#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 6.10 -0.01 7.83 0.15 -1.26 -4.98 113.70 121.53 1pfm s SER 4 Ca 0.00 2.23 -0.13 0.00 0.70 0.00 0.00 55.95 58.75 1pfm s SER 4 Cb 0.00 -2.59 -0.07 0.00 -1.71 0.00 0.00 66.02 61.65 1pfm s SER 4 CO 0.00 -0.96 0.69 0.00 1.20 0.00 0.00 173.24 174.17 1pfm h ALA 5 N 1.82 -0.63 -3.00 5.45 0.00 -2.04 -3.50 119.26 117.37 1pfm h ALA 5 Ca -0.49 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1pfm h ALA 5 Cb 1.25 0.18 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1pfm h ALA 5 CO 0.59 -0.59 0.00 1.17 0.00 0.00 0.00 179.25 180.42 1pfm n LYS 6 N -4.14 0.00 0.31 0.00 4.81 -1.26 -4.98 118.16 112.91 1pfm n LYS 6 Ca -0.06 0.00 0.18 0.00 -0.87 0.00 0.00 58.31 57.56 1pfm n LYS 6 Cb 0.18 0.00 0.94 0.00 0.02 0.00 0.00 35.03 36.17 1pfm n LYS 6 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1pfm h GLU 7 N 0.00 0.00 -1.78 1.64 4.81 -2.01 -3.48 114.58 113.76 1pfm h GLU 7 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1pfm h GLU 7 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1pfm h GLU 7 CO 0.00 0.00 -0.46 1.28 -0.73 0.00 0.00 179.01 179.10 1pfm n LEU 8 N -3.09 -1.00 0.00 1.64 7.99 -1.26 -5.06 117.00 116.22 1pfm n LEU 8 Ca -0.01 1.39 0.00 0.00 -0.01 0.00 0.00 56.01 57.37 1pfm n LEU 8 Cb 0.29 -0.96 0.00 0.00 -0.11 0.00 0.00 43.42 42.64 1pfm n LEU 8 CO 0.18 -0.24 0.00 -1.14 -1.51 0.00 0.00 177.39 174.68 1pfm n ARG 9 N -1.76 0.00 -2.15 3.23 0.63 -0.85 -4.97 116.66 110.80 1pfm n ARG 9 Ca 0.00 0.00 -0.32 0.00 -0.92 0.00 0.00 57.85 56.61 1pfm n ARG 9 Cb 0.17 0.00 -0.01 0.00 0.45 0.00 0.00 32.46 33.07 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 0.34 0.00 -2.19 0.00 4.15 -1.98 -3.42 115.11 112.01 1pfm h GLN 11 Ca -0.46 0.00 -0.42 0.00 0.77 0.00 0.00 58.65 58.55 1pfm h GLN 11 Cb 1.19 0.00 -0.34 0.00 0.21 0.00 0.00 27.48 28.54 1pfm h GLN 11 CO 0.62 0.51 -0.72 0.00 -1.93 0.00 0.00 178.83 177.30 1pfm n VAL 13 N 4.49 0.00 0.00 0.00 0.31 -1.26 -4.81 118.33 117.06 1pfm n VAL 13 Ca 0.07 0.03 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1pfm n VAL 13 Cb 0.43 -0.94 0.00 0.00 -0.91 0.00 0.00 33.84 32.42 1pfm n VAL 13 CO 0.00 0.00 0.00 0.29 -1.32 0.00 0.00 176.83 175.80 1pfm n LYS 14 N 0.00 -0.05 -4.44 5.55 4.01 -1.26 -4.97 118.16 117.00 1pfm n LYS 14 Ca 0.00 0.00 -0.34 0.00 -0.51 0.00 0.00 58.31 57.46 1pfm n LYS 14 Cb 0.00 0.00 -0.11 0.00 -0.51 0.00 0.00 35.03 34.41 1pfm n LYS 14 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1pfm s THR 15 N -0.43 3.99 -0.89 -0.18 2.01 -1.26 -4.96 115.64 113.91 1pfm s THR 15 Ca 0.00 -0.35 -0.04 0.00 0.31 0.00 0.00 61.69 61.61 1pfm s THR 15 Cb 0.00 -2.70 0.10 0.00 0.01 0.00 0.00 72.50 69.92 1pfm s THR 15 CO 0.00 0.55 2.54 0.41 -0.69 0.00 0.00 174.62 177.44 1pfm n THR 16 N 2.78 4.34 0.97 -0.82 -1.04 -0.14 -4.61 114.28 115.77 1pfm n THR 16 Ca -0.18 -3.76 0.10 0.00 -2.04 0.00 0.00 64.05 58.17 1pfm n THR 16 Cb 0.53 -1.81 0.51 0.00 -1.82 0.00 0.00 70.33 67.73 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 1.21 0.00 0.18 8.00 3.41 -1.25 -3.33 113.62 121.84 1pfm n SER 17 Ca 0.55 -0.07 0.18 0.00 -0.26 0.00 0.00 58.87 59.28 1pfm n SER 17 Cb 0.39 -0.25 0.79 0.00 -0.26 0.00 0.00 64.21 64.88 1pfm n SER 17 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1pfm h GLN 18 N 0.00 0.00 -6.43 4.33 5.75 -1.91 -3.40 115.11 113.45 1pfm h GLN 18 Ca 0.00 0.00 -0.54 0.00 -0.15 0.00 0.00 58.65 57.96 1pfm h GLN 18 Cb 0.16 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.68 1pfm h GLN 18 CO 0.00 0.00 -0.09 0.08 -2.65 0.00 0.00 178.83 176.17 1pfm s VAL 19 N -4.47 4.89 0.03 2.39 1.01 -1.21 -5.08 120.40 117.95 1pfm s VAL 19 Ca -0.04 0.62 0.01 0.00 0.00 0.00 0.00 61.98 62.58 1pfm s VAL 19 Cb 0.14 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1pfm s VAL 19 CO 0.47 0.01 0.05 -0.13 0.00 0.00 0.00 175.10 175.50 1pfm s ARG 20 N -2.58 2.90 -0.18 2.72 0.52 -1.26 -5.07 118.95 115.99 1pfm s ARG 20 Ca 0.45 -0.61 -0.29 0.00 -0.52 0.00 0.00 55.73 54.76 1pfm s ARG 20 Cb -0.12 -2.75 0.00 0.00 0.52 0.00 0.00 34.95 32.60 1pfm s ARG 20 CO 0.20 0.61 1.04 -1.25 0.02 0.00 0.00 175.30 175.93 1pfm s PRO 21 N -1.92 4.31 0.12 3.54 0.04 -1.26 -4.66 135.00 135.17 1pfm s PRO 21 Ca 0.24 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.67 1pfm s PRO 21 Cb -0.12 -3.61 0.00 0.00 0.04 0.00 0.00 34.50 30.81 1pfm s PRO 21 CO 0.16 -0.53 0.00 0.54 0.04 0.00 0.00 177.00 177.21 1pfm n ARG 22 N 5.87 0.00 -0.89 4.56 1.74 -1.26 -4.93 116.66 121.75 1pfm n ARG 22 Ca 0.11 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.08 1pfm n ARG 22 Cb 0.47 0.00 0.21 0.00 -1.02 0.00 0.00 32.46 32.11 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 -2.70 2.18 -0.69 -1.55 8.25 -1.26 -4.97 115.22 114.48 1pfm n HIS 23 Ca 0.00 -1.23 -0.28 0.00 -0.26 0.00 0.00 57.72 55.95 1pfm n HIS 23 Cb 0.00 -0.68 0.24 0.00 1.12 0.00 0.00 29.99 30.67 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 -2.55 2.03 0.00 1.59 1.10 -1.26 -1.07 121.20 121.04 1pfm s ILE 24 Ca 0.45 0.01 0.00 0.00 -0.51 0.00 0.00 60.65 60.60 1pfm s ILE 24 Cb 0.36 -2.17 0.00 0.00 0.15 0.00 0.00 42.46 40.81 1pfm s ILE 24 CO 0.10 -0.01 0.00 0.35 -2.11 0.00 0.00 174.94 173.27 1pfm n THR 25 N -4.76 0.00 -3.45 4.00 -2.24 -0.79 -4.56 114.28 102.48 1pfm n THR 25 Ca 0.03 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.70 1pfm n THR 25 Cb 0.55 -0.51 -0.02 0.00 -2.10 0.00 0.00 70.33 68.25 1pfm n THR 25 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1pfm s SER 26 N -4.23 -0.52 -0.07 3.42 0.01 -1.19 -5.04 113.70 106.07 1pfm s SER 26 Ca 0.00 0.05 -0.13 0.00 1.31 0.00 0.00 55.95 57.18 1pfm s SER 26 Cb 0.00 0.54 0.03 0.00 0.21 0.00 0.00 66.02 66.80 1pfm s SER 26 CO 0.00 -0.86 0.32 -0.22 0.41 0.00 0.00 173.24 172.89 1pfm s LEU 27 N -2.56 0.79 0.41 2.44 0.20 -1.26 0.07 118.68 118.77 1pfm s LEU 27 Ca 0.01 0.38 0.02 0.00 0.69 0.00 0.00 54.13 55.23 1pfm s LEU 27 Cb -0.01 1.20 -0.01 0.00 -0.43 0.00 0.00 46.19 46.94 1pfm s LEU 27 CO -0.10 -0.28 0.60 -1.61 -0.29 0.00 0.00 176.35 174.67 1pfm s GLU 28 N -0.56 3.13 -0.32 1.98 2.02 0.53 -4.93 118.70 120.55 1pfm s GLU 28 Ca -0.07 -0.59 0.05 0.00 0.02 0.00 0.00 54.97 54.38 1pfm s GLU 28 Cb -0.04 -2.64 0.18 0.00 0.10 0.00 0.00 34.13 31.74 1pfm s GLU 28 CO 0.02 -0.13 0.52 0.08 0.02 0.00 0.00 175.26 175.77 1pfm s VAL 29 N -2.43 -0.83 0.20 2.63 1.01 -1.26 -1.72 120.40 118.00 1pfm s VAL 29 Ca 0.46 -0.18 -0.02 0.00 0.00 0.00 0.00 61.98 62.25 1pfm s VAL 29 Cb -0.10 -0.77 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 1pfm s VAL 29 CO 0.36 -0.14 0.40 0.27 0.00 0.00 0.00 175.10 175.99 1pfm s ILE 30 N 2.43 5.19 0.25 2.22 -4.36 0.71 -4.94 121.20 122.70 1pfm s ILE 30 Ca 0.12 -0.28 -0.04 0.00 -0.26 0.00 0.00 60.65 60.18 1pfm s ILE 30 Cb -0.10 -3.72 0.06 0.00 1.25 0.00 0.00 42.46 39.95 1pfm s ILE 30 CO -0.22 -0.16 0.34 1.17 0.24 0.00 0.00 174.94 176.32 1pfm n LYS 31 N -0.59 -0.35 -2.48 0.37 4.81 -1.26 -2.08 118.16 116.58 1pfm n LYS 31 Ca -0.04 -0.53 -0.39 0.00 -0.87 0.00 0.00 58.31 56.48 1pfm n LYS 31 Cb 0.54 -0.35 -0.03 0.00 0.02 0.00 0.00 35.03 35.20 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 -3.98 2.56 1.00 3.14 0.00 -1.24 -4.04 121.76 119.20 1pfm s ALA 32 Ca 0.19 -2.00 0.00 0.00 0.00 0.00 0.00 51.96 50.16 1pfm s ALA 32 Cb -0.01 -4.49 0.00 0.00 0.00 0.00 0.00 23.12 18.62 1pfm s ALA 32 CO 0.14 -3.74 0.00 0.41 0.00 0.00 0.00 175.76 172.56 1pfm n GLY 33 N 6.65 -1.92 0.07 0.00 0.00 0.45 -4.57 105.19 105.87 1pfm n GLY 33 Ca 0.30 -1.47 -0.02 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 -0.11 -0.25 1.61 0.13 -1.96 -1.82 132.00 129.60 1pfm h PRO 34 Ca 0.00 0.01 0.07 0.00 -0.87 0.00 0.00 66.00 65.21 1pfm h PRO 34 Cb 0.00 0.03 -0.01 0.00 0.13 0.00 0.00 31.00 31.15 1pfm h PRO 34 CO 0.00 -0.07 0.38 1.12 -0.23 0.00 0.00 178.00 179.19 1pfm h HIS 35 N -0.50 0.00 -2.71 1.56 2.07 -1.93 -3.01 115.15 110.62 1pfm h HIS 35 Ca -0.01 0.00 -0.60 0.00 -2.85 0.00 0.00 60.37 56.90 1pfm h HIS 35 Cb 0.09 0.00 -0.40 0.00 2.57 0.00 0.00 27.41 29.67 1pfm h HIS 35 CO 0.02 0.00 -0.80 0.00 -3.07 0.00 0.00 177.93 174.08 1pfm n PRO 37 N 2.69 0.04 -3.26 0.00 -0.04 -0.69 0.17 135.00 133.91 1pfm n PRO 37 Ca 0.23 0.31 -0.25 0.00 -0.04 0.00 0.00 63.50 63.75 1pfm n PRO 37 Cb 0.41 -1.59 -0.01 0.00 -0.04 0.00 0.00 33.50 32.27 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 -3.08 5.07 0.15 0.52 -1.32 -1.26 -4.63 115.64 111.10 1pfm s THR 38 Ca 0.06 -0.34 -0.31 0.00 -1.21 0.00 0.00 61.69 59.89 1pfm s THR 38 Cb 0.09 -3.86 -0.09 0.00 -1.51 0.00 0.00 72.50 67.13 1pfm s THR 38 CO 0.27 -0.59 1.40 0.00 -2.21 0.00 0.00 174.62 173.49 1pfm s ALA 39 N -2.37 3.61 0.04 11.08 0.00 -1.26 -3.64 121.76 129.21 1pfm s ALA 39 Ca 0.41 1.17 0.06 0.00 0.00 0.00 0.00 51.96 53.61 1pfm s ALA 39 Cb -0.10 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.46 1pfm s ALA 39 CO 0.37 -0.63 -0.18 -1.14 0.00 0.00 0.00 175.76 174.18 1pfm s GLN 40 N 0.75 1.21 -0.14 0.00 -0.44 -0.88 -4.88 119.66 115.27 1pfm s GLN 40 Ca 0.63 -0.87 -0.09 0.00 -2.50 0.00 0.00 55.36 52.53 1pfm s GLN 40 Cb -0.38 -1.29 0.05 0.00 -1.64 0.00 0.00 33.01 29.74 1pfm s GLN 40 CO 0.33 0.33 0.35 -0.48 0.50 0.00 0.00 175.29 176.32 1pfm s LEU 41 N -1.16 0.25 0.44 3.68 2.34 -1.26 -0.21 118.68 122.75 1pfm s LEU 41 Ca 0.05 0.74 0.07 0.00 0.06 0.00 0.00 54.13 55.06 1pfm s LEU 41 Cb -0.08 1.15 -0.02 0.00 -0.56 0.00 0.00 46.19 46.67 1pfm s LEU 41 CO 0.02 -0.17 0.33 -0.63 -1.06 0.00 0.00 176.35 174.84 1pfm s ILE 42 N 1.03 2.38 0.32 1.48 -1.09 -0.70 -2.60 121.20 122.03 1pfm s ILE 42 Ca -0.07 -1.47 0.01 0.00 -2.23 0.00 0.00 60.65 56.90 1pfm s ILE 42 Cb -0.07 -2.85 -0.01 0.00 -1.58 0.00 0.00 42.46 37.94 1pfm s ILE 42 CO -0.08 0.00 0.37 0.00 -1.23 0.00 0.00 174.94 174.00 1pfm s ALA 43 N -2.56 1.20 -0.07 9.38 0.00 -0.84 -0.35 121.76 128.53 1pfm s ALA 43 Ca 0.44 -1.73 -0.05 0.00 0.00 0.00 0.00 51.96 50.61 1pfm s ALA 43 Cb -0.01 1.30 0.02 0.00 0.00 0.00 0.00 23.12 24.43 1pfm s ALA 43 CO 0.25 -0.73 0.17 0.99 0.00 0.00 0.00 175.76 176.45 1pfm s THR 44 N -3.33 -0.01 0.09 0.00 2.01 0.11 -2.97 115.64 111.54 1pfm s THR 44 Ca 0.35 0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.40 1pfm s THR 44 Cb 0.01 -0.25 0.01 0.00 0.01 0.00 0.00 72.50 72.28 1pfm s THR 44 CO 0.22 0.01 0.11 0.18 -0.69 0.00 0.00 174.62 174.45 1pfm n LEU 45 N 3.22 0.00 0.06 4.42 4.32 -1.06 -1.88 117.00 126.08 1pfm n LEU 45 Ca -0.15 -0.44 -0.08 0.00 -0.02 0.00 0.00 56.01 55.32 1pfm n LEU 45 Cb 0.58 -0.04 0.06 0.00 -1.62 0.00 0.00 43.42 42.39 1pfm n LEU 45 CO 0.20 -0.44 0.40 0.07 -1.22 0.00 0.00 177.39 176.39 1pfm h LYS 46 N 0.00 0.34 -5.53 3.23 5.09 -1.34 -3.30 116.57 115.06 1pfm h LYS 46 Ca -0.05 -0.27 -0.65 0.00 0.09 0.00 0.00 60.65 59.78 1pfm h LYS 46 Cb 0.21 0.05 -0.14 0.00 0.10 0.00 0.00 32.23 32.45 1pfm h LYS 46 CO 0.07 0.90 1.09 -0.80 -2.09 0.00 0.00 179.45 178.63 1pfm s ASN 47 N -6.94 6.53 -0.03 7.07 0.01 -1.26 -4.84 114.94 115.49 1pfm s ASN 47 Ca -0.05 -1.69 -0.00 0.00 -0.71 0.00 0.00 52.86 50.41 1pfm s ASN 47 Cb 0.11 -2.47 -0.01 0.00 0.41 0.00 0.00 41.25 39.29 1pfm s ASN 47 CO 0.82 -1.29 0.61 0.61 -1.51 0.00 0.00 177.10 176.34 1pfm n GLY 48 N 6.05 -0.01 3.31 0.66 0.00 -1.24 -4.76 105.19 109.19 1pfm n GLY 48 Ca 0.25 -0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.09 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 2.94 1.56 -0.10 1.61 1.70 -1.26 -4.97 118.95 120.43 1pfm s ARG 49 Ca 0.03 -1.89 -0.04 0.00 -0.47 0.00 0.00 55.73 53.37 1pfm s ARG 49 Cb -0.02 0.02 0.05 0.00 -0.57 0.00 0.00 34.95 34.43 1pfm s ARG 49 CO 0.01 -0.47 0.22 0.15 -1.08 0.00 0.00 175.30 174.13 1pfm s LYS 50 N -3.81 0.13 0.00 3.89 3.01 -1.26 -2.57 119.74 119.12 1pfm s LYS 50 Ca 0.37 0.59 0.00 0.00 -1.01 0.00 0.00 55.97 55.91 1pfm s LYS 50 Cb 0.05 -0.14 0.00 0.00 -1.01 0.00 0.00 37.83 36.73 1pfm s LYS 50 CO 0.18 -0.24 0.00 0.44 0.51 0.00 0.00 175.35 176.25 1pfm n ILE 51 N 4.85 0.00 -3.62 2.17 -6.64 -1.16 -4.85 119.36 110.11 1pfm n ILE 51 Ca -0.14 0.00 -0.06 0.00 -1.77 0.00 0.00 62.75 60.78 1pfm n ILE 51 Cb 0.51 0.00 -0.05 0.00 -1.44 0.00 0.00 39.64 38.66 1pfm n ILE 51 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1pfm n LEU 53 N 0.78 0.00 -5.00 0.00 4.77 -1.07 -0.97 117.00 115.51 1pfm n LEU 53 Ca -0.05 -1.77 -0.22 0.00 -0.03 0.00 0.00 56.01 53.93 1pfm n LEU 53 Cb 0.58 0.56 0.04 0.00 -2.33 0.00 0.00 43.42 42.28 1pfm n LEU 53 CO 0.10 -0.27 0.27 1.51 -1.33 0.00 0.00 177.39 177.66 1pfm s ASP 54 N -2.43 4.92 0.00 -1.43 1.47 -1.26 -4.25 116.67 113.69 1pfm s ASP 54 Ca 0.11 -1.00 0.00 0.00 1.18 0.00 0.00 52.55 52.84 1pfm s ASP 54 Cb 0.01 0.41 0.00 0.00 -0.34 0.00 0.00 42.92 43.00 1pfm s ASP 54 CO 0.08 -1.31 0.16 -0.11 0.68 0.00 0.00 175.17 174.67 1pfm n LEU 55 N -2.12 0.33 0.07 2.11 7.94 -1.26 -4.60 117.00 119.46 1pfm n LEU 55 Ca 0.11 -0.61 0.11 0.00 -1.11 0.00 0.00 56.01 54.51 1pfm n LEU 55 Cb 0.63 0.00 -0.01 0.00 0.53 0.00 0.00 43.42 44.57 1pfm n LEU 55 CO 0.39 0.08 -0.07 0.00 -1.11 0.00 0.00 177.39 176.69 1pfm n GLN 56 N -0.57 0.52 -3.45 1.96 6.02 -1.26 -4.91 117.38 115.69 1pfm n GLN 56 Ca 0.00 0.05 -0.25 0.00 -0.01 0.00 0.00 57.00 56.79 1pfm n GLN 56 Cb 0.01 -1.72 -0.02 0.00 1.02 0.00 0.00 30.24 29.53 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 -3.34 3.72 -1.72 -1.58 0.00 -1.26 -4.98 121.76 112.61 1pfm s ALA 57 Ca -0.00 -0.88 0.30 0.00 0.00 0.00 0.00 51.96 51.39 1pfm s ALA 57 Cb 0.11 -2.09 1.68 0.00 0.00 0.00 0.00 23.12 22.83 1pfm s ALA 57 CO 0.80 0.09 2.11 -0.35 0.00 0.00 0.00 175.76 178.41 1pfm n PRO 58 N -1.51 0.70 0.11 0.00 -0.04 -1.26 -3.90 135.00 129.10 1pfm n PRO 58 Ca -0.05 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.28 1pfm n PRO 58 Cb 0.56 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.44 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 -0.16 -1.37 1.53 5.85 -1.93 -1.15 115.31 118.07 1pfm h LEU 59 Ca 0.00 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1pfm h LEU 59 Cb 0.14 0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.21 1pfm h LEU 59 CO 0.00 -0.11 0.00 0.10 -0.34 0.00 0.00 178.44 178.09 1pfm h TYR 60 N -0.20 0.00 0.00 1.25 -0.00 -1.81 -1.76 116.97 114.45 1pfm h TYR 60 Ca -0.02 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.69 1pfm h TYR 60 Cb 0.16 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.88 1pfm h TYR 60 CO -0.07 0.00 -0.10 -0.22 -0.00 0.00 0.00 178.16 177.78 1pfm h LYS 61 N 0.00 0.00 0.00 0.10 3.64 -1.39 0.54 116.57 119.45 1pfm h LYS 61 Ca 0.00 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.23 1pfm h LYS 61 Cb 0.51 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1pfm h LYS 61 CO 0.00 0.10 -0.71 0.87 -2.27 0.00 0.00 179.45 177.43 1pfm h LYS 62 N 0.00 0.00 0.41 1.90 1.79 -0.87 -1.37 116.57 118.43 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 0.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.08 1pfm h LYS 62 CO 0.01 0.71 -0.20 0.82 -1.08 0.00 0.00 179.45 179.72 1pfm h ILE 63 N 0.00 0.25 -0.99 1.86 2.04 -0.95 -1.02 117.51 118.71 1pfm h ILE 63 Ca -0.01 -0.64 0.05 0.00 1.00 0.00 0.00 64.86 65.27 1pfm h ILE 63 Cb 1.37 0.40 -0.06 0.00 -0.74 0.00 0.00 36.82 37.79 1pfm h ILE 63 CO 0.09 0.06 0.64 0.40 0.00 0.00 0.00 178.15 179.34 1pfm h ILE 64 N -1.06 1.13 -0.34 -0.67 2.04 -1.37 0.13 117.51 117.37 1pfm h ILE 64 Ca -0.06 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.37 1pfm h ILE 64 Cb 0.51 -0.18 -0.02 0.00 -0.74 0.00 0.00 36.82 36.40 1pfm h ILE 64 CO 0.09 0.22 0.12 0.11 0.00 0.00 0.00 178.15 178.70 1pfm h LYS 65 N 1.20 0.49 0.00 2.37 1.79 -1.25 0.33 116.57 121.50 1pfm h LYS 65 Ca 0.41 -0.06 -0.08 0.00 -2.18 0.00 0.00 60.65 58.74 1pfm h LYS 65 Cb 0.09 -0.09 -0.01 0.00 -1.58 0.00 0.00 32.23 30.63 1pfm h LYS 65 CO -0.14 0.42 -0.37 0.87 -1.08 0.00 0.00 179.45 179.15 1pfm h LYS 66 N 0.49 0.00 0.00 3.15 1.57 0.61 -2.11 116.57 120.28 1pfm h LYS 66 Ca 0.12 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.80 1pfm h LYS 66 Cb 0.12 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1pfm h LYS 66 CO -0.01 0.37 -0.48 -0.07 -0.57 0.00 0.00 179.45 178.68 1pfm h LEU 67 N 0.00 0.00 0.19 2.94 3.38 0.23 -3.28 115.31 118.76 1pfm h LEU 67 Ca -0.00 0.00 -0.28 0.00 0.09 0.00 0.00 57.88 57.68 1pfm h LEU 67 Cb 0.85 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.64 1pfm h LEU 67 CO 0.05 0.48 -1.22 -0.07 0.09 0.00 0.00 178.44 177.77 1pfm h LEU 68 N 0.00 0.75 -1.70 1.67 3.38 -0.83 -3.22 115.31 115.35 1pfm h LEU 68 Ca -0.00 -0.90 0.19 0.00 0.09 0.00 0.00 57.88 57.25 1pfm h LEU 68 Cb 1.34 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.82 1pfm h LEU 68 CO 0.06 1.59 0.71 1.05 0.09 0.00 0.00 178.44 181.94 1pfm h GLU 69 N 0.03 0.00 -0.02 1.13 -0.00 -1.45 -3.52 114.58 110.75 1pfm h GLU 69 Ca -0.21 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.15 1pfm h GLU 69 Cb 1.94 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.69 1pfm h GLU 69 CO 0.23 0.00 0.00 -1.13 -0.00 0.00 0.00 179.01 178.11