#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 -0.64 0.98 7.83 1.04 -1.26 -5.12 113.70 116.53 1pfm s SER 4 Ca 0.00 1.19 0.00 0.00 0.48 0.00 0.00 55.95 57.62 1pfm s SER 4 Cb 0.00 1.20 0.00 0.00 0.10 0.00 0.00 66.02 67.32 1pfm s SER 4 CO 0.00 -0.25 0.00 0.00 0.98 0.00 0.00 173.24 173.97 1pfm n ALA 5 N 2.57 0.00 -1.00 5.32 0.00 -1.26 -4.97 120.51 121.17 1pfm n ALA 5 Ca -0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.30 1pfm n ALA 5 Cb 0.56 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.01 1pfm n ALA 5 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1pfm n LYS 6 N 0.00 0.00 -2.30 0.00 5.02 -1.26 -5.00 118.16 114.62 1pfm n LYS 6 Ca 0.00 0.00 -0.43 0.00 -2.02 0.00 0.00 58.31 55.86 1pfm n LYS 6 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1pfm n LYS 6 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1pfm n GLU 7 N -0.46 3.30 -0.58 1.97 4.71 -1.26 -4.99 120.64 123.33 1pfm n GLU 7 Ca 0.00 -3.28 -0.30 0.00 -0.01 0.00 0.00 57.16 53.57 1pfm n GLU 7 Cb 0.00 -3.13 0.21 0.00 -1.01 0.00 0.00 31.44 27.51 1pfm n GLU 7 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1pfm n LEU 8 N 5.43 -0.97 0.00 -4.62 7.94 -1.26 -4.85 117.00 118.67 1pfm n LEU 8 Ca 0.44 -0.03 0.00 0.00 -1.11 0.00 0.00 56.01 55.31 1pfm n LEU 8 Cb 0.39 -1.20 0.00 0.00 0.53 0.00 0.00 43.42 43.15 1pfm n LEU 8 CO 0.80 -3.13 0.00 0.54 -1.11 0.00 0.00 177.39 174.49 1pfm n ARG 9 N -3.76 0.00 -2.17 1.96 1.74 -0.92 -4.97 116.66 108.54 1pfm n ARG 9 Ca 0.04 0.00 -0.32 0.00 -0.77 0.00 0.00 57.85 56.80 1pfm n ARG 9 Cb 0.56 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.98 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 0.39 0.55 -4.63 0.00 4.15 -2.00 -3.41 115.11 110.15 1pfm h GLN 11 Ca -0.46 -0.46 -0.65 0.00 0.77 0.00 0.00 58.65 57.86 1pfm h GLN 11 Cb 1.19 0.10 -0.38 0.00 0.21 0.00 0.00 27.48 28.60 1pfm h GLN 11 CO 0.62 1.08 -0.78 0.00 -1.93 0.00 0.00 178.83 177.82 1pfm n VAL 13 N 4.50 0.00 -0.64 0.00 0.31 -1.26 -4.86 118.33 116.37 1pfm n VAL 13 Ca -0.11 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.02 1pfm n VAL 13 Cb 0.43 0.00 0.11 0.00 -0.91 0.00 0.00 33.84 33.47 1pfm n VAL 13 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 1pfm n LYS 14 N 0.00 -1.53 -2.96 5.55 2.85 -1.26 -4.87 118.16 115.94 1pfm n LYS 14 Ca 0.00 -0.45 -0.40 0.00 -1.05 0.00 0.00 58.31 56.41 1pfm n LYS 14 Cb 0.00 -1.37 -0.05 0.00 -0.65 0.00 0.00 35.03 32.96 1pfm n LYS 14 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1pfm s THR 15 N -2.08 4.77 -1.02 0.58 2.01 -1.26 -4.95 115.64 113.68 1pfm s THR 15 Ca 0.33 1.65 -0.05 0.00 0.31 0.00 0.00 61.69 63.94 1pfm s THR 15 Cb -0.04 -4.13 0.11 0.00 0.01 0.00 0.00 72.50 68.46 1pfm s THR 15 CO 0.37 0.34 2.48 0.41 -0.69 0.00 0.00 174.62 177.53 1pfm n THR 16 N 2.97 4.66 1.13 -0.82 -1.04 -0.23 -4.62 114.28 116.34 1pfm n THR 16 Ca -0.02 -3.98 0.11 0.00 -2.04 0.00 0.00 64.05 58.12 1pfm n THR 16 Cb 0.50 -1.88 0.58 0.00 -1.82 0.00 0.00 70.33 67.71 1pfm n THR 16 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1pfm n SER 17 N 1.33 0.00 0.17 8.00 7.64 -1.26 -3.45 113.62 126.06 1pfm n SER 17 Ca 0.57 -0.22 0.18 0.00 1.01 0.00 0.00 58.87 60.42 1pfm n SER 17 Cb 0.34 -0.20 0.76 0.00 -1.01 0.00 0.00 64.21 64.10 1pfm n SER 17 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 1pfm h GLN 18 N 0.00 0.00 -6.10 1.43 -0.00 -1.91 -3.39 115.11 105.14 1pfm h GLN 18 Ca 0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 58.65 58.08 1pfm h GLN 18 Cb 0.14 0.00 -0.05 0.00 0.00 0.00 0.00 27.48 27.57 1pfm h GLN 18 CO 0.00 0.00 -0.00 0.08 0.00 0.00 0.00 178.83 178.91 1pfm s VAL 19 N -4.43 4.90 0.14 2.39 1.01 -1.22 -5.06 120.40 118.12 1pfm s VAL 19 Ca -0.04 1.27 -0.11 0.00 0.00 0.00 0.00 61.98 63.10 1pfm s VAL 19 Cb 0.13 -3.94 -0.06 0.00 0.00 0.00 0.00 36.38 32.50 1pfm s VAL 19 CO 0.45 0.42 0.48 -0.13 0.00 0.00 0.00 175.10 176.32 1pfm s ARG 20 N -0.19 3.83 -0.03 2.72 0.52 -1.26 -5.05 118.95 119.48 1pfm s ARG 20 Ca 0.31 0.28 -0.30 0.00 -0.52 0.00 0.00 55.73 55.51 1pfm s ARG 20 Cb -0.18 -2.88 -0.03 0.00 0.52 0.00 0.00 34.95 32.38 1pfm s ARG 20 CO 0.18 0.47 1.02 -1.25 0.02 0.00 0.00 175.30 175.73 1pfm s PRO 21 N -2.21 4.49 0.00 3.54 0.04 -1.26 -4.74 135.00 134.86 1pfm s PRO 21 Ca 0.39 1.45 0.00 0.00 0.04 0.00 0.00 61.00 62.87 1pfm s PRO 21 Cb -0.13 -3.49 0.00 0.00 0.04 0.00 0.00 34.50 30.92 1pfm s PRO 21 CO 0.20 -0.18 0.00 0.54 0.04 0.00 0.00 177.00 177.60 1pfm n ARG 22 N 4.35 0.00 -1.20 4.56 1.74 -1.26 -4.95 116.66 119.90 1pfm n ARG 22 Ca 0.07 0.00 -0.27 0.00 -0.77 0.00 0.00 57.85 56.88 1pfm n ARG 22 Cb 0.50 0.00 0.05 0.00 -1.02 0.00 0.00 32.46 31.99 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 -1.58 2.45 -0.92 -1.55 8.25 -1.26 -4.98 115.22 115.63 1pfm n HIS 23 Ca 0.00 -2.51 -0.29 0.00 -0.26 0.00 0.00 57.72 54.67 1pfm n HIS 23 Cb 0.00 -1.24 0.22 0.00 1.12 0.00 0.00 29.99 30.09 1pfm n HIS 23 CO 0.00 0.00 0.00 -1.50 0.64 0.00 0.00 176.34 175.48 1pfm s ILE 24 N -3.68 1.91 0.00 1.59 1.10 -1.26 -0.51 121.20 120.35 1pfm s ILE 24 Ca 0.50 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.64 1pfm s ILE 24 Cb 0.39 -2.33 0.00 0.00 0.15 0.00 0.00 42.46 40.67 1pfm s ILE 24 CO -0.04 0.00 0.00 1.07 -2.11 0.00 0.00 174.94 173.86 1pfm n THR 25 N -4.60 0.00 -3.52 4.00 5.66 -0.79 -4.36 114.28 110.67 1pfm n THR 25 Ca 0.05 0.00 -0.09 0.00 -3.05 0.00 0.00 64.05 60.96 1pfm n THR 25 Cb 0.57 -0.39 -0.03 0.00 -1.55 0.00 0.00 70.33 68.93 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 -3.99 -0.37 -0.05 1.09 0.01 -1.16 -5.04 113.70 104.20 1pfm s SER 26 Ca 0.00 0.10 -0.12 0.00 1.31 0.00 0.00 55.95 57.25 1pfm s SER 26 Cb 0.00 0.37 0.02 0.00 0.21 0.00 0.00 66.02 66.62 1pfm s SER 26 CO 0.00 -0.56 0.27 -1.48 0.41 0.00 0.00 173.24 171.88 1pfm s LEU 27 N -2.17 1.00 0.28 2.44 0.05 -1.26 0.79 118.68 119.81 1pfm s LEU 27 Ca 0.03 0.21 -0.07 0.00 0.05 0.00 0.00 54.13 54.36 1pfm s LEU 27 Cb -0.01 1.06 -0.06 0.00 -2.05 0.00 0.00 46.19 45.13 1pfm s LEU 27 CO -0.06 -0.31 0.57 -1.61 -0.55 0.00 0.00 176.35 174.39 1pfm s GLU 28 N -0.79 3.69 -0.31 1.48 2.02 0.52 -4.92 118.70 120.38 1pfm s GLU 28 Ca -0.09 0.12 -0.01 0.00 0.02 0.00 0.00 54.97 55.01 1pfm s GLU 28 Cb -0.04 -2.63 0.10 0.00 0.10 0.00 0.00 34.13 31.66 1pfm s GLU 28 CO 0.02 0.22 0.09 0.08 0.02 0.00 0.00 175.26 175.70 1pfm s VAL 29 N -2.03 0.92 -0.07 2.63 1.01 -1.26 -1.92 120.40 119.68 1pfm s VAL 29 Ca 0.45 -1.41 -0.03 0.00 0.00 0.00 0.00 61.98 61.00 1pfm s VAL 29 Cb -0.11 -1.69 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1pfm s VAL 29 CO 0.28 -0.66 0.06 -0.63 0.00 0.00 0.00 175.10 174.15 1pfm s ILE 30 N 1.60 4.75 0.55 2.22 1.09 -0.14 -4.99 121.20 126.27 1pfm s ILE 30 Ca 0.09 -0.19 -0.09 0.00 -1.10 0.00 0.00 60.65 59.37 1pfm s ILE 30 Cb -0.17 -3.07 0.13 0.00 -1.06 0.00 0.00 42.46 38.28 1pfm s ILE 30 CO -0.24 0.53 0.75 1.17 -0.10 0.00 0.00 174.94 177.04 1pfm n LYS 31 N 1.79 -0.72 -2.47 2.79 4.81 -1.26 -1.47 118.16 121.63 1pfm n LYS 31 Ca -0.17 -1.16 -0.39 0.00 -0.87 0.00 0.00 58.31 55.71 1pfm n LYS 31 Cb 0.54 -0.77 -0.03 0.00 0.02 0.00 0.00 35.03 34.79 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 -3.97 2.56 1.00 3.14 0.00 -1.24 -3.89 121.76 119.36 1pfm s ALA 32 Ca 0.42 -1.93 0.00 0.00 0.00 0.00 0.00 51.96 50.45 1pfm s ALA 32 Cb -0.01 -4.47 0.00 0.00 0.00 0.00 0.00 23.12 18.64 1pfm s ALA 32 CO 0.30 -3.72 0.00 0.41 0.00 0.00 0.00 175.76 172.75 1pfm n GLY 33 N 6.55 -2.57 0.10 0.00 0.00 0.45 -4.54 105.19 105.18 1pfm n GLY 33 Ca 0.28 -1.36 -0.02 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.15 0.00 1.61 0.13 -1.97 -2.60 132.00 129.02 1pfm h PRO 34 Ca 0.00 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1pfm h PRO 34 Cb 0.00 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.16 1pfm h PRO 34 CO 0.00 -0.10 0.00 1.12 -0.23 0.00 0.00 178.00 178.79 1pfm h HIS 35 N -0.94 0.00 -2.64 1.56 2.07 -1.89 -3.19 115.15 110.13 1pfm h HIS 35 Ca -0.02 0.00 -0.60 0.00 -2.85 0.00 0.00 60.37 56.90 1pfm h HIS 35 Cb 0.12 0.00 -0.40 0.00 2.57 0.00 0.00 27.41 29.70 1pfm h HIS 35 CO 0.00 0.00 -0.80 0.00 -3.07 0.00 0.00 177.93 174.06 1pfm n PRO 37 N 2.34 0.14 -3.27 0.00 -0.04 -0.98 0.17 135.00 133.36 1pfm n PRO 37 Ca 0.26 0.41 -0.27 0.00 -0.04 0.00 0.00 63.50 63.85 1pfm n PRO 37 Cb 0.43 -1.79 -0.02 0.00 -0.04 0.00 0.00 33.50 32.08 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 -3.26 5.03 0.12 0.52 -1.32 -1.26 -4.64 115.64 110.83 1pfm s THR 38 Ca 0.04 -0.04 -0.31 0.00 -1.21 0.00 0.00 61.69 60.17 1pfm s THR 38 Cb 0.09 -3.78 -0.09 0.00 -1.51 0.00 0.00 72.50 67.21 1pfm s THR 38 CO 0.33 -0.44 1.55 0.00 -2.21 0.00 0.00 174.62 173.86 1pfm s ALA 39 N -2.21 3.71 0.13 11.08 0.00 -1.26 -3.72 121.76 129.49 1pfm s ALA 39 Ca 0.43 1.26 0.08 0.00 0.00 0.00 0.00 51.96 53.73 1pfm s ALA 39 Cb -0.10 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 1pfm s ALA 39 CO 0.33 -0.85 -0.09 -1.14 0.00 0.00 0.00 175.76 174.01 1pfm s GLN 40 N 1.61 2.12 -0.19 0.00 0.74 -0.54 -4.78 119.66 118.61 1pfm s GLN 40 Ca 0.70 -1.09 -0.10 0.00 0.05 0.00 0.00 55.36 54.91 1pfm s GLN 40 Cb -0.41 -2.27 0.06 0.00 1.10 0.00 0.00 33.01 31.49 1pfm s GLN 40 CO 0.31 0.49 0.46 -1.17 -0.55 0.00 0.00 175.29 174.83 1pfm s LEU 41 N -2.40 -0.27 0.41 3.68 2.96 -1.25 -0.97 118.68 120.84 1pfm s LEU 41 Ca 0.22 1.01 0.07 0.00 -0.22 0.00 0.00 54.13 55.22 1pfm s LEU 41 Cb -0.10 1.54 -0.04 0.00 0.50 0.00 0.00 46.19 48.08 1pfm s LEU 41 CO 0.14 -0.20 0.22 -0.63 -1.32 0.00 0.00 176.35 174.56 1pfm s ILE 42 N 1.48 2.44 0.33 6.68 -1.09 -0.81 -2.14 121.20 128.09 1pfm s ILE 42 Ca -0.09 -1.61 0.01 0.00 -2.23 0.00 0.00 60.65 56.72 1pfm s ILE 42 Cb -0.08 -3.00 -0.01 0.00 -1.58 0.00 0.00 42.46 37.79 1pfm s ILE 42 CO -0.14 -0.01 0.39 0.00 -1.23 0.00 0.00 174.94 173.95 1pfm s ALA 43 N -2.56 1.12 -0.08 9.38 0.00 -0.73 -0.36 121.76 128.54 1pfm s ALA 43 Ca 0.43 -1.69 -0.07 0.00 0.00 0.00 0.00 51.96 50.62 1pfm s ALA 43 Cb 0.02 1.27 0.02 0.00 0.00 0.00 0.00 23.12 24.43 1pfm s ALA 43 CO 0.24 -0.74 0.21 0.99 0.00 0.00 0.00 175.76 176.46 1pfm s THR 44 N -3.26 -0.00 0.11 0.00 2.01 0.24 -3.00 115.64 111.74 1pfm s THR 44 Ca 0.34 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.36 1pfm s THR 44 Cb 0.01 -0.30 0.02 0.00 0.01 0.00 0.00 72.50 72.24 1pfm s THR 44 CO 0.22 0.00 0.13 0.18 -0.69 0.00 0.00 174.62 174.46 1pfm n LEU 45 N 3.00 0.00 -0.06 4.42 4.32 -1.09 -1.89 117.00 125.70 1pfm n LEU 45 Ca -0.13 -0.51 -0.16 0.00 -0.02 0.00 0.00 56.01 55.20 1pfm n LEU 45 Cb 0.58 -0.05 -0.06 0.00 -1.62 0.00 0.00 43.42 42.27 1pfm n LEU 45 CO 0.19 -0.46 0.39 0.11 -1.22 0.00 0.00 177.39 176.41 1pfm h LYS 46 N 0.00 0.80 -6.16 3.23 1.79 -1.00 -3.30 116.57 111.93 1pfm h LYS 46 Ca -0.06 -0.55 -0.58 0.00 -2.18 0.00 0.00 60.65 57.28 1pfm h LYS 46 Cb 0.24 0.08 -0.09 0.00 -1.58 0.00 0.00 32.23 30.88 1pfm h LYS 46 CO 0.09 1.18 1.39 -0.80 -1.08 0.00 0.00 179.45 180.22 1pfm s ASN 47 N -6.92 6.40 -0.06 0.86 0.01 -1.26 -4.80 114.94 109.17 1pfm s ASN 47 Ca -0.11 -1.22 -0.01 0.00 -0.71 0.00 0.00 52.86 50.82 1pfm s ASN 47 Cb 0.09 -2.57 -0.02 0.00 0.41 0.00 0.00 41.25 39.16 1pfm s ASN 47 CO 0.88 -1.60 0.69 0.61 -1.51 0.00 0.00 177.10 176.16 1pfm n GLY 48 N 6.56 -0.03 3.39 0.66 0.00 -1.24 -4.77 105.19 109.76 1pfm n GLY 48 Ca 0.27 -0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.07 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 3.18 1.74 -0.14 1.61 1.70 -1.26 -4.96 118.95 120.83 1pfm s ARG 49 Ca 0.09 -2.02 -0.06 0.00 -0.47 0.00 0.00 55.73 53.26 1pfm s ARG 49 Cb -0.05 -0.21 0.06 0.00 -0.57 0.00 0.00 34.95 34.18 1pfm s ARG 49 CO 0.04 -0.50 0.30 0.15 -1.08 0.00 0.00 175.30 174.21 1pfm s LYS 50 N -3.71 0.24 0.00 3.89 3.01 -1.26 -2.66 119.74 119.25 1pfm s LYS 50 Ca 0.33 0.71 0.00 0.00 -1.01 0.00 0.00 55.97 55.99 1pfm s LYS 50 Cb 0.04 -0.03 0.00 0.00 -1.01 0.00 0.00 37.83 36.83 1pfm s LYS 50 CO 0.18 -0.21 0.00 0.44 0.51 0.00 0.00 175.35 176.27 1pfm n ILE 51 N 4.72 0.00 -3.63 2.17 -6.64 -1.16 -4.88 119.36 109.94 1pfm n ILE 51 Ca -0.17 0.00 -0.09 0.00 -1.77 0.00 0.00 62.75 60.72 1pfm n ILE 51 Cb 0.52 0.00 -0.07 0.00 -1.44 0.00 0.00 39.64 38.65 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 -0.07 2.11 0.00 0.00 1.43 -0.91 -1.06 118.68 120.17 1pfm s LEU 53 Ca 0.03 -1.64 0.00 0.00 -1.03 0.00 0.00 54.13 51.49 1pfm s LEU 53 Cb -0.04 -0.30 0.09 0.00 0.03 0.00 0.00 46.19 45.97 1pfm s LEU 53 CO -0.06 -0.88 0.62 -0.90 0.23 0.00 0.00 176.35 175.36 1pfm n ASP 54 N -1.24 0.86 0.00 2.29 5.68 -1.26 -3.93 116.55 118.95 1pfm n ASP 54 Ca -0.09 -1.72 0.00 0.00 -0.50 0.00 0.00 54.79 52.48 1pfm n ASP 54 Cb 0.66 -0.40 0.00 0.00 -1.14 0.00 0.00 41.12 40.24 1pfm n ASP 54 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1pfm n LEU 55 N 0.00 0.57 -0.55 -2.12 4.32 -1.26 -4.64 117.00 113.31 1pfm n LEU 55 Ca 0.10 -0.57 0.07 0.00 -0.02 0.00 0.00 56.01 55.60 1pfm n LEU 55 Cb 0.37 0.00 0.20 0.00 -1.62 0.00 0.00 43.42 42.37 1pfm n LEU 55 CO 0.25 0.14 0.62 0.00 -1.22 0.00 0.00 177.39 177.18 1pfm n GLN 56 N -0.04 1.99 -4.37 3.23 6.02 -1.26 -5.01 117.38 117.94 1pfm n GLN 56 Ca 0.00 -2.81 -0.19 0.00 -0.01 0.00 0.00 57.00 53.99 1pfm n GLN 56 Cb 0.17 -1.68 -0.10 0.00 1.02 0.00 0.00 30.24 29.65 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 -2.94 2.08 -2.00 -1.58 0.00 -1.26 -5.02 121.76 111.05 1pfm s ALA 57 Ca 0.38 -1.78 0.25 0.00 0.00 0.00 0.00 51.96 50.81 1pfm s ALA 57 Cb 0.33 0.17 1.52 0.00 0.00 0.00 0.00 23.12 25.14 1pfm s ALA 57 CO 0.04 -0.07 1.94 -0.35 0.00 0.00 0.00 175.76 177.32 1pfm n PRO 58 N -0.47 0.93 0.15 0.00 -0.04 -1.26 -3.76 135.00 130.55 1pfm n PRO 58 Ca -0.06 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.32 1pfm n PRO 58 Cb 0.62 -1.43 -0.04 0.00 -0.04 0.00 0.00 33.50 32.61 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 -0.38 -1.16 1.53 5.85 -1.95 -2.82 115.31 116.38 1pfm h LEU 59 Ca 0.00 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1pfm h LEU 59 Cb 0.00 0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.13 1pfm h LEU 59 CO 0.00 0.08 0.00 0.10 -0.34 0.00 0.00 178.44 178.28 1pfm h TYR 60 N -1.09 0.00 0.00 1.25 -0.00 -1.83 -1.60 116.97 113.71 1pfm h TYR 60 Ca -0.05 0.00 -0.06 0.00 -0.00 0.00 0.00 58.73 58.63 1pfm h TYR 60 Cb 0.40 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.12 1pfm h TYR 60 CO 0.01 0.00 -0.26 -0.22 -0.00 0.00 0.00 178.16 177.69 1pfm h LYS 61 N 0.00 0.00 0.00 0.10 1.63 -1.64 -0.74 116.57 115.92 1pfm h LYS 61 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1pfm h LYS 61 Cb 0.42 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.05 1pfm h LYS 61 CO 0.00 0.26 0.00 0.87 -3.45 0.00 0.00 179.45 177.13 1pfm h LYS 62 N 0.00 0.00 0.05 1.90 1.57 -1.02 -1.57 116.57 117.49 1pfm h LYS 62 Ca -0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1pfm h LYS 62 Cb 0.77 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.08 1pfm h LYS 62 CO 0.03 0.00 -0.02 0.82 -0.57 0.00 0.00 179.45 179.71 1pfm h ILE 63 N 0.00 0.89 -0.82 1.86 2.04 -1.14 -1.13 117.51 119.22 1pfm h ILE 63 Ca 0.00 -1.54 -0.00 0.00 1.00 0.00 0.00 64.86 64.32 1pfm h ILE 63 Cb 0.88 1.64 -0.04 0.00 -0.74 0.00 0.00 36.82 38.56 1pfm h ILE 63 CO 0.00 0.29 0.50 0.40 0.00 0.00 0.00 178.15 179.34 1pfm h ILE 64 N -0.97 1.23 -0.62 -0.67 2.04 -1.38 0.11 117.51 117.25 1pfm h ILE 64 Ca -0.01 -0.49 -0.06 0.00 1.00 0.00 0.00 64.86 65.31 1pfm h ILE 64 Cb 0.52 0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.64 1pfm h ILE 64 CO 0.01 0.23 0.14 0.11 0.00 0.00 0.00 178.15 178.64 1pfm h LYS 65 N 1.12 0.97 0.00 2.37 1.57 -1.38 -0.12 116.57 121.11 1pfm h LYS 65 Ca 0.29 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1pfm h LYS 65 Cb -0.05 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.12 1pfm h LYS 65 CO -0.06 0.87 0.00 -0.22 -0.57 0.00 0.00 179.45 179.48 1pfm h LYS 66 N 0.93 0.00 0.00 3.15 3.64 -0.08 -2.10 116.57 122.11 1pfm h LYS 66 Ca 0.20 0.00 -0.13 0.00 -1.27 0.00 0.00 60.65 59.45 1pfm h LYS 66 Cb 0.35 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1pfm h LYS 66 CO 0.00 0.00 -1.10 -0.07 -2.27 0.00 0.00 179.45 176.01 1pfm h LEU 67 N 0.00 0.00 0.22 5.20 -0.00 0.86 -3.35 115.31 118.24 1pfm h LEU 67 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.88 57.54 1pfm h LEU 67 Cb 0.49 0.00 0.03 0.00 -0.00 0.00 0.00 40.66 41.18 1pfm h LEU 67 CO 0.00 0.48 -1.54 -0.07 -0.00 0.00 0.00 178.44 177.31 1pfm h LEU 68 N 0.00 0.74 -1.72 1.67 3.38 -0.57 -3.26 115.31 115.54 1pfm h LEU 68 Ca -0.10 -0.86 0.23 0.00 0.09 0.00 0.00 57.88 57.24 1pfm h LEU 68 Cb 1.45 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 1pfm h LEU 68 CO 0.04 1.69 0.77 1.05 0.09 0.00 0.00 178.44 182.09 1pfm h GLU 69 N 0.13 0.00 -0.02 1.13 4.11 -1.53 -3.51 114.58 114.88 1pfm h GLU 69 Ca -0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.16 1pfm h GLU 69 Cb 2.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.38 1pfm h GLU 69 CO 0.24 0.00 0.00 0.43 0.07 0.00 0.00 179.01 179.75