3.52 -1.26 -5.08 118.95 118.54 1pfm s ARG 20 Ca 0.59 -0.44 -0.30 0.00 -0.13 0.00 0.00 55.73 55.45 1pfm s ARG 20 Cb -0.09 -2.82 -0.02 0.00 -1.56 0.00 0.00 34.95 30.46 1pfm s ARG 20 CO 0.16 0.68 1.00 -1.25 -0.81 0.00 0.00 175.30 175.09 1pfm s PRO 21 N -1.24 4.47 0.00 5.12 0.04 -1.26 -4.60 135.00 137.52 1pfm s PRO 21 Ca 0.17 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.62 1pfm s PRO 21 Cb -0.12 -3.52 0.00 0.00 0.04 0.00 0.00 34.50 30.91 1pfm s PRO 21 CO 0.07 -0.23 0.00 0.54 0.04 0.00 0.00 177.00 177.42 1pfm n ARG 22 N 4.65 0.00 -0.82 4.56 1.74 -1.26 -4.93 116.66 120.60 1pfm n ARG 22 Ca 0.08 0.00 0.03 0.00 -0.77 0.00 0.00 57.85 57.19 1pfm n ARG 22 Cb 0.49 0.00 0.33 0.00 -1.02 0.00 0.00 32.46 32.26 1pfm n ARG 22 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1pfm n HIS 23 N 0.00 1.93 -0.33 -1.55 -0.00 -1.26 -4.98 115.22 109.04 1pfm n HIS 23 Ca 0.00 -0.77 -0.28 0.00 -0.00 0.00 0.00 57.72 56.67 1pfm n HIS 23 Cb 0.00 -0.51 0.26 0.00 -0.00 0.00 0.00 29.99 29.74 1pfm n HIS 23 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.34 177.85 1pfm n ILE 24 N 0.36 0.00 0.00 1.59 3.06 -1.26 -0.48 119.36 122.63 1pfm n ILE 24 Ca 0.28 -0.11 0.00 0.00 -2.50 0.00 0.00 62.75 60.42 1pfm n ILE 24 Cb 1.14 -0.90 0.00 0.00 0.54 0.00 0.00 39.64 40.42 1pfm n ILE 24 CO 0.00 0.00 0.00 1.07 -2.50 0.00 0.00 176.55 175.12 1pfm n THR 25 N -5.44 0.00 -3.52 9.51 5.66 -0.83 -4.13 114.28 115.53 1pfm n THR 25 Ca 0.10 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.00 1pfm n THR 25 Cb 0.55 -0.19 -0.03 0.00 -1.55 0.00 0.00 70.33 69.11 1pfm n THR 25 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1pfm s SER 26 N -3.46 -0.41 -0.04 1.09 1.04 -1.13 -5.04 113.70 105.75 1pfm s SER 26 Ca 0.00 0.17 -0.10 0.00 0.48 0.00 0.00 55.95 56.50 1pfm s SER 26 Cb 0.00 0.40 0.02 0.00 0.10 0.00 0.00 66.02 66.53 1pfm s SER 26 CO 0.00 -0.58 0.23 -1.48 0.98 0.00 0.00 173.24 172.39 1pfm s LEU 27 N -2.05 1.15 0.29 2.42 0.05 -1.26 0.90 118.68 120.19 1pfm s LEU 27 Ca 0.01 0.15 -0.07 0.00 0.05 0.00 0.00 54.13 54.27 1pfm s LEU 27 Cb -0.01 0.92 -0.06 0.00 -2.05 0.00 0.00 46.19 45.00 1pfm s LEU 27 CO -0.05 -0.29 0.58 -1.61 -0.55 0.00 0.00 176.35 174.43 1pfm s GLU 28 N -0.80 3.69 -0.32 1.48 2.02 0.87 -4.91 118.70 120.73 1pfm s GLU 28 Ca -0.09 0.13 -0.01 0.00 0.02 0.00 0.00 54.97 55.02 1pfm s GLU 28 Cb -0.05 -2.61 0.10 0.00 0.10 0.00 0.00 34.13 31.67 1pfm s GLU 28 CO 0.02 0.21 0.11 0.08 0.02 0.00 0.00 175.26 175.69 1pfm s VAL 29 N -2.06 0.89 -0.11 2.63 1.01 -1.26 -1.47 120.40 120.03 1pfm s VAL 29 Ca 0.46 -1.47 -0.05 0.00 0.00 0.00 0.00 61.98 60.92 1pfm s VAL 29 Cb -0.11 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 1pfm s VAL 29 CO 0.28 -0.70 0.08 -0.63 0.00 0.00 0.00 175.10 174.14 1pfm s ILE 30 N 1.53 5.03 0.44 2.22 1.09 -0.17 -4.99 121.20 126.36 1pfm s ILE 30 Ca 0.10 0.03 -0.07 0.00 -1.10 0.00 0.00 60.65 59.61 1pfm s ILE 30 Cb -0.18 -3.17 0.10 0.00 -1.06 0.00 0.00 42.46 38.16 1pfm s ILE 30 CO -0.23 0.61 0.60 1.17 -0.10 0.00 0.00 174.94 176.99 1pfm n LYS 31 N 2.06 -0.55 -2.49 2.79 4.81 -1.26 -1.59 118.16 121.92 1pfm n LYS 31 Ca -0.19 -0.95 -0.39 0.00 -0.87 0.00 0.00 58.31 55.90 1pfm n LYS 31 Cb 0.54 -0.61 -0.03 0.00 0.02 0.00 0.00 35.03 34.95 1pfm n LYS 31 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1pfm s ALA 32 N -3.93 2.58 1.00 3.14 0.00 -1.24 -4.06 121.76 119.25 1pfm s ALA 32 Ca 0.34 -2.04 0.00 0.00 0.00 0.00 0.00 51.96 50.26 1pfm s ALA 32 Cb -0.01 -4.50 0.00 0.00 0.00 0.00 0.00 23.12 18.61 1pfm s ALA 32 CO 0.24 -3.73 0.00 0.41 0.00 0.00 0.00 175.76 172.68 1pfm n GLY 33 N 6.69 -0.32 0.00 0.00 0.00 0.46 -4.60 105.19 107.41 1pfm n GLY 33 Ca 0.30 -1.44 0.00 0.00 0.00 0.00 0.00 46.02 44.89 1pfm n GLY 33 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pfm n PRO 34 N 0.00 0.00 0.27 1.61 -0.04 -1.26 -2.60 135.00 132.99 1pfm n PRO 34 Ca 0.00 0.25 0.18 0.00 -0.04 0.00 0.00 63.50 63.89 1pfm n PRO 34 Cb 0.00 -0.82 0.90 0.00 -0.04 0.00 0.00 33.50 33.55 1pfm n PRO 34 CO 0.00 0.00 0.00 1.12 -0.04 0.00 0.00 175.50 176.58 1pfm h HIS 35 N 0.00 0.00 -2.96 0.54 2.07 -1.94 -2.96 115.15 109.90 1pfm h HIS 35 Ca 0.00 0.00 -0.62 0.00 -2.85 0.00 0.00 60.37 56.90 1pfm h HIS 35 Cb 0.00 0.00 -0.42 0.00 2.57 0.00 0.00 27.41 29.56 1pfm h HIS 35 CO 0.02 0.00 -0.59 0.00 -3.07 0.00 0.00 177.93 174.29 1pfm n PRO 37 N 1.86 0.16 -3.15 0.00 -0.04 -1.07 0.17 135.00 132.93 1pfm n PRO 37 Ca 0.21 0.37 -0.25 0.00 -0.04 0.00 0.00 63.50 63.80 1pfm n PRO 37 Cb 0.36 -1.79 -0.01 0.00 -0.04 0.00 0.00 33.50 32.03 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 4.89 0.11 0.52 -1.32 -1.26 -4.63 115.64 110.71 1pfm s THR 38 Ca 0.05 -0.31 -0.31 0.00 -1.21 0.00 0.00 61.69 59.91 1pfm s THR 38 Cb 0.10 -3.81 -0.08 0.00 -1.51 0.00 0.00 72.50 67.20 1pfm s THR 38 CO 0.38 -0.59 1.42 0.00 -2.21 0.00 0.00 174.62 173.61 1pfm s ALA 39 N -2.45 3.61 0.11 11.08 0.00 -1.26 -3.64 121.76 129.20 1pfm s ALA 39 Ca 0.43 1.12 0.10 0.00 0.00 0.00 0.00 51.96 53.61 1pfm s ALA 39 Cb -0.10 -3.56 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 1pfm s ALA 39 CO 0.38 -0.67 -0.25 -1.14 0.00 0.00 0.00 175.76 174.08 1pfm s GLN 40 N 1.29 1.54 -0.13 0.00 0.74 -0.62 -4.89 119.66 117.59 1pfm s GLN 40 Ca 0.65 -1.28 -0.06 0.00 0.05 0.00 0.00 55.36 54.72 1pfm s GLN 40 Cb -0.37 -1.96 0.05 0.00 1.10 0.00 0.00 33.01 31.84 1pfm s GLN 40 CO 0.30 0.47 0.30 -1.17 -0.55 0.00 0.00 175.29 174.63 1pfm s LEU 41 N -1.96 0.25 0.40 3.68 2.96 -1.25 -1.00 118.68 121.76 1pfm s LEU 41 Ca 0.14 0.64 0.08 0.00 -0.22 0.00 0.00 54.13 54.77 1pfm s LEU 41 Cb -0.10 0.93 -0.05 0.00 0.50 0.00 0.00 46.19 47.47 1pfm s LEU 41 CO 0.06 -0.18 0.19 -0.63 -1.32 0.00 0.00 176.35 174.48 1pfm s ILE 42 N 1.32 2.47 0.31 6.68 -1.09 -0.54 -1.91 121.20 128.43 1pfm s ILE 42 Ca -0.09 -1.67 0.02 0.00 -2.23 0.00 0.00 60.65 56.68 1pfm s ILE 42 Cb -0.10 -2.99 -0.02 0.00 -1.58 0.00 0.00 42.46 37.78 1pfm s ILE 42 CO -0.10 -0.04 0.33 0.00 -1.23 0.00 0.00 174.94 173.90 1pfm s ALA 43 N -2.55 1.31 -0.08 9.38 0.00 -1.01 -0.09 121.76 128.72 1pfm s ALA 43 Ca 0.41 -1.79 -0.07 0.00 0.00 0.00 0.00 51.96 50.51 1pfm s ALA 43 Cb 0.02 1.35 0.02 0.00 0.00 0.00 0.00 23.12 24.50 1pfm s ALA 43 CO 0.23 -0.70 0.21 0.99 0.00 0.00 0.00 175.76 176.49 1pfm s THR 44 N -3.46 -0.00 0.24 0.00 2.01 0.26 -2.89 115.64 111.81 1pfm s THR 44 Ca 0.36 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.40 1pfm s THR 44 Cb 0.02 -0.30 0.03 0.00 0.01 0.00 0.00 72.50 72.27 1pfm s THR 44 CO 0.22 0.00 0.26 0.18 -0.69 0.00 0.00 174.62 174.59 1pfm n LEU 45 N 2.99 0.00 0.15 4.42 4.32 -1.00 -1.97 117.00 125.91 1pfm n LEU 45 Ca -0.13 -1.17 0.01 0.00 -0.02 0.00 0.00 56.01 54.70 1pfm n LEU 45 Cb 0.58 -0.09 0.22 0.00 -1.62 0.00 0.00 43.42 42.51 1pfm n LEU 45 CO 0.19 -0.49 0.55 0.07 -1.22 0.00 0.00 177.39 176.50 1pfm h LYS 46 N 0.00 0.00 -4.98 3.23 2.10 -0.93 -3.30 116.57 112.68 1pfm h LYS 46 Ca -0.14 0.00 -0.68 0.00 -2.00 0.00 0.00 60.65 57.83 1pfm h LYS 46 Cb 0.55 0.00 -0.18 0.00 -0.90 0.00 0.00 32.23 31.70 1pfm h LYS 46 CO 0.20 0.54 0.56 -0.80 -2.00 0.00 0.00 179.45 177.96 1pfm s ASN 47 N -6.76 6.43 -0.02 7.07 0.01 -1.26 -4.87 114.94 115.54 1pfm s ASN 47 Ca -0.01 -1.70 -0.00 0.00 -0.71 0.00 0.00 52.86 50.44 1pfm s ASN 47 Cb 0.12 -2.37 -0.01 0.00 0.41 0.00 0.00 41.25 39.40 1pfm s ASN 47 CO 0.74 -1.14 0.60 0.61 -1.51 0.00 0.00 177.10 176.41 1pfm n GLY 48 N 5.30 -0.01 3.29 0.66 0.00 -1.24 -4.76 105.19 108.43 1pfm n GLY 48 Ca 0.09 -0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 1pfm n GLY 48 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1pfm s ARG 49 N 2.92 1.55 -0.12 1.61 1.70 -1.26 -4.97 118.95 120.38 1pfm s ARG 49 Ca 0.03 -1.88 -0.06 0.00 -0.47 0.00 0.00 55.73 53.35 1pfm s ARG 49 Cb -0.02 0.09 0.05 0.00 -0.57 0.00 0.00 34.95 34.50 1pfm s ARG 49 CO 0.01 -0.49 0.28 0.15 -1.08 0.00 0.00 175.30 174.17 1pfm s LYS 50 N -3.80 0.23 0.00 3.89 3.01 -1.26 -2.39 119.74 119.43 1pfm s LYS 50 Ca 0.38 0.62 0.00 0.00 -1.01 0.00 0.00 55.97 55.96 1pfm s LYS 50 Cb 0.05 -0.08 0.00 0.00 -1.01 0.00 0.00 37.83 36.79 1pfm s LYS 50 CO 0.19 -0.19 0.00 0.44 0.51 0.00 0.00 175.35 176.30 1pfm n ILE 51 N 4.46 0.00 -3.62 2.17 -0.00 -1.14 -4.86 119.36 116.37 1pfm n ILE 51 Ca -0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 62.75 62.52 1pfm n ILE 51 Cb 0.53 0.00 -0.06 0.00 -0.00 0.00 0.00 39.64 40.10 1pfm n ILE 51 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1pfm s LEU 53 N 1.50 2.23 0.00 0.00 1.43 -0.80 -0.84 118.68 122.19 1pfm s LEU 53 Ca -0.08 -1.68 0.04 0.00 -1.03 0.00 0.00 54.13 51.38 1pfm s LEU 53 Cb -0.04 -0.73 0.04 0.00 0.03 0.00 0.00 46.19 45.49 1pfm s LEU 53 CO -0.15 -0.92 0.31 -0.90 0.23 0.00 0.00 176.35 174.91 1pfm n ASP 54 N -1.33 1.15 -0.58 2.29 5.68 -1.26 -3.85 116.55 118.65 1pfm n ASP 54 Ca -0.20 -1.72 0.01 0.00 -0.50 0.00 0.00 54.79 52.37 1pfm n ASP 54 Cb 0.67 -0.15 0.01 0.00 -1.14 0.00 0.00 41.12 40.51 1pfm n ASP 54 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1pfm n LEU 55 N 0.00 0.25 -0.00 -2.12 -0.00 -1.26 -4.57 117.00 109.29 1pfm n LEU 55 Ca 0.05 -1.23 0.02 0.00 -0.00 0.00 0.00 56.01 54.85 1pfm n LEU 55 Cb 0.27 -0.03 -0.03 0.00 -0.00 0.00 0.00 43.42 43.64 1pfm n LEU 55 CO 0.17 0.31 -0.38 0.00 -0.00 0.00 0.00 177.39 177.49 1pfm n GLN 56 N -0.03 1.89 -3.58 1.47 10.64 -1.26 -5.04 117.38 121.47 1pfm n GLN 56 Ca 0.02 -0.03 -0.22 0.00 -1.83 0.00 0.00 57.00 54.95 1pfm n GLN 56 Cb 0.74 -0.96 -0.02 0.00 -0.86 0.00 0.00 30.24 29.14 1pfm n GLN 56 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1pfm s ALA 57 N -1.99 4.16 -2.00 2.61 0.00 -1.26 -5.00 121.76 118.28 1pfm s ALA 57 Ca -0.01 -1.81 0.28 0.00 0.00 0.00 0.00 51.96 50.42 1pfm s ALA 57 Cb 0.03 -1.00 1.66 0.00 0.00 0.00 0.00 23.12 23.81 1pfm s ALA 57 CO 0.16 -0.30 2.05 -0.35 0.00 0.00 0.00 175.76 177.32 1pfm n PRO 58 N -1.62 0.96 0.25 0.00 -0.04 -1.26 -3.94 135.00 129.36 1pfm n PRO 58 Ca 0.04 0.00 -0.15 0.00 -0.04 0.00 0.00 63.50 63.35 1pfm n PRO 58 Cb 0.62 -1.45 -0.08 0.00 -0.04 0.00 0.00 33.50 32.55 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 -0.55 -1.37 1.53 5.85 -1.94 -2.33 115.31 116.50 1pfm h LEU 59 Ca 0.00 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1pfm h LEU 59 Cb 0.00 0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 1pfm h LEU 59 CO 0.00 -0.22 -0.05 0.10 -0.34 0.00 0.00 178.44 177.93 1pfm h TYR 60 N -0.89 0.00 0.00 1.25 -0.00 -1.81 -1.81 116.97 113.71 1pfm h TYR 60 Ca -0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.65 1pfm h TYR 60 Cb 0.59 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.32 1pfm h TYR 60 CO 0.00 0.05 -0.06 -0.22 -0.00 0.00 0.00 178.16 177.93 1pfm h LYS 61 N 0.00 0.00 0.00 0.10 3.64 -1.61 0.63 116.57 119.32 1pfm h LYS 61 Ca -0.00 0.00 -0.16 0.00 -1.27 0.00 0.00 60.65 59.22 1pfm h LYS 61 Cb 0.57 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.37 1pfm h LYS 61 CO 0.01 0.06 -0.77 0.87 -2.27 0.00 0.00 179.45 177.35 1pfm h LYS 62 N 0.00 0.00 0.39 1.90 1.79 -0.79 -1.42 116.57 118.44 1pfm h LYS 62 Ca -0.00 0.00 -0.02 0.00 -2.18 0.00 0.00 60.65 58.45 1pfm h LYS 62 Cb 0.37 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.03 1pfm h LYS 62 CO 0.01 0.77 -0.19 0.82 -1.08 0.00 0.00 179.45 179.78 1pfm h ILE 63 N 0.00 0.31 -0.90 1.86 2.04 -0.93 -0.78 117.51 119.11 1pfm h ILE 63 Ca -0.01 -0.66 0.01 0.00 1.00 0.00 0.00 64.86 65.21 1pfm h ILE 63 Cb 1.47 0.48 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 1pfm h ILE 63 CO 0.10 0.07 0.60 0.40 0.00 0.00 0.00 178.15 179.31 1pfm h ILE 64 N -1.04 1.22 -0.00 -0.67 2.04 -1.38 0.41 117.51 118.09 1pfm h ILE 64 Ca -0.05 -0.42 -0.04 0.00 1.00 0.00 0.00 64.86 65.36 1pfm h ILE 64 Cb 0.51 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 1pfm h ILE 64 CO 0.09 0.22 -0.17 0.11 0.00 0.00 0.00 178.15 178.40 1pfm h LYS 65 N 1.21 0.01 0.00 2.37 1.79 -1.28 0.05 116.57 120.72 1pfm h LYS 65 Ca 0.34 -0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.73 1pfm h LYS 65 Cb -0.12 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.52 1pfm h LYS 65 CO -0.08 0.17 -0.34 0.87 -1.08 0.00 0.00 179.45 178.99 1pfm h LYS 66 N 0.01 0.00 0.00 3.15 1.57 0.56 -2.20 116.57 119.66 1pfm h LYS 66 Ca -0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1pfm h LYS 66 Cb 0.30 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.60 1pfm h LYS 66 CO 0.02 0.34 -0.47 -0.07 -0.57 0.00 0.00 179.45 178.71 1pfm h LEU 67 N 0.00 0.00 0.20 2.94 3.38 0.59 -3.31 115.31 119.11 1pfm h LEU 67 Ca -0.00 0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.62 1pfm h LEU 67 Cb 1.11 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.87 1pfm h LEU 67 CO 0.04 0.17 -1.69 -0.07 0.09 0.00 0.00 178.44 176.98 1pfm h LEU 68 N 0.00 0.66 -1.83 1.67 3.38 -0.97 -3.27 115.31 114.94 1pfm h LEU 68 Ca -0.02 -0.91 0.13 0.00 0.09 0.00 0.00 57.88 57.17 1pfm h LEU 68 Cb 1.14 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.66 1pfm h LEU 68 CO 0.02 1.76 0.54 1.05 0.09 0.00 0.00 178.44 181.90 1pfm h GLU 69 N 0.11 0.00 -0.03 1.13 -0.00 -1.49 -3.51 114.58 110.79 1pfm h GLU 69 Ca -0.32 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.04 1pfm h GLU 69 Cb 2.11 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.86 1pfm h GLU 69 CO 0.20 0.00 0.00 0.45 -0.00 0.00 0.00 179.01 179.66