#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 6.09 -0.19 7.83 0.01 -1.26 -5.05 113.70 121.13 1pfm s SER 4 Ca 0.00 2.03 -0.27 0.00 1.31 0.00 0.00 55.95 59.01 1pfm s SER 4 Cb 0.00 -2.57 0.07 0.00 0.21 0.00 0.00 66.02 63.73 1pfm s SER 4 CO 0.00 -0.96 0.71 0.00 0.41 0.00 0.00 173.24 173.40 1pfm s ALA 5 N -1.90 -1.78 0.00 1.44 0.00 -1.26 -5.08 121.76 113.18 1pfm s ALA 5 Ca 0.69 1.78 0.00 0.00 0.00 0.00 0.00 51.96 54.43 1pfm s ALA 5 Cb -0.19 -0.77 0.00 0.00 0.00 0.00 0.00 23.12 22.16 1pfm s ALA 5 CO 0.23 -0.35 0.00 1.63 0.00 0.00 0.00 175.76 177.27 1pfm n LYS 6 N 2.06 -0.27 -1.55 0.00 5.02 -1.26 -5.07 118.16 117.10 1pfm n LYS 6 Ca -0.16 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 55.76 1pfm n LYS 6 Cb 0.56 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.53 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 0.00 1.10 0.00 1.97 1.02 -1.26 -4.75 120.64 118.73 1pfm n GLU 7 Ca 0.00 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1pfm n GLU 7 Cb 0.00 -3.37 0.00 0.00 -0.02 0.00 0.00 31.44 28.05 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 15.34 0.00 -0.83 -4.62 0.00 -1.25 -4.99 117.00 120.64 1pfm n LEU 8 Ca 0.37 0.00 -0.05 0.00 0.00 0.00 0.00 56.01 56.33 1pfm n LEU 8 Cb 0.52 -0.27 -0.05 0.00 0.00 0.00 0.00 43.42 43.62 1pfm n LEU 8 CO 0.71 -0.39 0.26 0.54 0.00 0.00 0.00 177.39 178.51 1pfm n ARG 9 N -2.25 0.00 -2.78 1.96 5.12 -0.82 -5.03 116.66 112.86 1pfm n ARG 9 Ca 0.00 -0.68 -0.36 0.00 -1.93 0.00 0.00 57.85 54.87 1pfm n ARG 9 Cb 0.00 0.44 -0.06 0.00 -1.16 0.00 0.00 32.46 31.68 1pfm n ARG 9 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1pfm n GLN 11 N 0.36 0.61 -3.16 0.00 -0.06 -1.26 -4.42 117.38 109.45 1pfm n GLN 11 Ca 0.03 0.16 -0.23 0.00 -2.00 0.00 0.00 57.00 54.96 1pfm n GLN 11 Cb 0.51 -1.82 -0.05 0.00 -4.06 0.00 0.00 30.24 24.82 1pfm n GLN 11 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1pfm h VAL 13 N 2.08 1.27 -1.02 0.00 3.04 -1.93 -3.44 116.25 116.25 1pfm h VAL 13 Ca 0.12 -1.24 0.00 0.00 -1.01 0.00 0.00 66.70 64.57 1pfm h VAL 13 Cb 0.77 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 31.12 1pfm h VAL 13 CO 0.63 0.43 0.00 1.17 -1.01 0.00 0.00 177.57 178.79 1pfm n LYS 14 N -4.22 2.49 -4.60 4.17 3.00 -1.26 -4.99 118.16 112.76 1pfm n LYS 14 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.06 1pfm n LYS 14 Cb 0.39 0.00 -0.17 0.00 0.00 0.00 0.00 35.03 35.25 1pfm n LYS 14 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1pfm s THR 15 N 0.84 1.22 -1.28 3.15 2.01 -1.26 -4.89 115.64 115.43 1pfm s THR 15 Ca 0.00 -0.52 -0.05 0.00 0.31 0.00 0.00 61.69 61.43 1pfm s THR 15 Cb 0.00 -1.12 0.15 0.00 0.01 0.00 0.00 72.50 71.54 1pfm s THR 15 CO 0.00 0.38 2.30 0.41 -0.69 0.00 0.00 174.62 177.01 1pfm n THR 16 N 3.86 5.33 0.69 -0.82 -1.04 -0.33 -4.66 114.28 117.32 1pfm n THR 16 Ca -0.22 -4.54 0.08 0.00 -2.04 0.00 0.00 64.05 57.33 1pfm n THR 16 Cb 0.52 -2.02 0.38 0.00 -1.82 0.00 0.00 70.33 67.39 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 1.56 0.00 0.12 8.00 7.64 -1.26 -3.16 113.62 126.52 1pfm n SER 17 Ca 0.60 0.20 0.20 0.00 1.01 0.00 0.00 58.87 60.87 1pfm n SER 17 Cb 0.25 -0.35 0.71 0.00 -1.01 0.00 0.00 64.21 63.81 1pfm n SER 17 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1pfm h GLN 18 N 0.00 0.00 -7.28 1.43 7.50 -1.91 -3.40 115.11 111.45 1pfm h GLN 18 Ca 0.00 0.00 -0.51 0.00 0.50 0.00 0.00 58.65 58.64 1pfm h GLN 18 Cb 0.19 0.00 0.10 0.00 0.05 0.00 0.00 27.48 27.82 1pfm h GLN 18 CO 0.00 0.00 0.36 0.54 -1.50 0.00 0.00 178.83 178.23 1pfm s VAL 19 N -4.48 3.70 -0.13 -0.54 0.11 -1.19 -5.04 120.40 112.83 1pfm s VAL 19 Ca -0.04 0.64 -0.01 0.00 -2.93 0.00 0.00 61.98 59.64 1pfm s VAL 19 Cb 0.14 -3.23 -0.02 0.00 -1.53 0.00 0.00 36.38 31.73 1pfm s VAL 19 CO 0.47 -0.64 -0.10 -0.13 -3.33 0.00 0.00 175.10 171.38 1pfm s ARG 20 N -4.67 3.40 -0.40 1.54 0.52 -1.26 -5.07 118.95 113.01 1pfm s ARG 20 Ca 0.61 -0.62 -0.29 0.00 -0.52 0.00 0.00 55.73 54.91 1pfm s ARG 20 Cb -0.16 -2.71 0.02 0.00 0.52 0.00 0.00 34.95 32.62 1pfm s ARG 20 CO 0.49 0.28 1.15 -1.25 0.02 0.00 0.00 175.30 175.99 1pfm s PRO 21 N 0.22 3.86 0.03 3.54 0.04 -1.26 -4.55 135.00 136.88 1pfm s PRO 21 Ca -0.06 0.84 0.00 0.00 0.04 0.00 0.00 61.00 61.82 1pfm s PRO 21 Cb -0.15 -3.85 0.00 0.00 0.04 0.00 0.00 34.50 30.54 1pfm s PRO 21 CO 0.04 -1.19 0.00 -2.13 0.04 0.00 0.00 177.00 173.76 1pfm n ARG 22 N 7.45 0.00 -1.20 4.56 0.63 -1.26 -4.95 116.66 121.88 1pfm n ARG 22 Ca 0.13 0.00 -0.25 0.00 -0.92 0.00 0.00 57.85 56.80 1pfm n ARG 22 Cb 0.48 0.00 0.03 0.00 0.45 0.00 0.00 32.46 33.42 1pfm n ARG 22 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 1pfm n HIS 23 N -2.07 2.12 -1.34 -0.14 1.44 -1.26 -4.96 115.22 109.00 1pfm n HIS 23 Ca 0.00 -2.28 -0.29 0.00 -2.01 0.00 0.00 57.72 53.14 1pfm n HIS 23 Cb 0.00 -1.19 0.15 0.00 0.12 0.00 0.00 29.99 29.07 1pfm n HIS 23 CO 0.00 0.00 0.00 -1.50 -2.81 0.00 0.00 176.34 172.03 1pfm s ILE 24 N -3.18 2.12 0.00 0.61 1.10 -1.26 -1.85 121.20 118.73 1pfm s ILE 24 Ca 0.47 0.04 0.00 0.00 -0.51 0.00 0.00 60.65 60.65 1pfm s ILE 24 Cb 0.36 -2.65 0.00 0.00 0.15 0.00 0.00 42.46 40.31 1pfm s ILE 24 CO -0.08 -0.05 0.00 1.07 -2.11 0.00 0.00 174.94 173.77 1pfm n THR 25 N -3.96 0.00 -3.53 4.00 5.66 -0.83 -4.56 114.28 111.06 1pfm n THR 25 Ca 0.06 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.96 1pfm n THR 25 Cb 0.58 -0.60 -0.03 0.00 -1.55 0.00 0.00 70.33 68.73 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 -4.19 -0.39 -0.07 1.09 0.01 -1.17 -5.04 113.70 103.93 1pfm s SER 26 Ca 0.00 0.19 -0.09 0.00 1.31 0.00 0.00 55.95 57.36 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 -0.52 0.24 -1.48 0.41 0.00 0.00 173.24 171.89 1pfm s LEU 27 N -1.90 1.08 0.36 2.44 0.05 -1.26 0.66 118.68 120.11 1pfm s LEU 27 Ca 0.01 0.37 -0.02 0.00 0.05 0.00 0.00 54.13 54.54 1pfm s LEU 27 Cb -0.01 0.89 -0.04 0.00 -2.05 0.00 0.00 46.19 44.98 1pfm s LEU 27 CO -0.04 -0.16 0.60 -1.61 -0.55 0.00 0.00 176.35 174.59 1pfm s GLU 28 N -0.22 3.54 -0.31 1.48 2.02 0.92 -4.92 118.70 121.21 1pfm s GLU 28 Ca -0.03 -0.13 -0.01 0.00 0.02 0.00 0.00 54.97 54.82 1pfm s GLU 28 Cb -0.03 -2.60 0.13 0.00 0.10 0.00 0.00 34.13 31.73 1pfm s GLU 28 CO 0.01 0.09 0.23 0.08 0.02 0.00 0.00 175.26 175.70 1pfm s VAL 29 N -2.34 -0.17 0.18 2.63 1.01 -1.26 -1.01 120.40 119.43 1pfm s VAL 29 Ca 0.43 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 61.42 1pfm s VAL 29 Cb -0.10 -0.96 -0.06 0.00 0.00 0.00 0.00 36.38 35.25 1pfm s VAL 29 CO 0.36 -0.68 0.47 -0.63 0.00 0.00 0.00 175.10 174.62 1pfm s ILE 30 N 1.87 5.04 0.13 2.22 -1.09 0.11 -4.94 121.20 124.54 1pfm s ILE 30 Ca 0.12 0.32 -0.02 0.00 -2.23 0.00 0.00 60.65 58.84 1pfm s ILE 30 Cb -0.17 -3.63 0.03 0.00 -1.58 0.00 0.00 42.46 37.12 1pfm s ILE 30 CO -0.23 0.02 0.18 1.17 -1.23 0.00 0.00 174.94 174.86 1pfm n LYS 31 N 0.10 0.09 -2.46 2.79 4.81 -1.26 -1.83 118.16 120.40 1pfm n LYS 31 Ca -0.02 -0.36 -0.40 0.00 -0.87 0.00 0.00 58.31 56.66 1pfm n LYS 31 Cb 0.52 -0.17 -0.03 0.00 0.02 0.00 0.00 35.03 35.37 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 -3.51 2.62 1.00 3.14 0.00 -1.24 -3.85 121.76 119.91 1pfm s ALA 32 Ca 0.11 -1.49 0.00 0.00 0.00 0.00 0.00 51.96 50.58 1pfm s ALA 32 Cb -0.00 -4.34 0.00 0.00 0.00 0.00 0.00 23.12 18.78 1pfm s ALA 32 CO 0.08 -3.51 0.00 0.41 0.00 0.00 0.00 175.76 172.73 1pfm n GLY 33 N 5.83 -1.33 0.04 0.00 0.00 0.52 -4.65 105.19 105.59 1pfm n GLY 33 Ca 0.14 -1.54 -0.01 0.00 0.00 0.00 0.00 46.02 44.60 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 -0.07 -0.82 1.61 0.13 -1.96 -2.62 132.00 128.28 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 0.02 -0.06 0.00 0.13 0.00 0.00 31.00 31.09 1pfm h PRO 34 CO 0.00 -0.04 0.55 1.12 -0.23 0.00 0.00 178.00 179.39 1pfm h HIS 35 N -0.27 0.46 -3.29 1.56 2.07 -1.95 -3.08 115.15 110.65 1pfm h HIS 35 Ca -0.01 0.01 -0.66 0.00 -2.85 0.00 0.00 60.37 56.86 1pfm h HIS 35 Cb 0.05 -0.14 -0.39 0.00 2.57 0.00 0.00 27.41 29.50 1pfm h HIS 35 CO 0.03 0.15 -0.39 0.00 -3.07 0.00 0.00 177.93 174.65 1pfm n PRO 37 N 2.51 0.16 -3.18 0.00 -0.04 -0.99 0.19 135.00 133.66 1pfm n PRO 37 Ca 0.16 0.38 -0.25 0.00 -0.04 0.00 0.00 63.50 63.74 1pfm n PRO 37 Cb 0.36 -1.79 -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 5.05 0.33 0.52 -1.32 -1.26 -4.64 115.64 111.08 1pfm s THR 38 Ca 0.05 -0.24 -0.29 0.00 -1.21 0.00 0.00 61.69 60.00 1pfm s THR 38 Cb 0.10 -3.85 -0.11 0.00 -1.51 0.00 0.00 72.50 67.13 1pfm s THR 38 CO 0.37 -0.61 1.43 0.00 -2.21 0.00 0.00 174.62 173.60 1pfm s ALA 39 N -2.41 3.57 -0.07 11.08 0.00 -1.26 -3.67 121.76 129.00 1pfm s ALA 39 Ca 0.42 1.42 -0.01 0.00 0.00 0.00 0.00 51.96 53.79 1pfm s ALA 39 Cb -0.10 -3.56 0.03 0.00 0.00 0.00 0.00 23.12 19.49 1pfm s ALA 39 CO 0.38 -0.85 0.00 -1.14 0.00 0.00 0.00 175.76 174.15 1pfm s GLN 40 N -1.53 0.59 -0.04 0.00 -0.44 -0.76 -4.88 119.66 112.60 1pfm s GLN 40 Ca 0.54 0.11 0.04 0.00 -2.50 0.00 0.00 55.36 53.55 1pfm s GLN 40 Cb -0.43 -0.96 -0.00 0.00 -1.64 0.00 0.00 33.01 29.97 1pfm s GLN 40 CO 0.55 -0.30 -0.16 -0.48 0.50 0.00 0.00 175.29 175.39 1pfm s LEU 41 N 1.98 1.92 0.42 3.68 2.34 -1.26 0.07 118.68 127.82 1pfm s LEU 41 Ca 0.05 -0.32 0.07 0.00 0.06 0.00 0.00 54.13 53.99 1pfm s LEU 41 Cb -0.12 -0.90 -0.03 0.00 -0.56 0.00 0.00 46.19 44.58 1pfm s LEU 41 CO -0.05 0.15 0.32 -0.63 -1.06 0.00 0.00 176.35 175.08 1pfm s ILE 42 N -0.01 2.52 0.30 1.48 -1.09 -0.18 -2.58 121.20 121.64 1pfm s ILE 42 Ca -0.02 -1.45 0.02 0.00 -2.23 0.00 0.00 60.65 56.97 1pfm s ILE 42 Cb -0.10 -2.97 -0.02 0.00 -1.58 0.00 0.00 42.46 37.78 1pfm s ILE 42 CO 0.01 0.00 0.29 0.00 -1.23 0.00 0.00 174.94 174.02 1pfm s ALA 43 N -2.52 1.37 -0.05 9.38 0.00 -0.89 -0.05 121.76 129.00 1pfm s ALA 43 Ca 0.46 -1.82 -0.04 0.00 0.00 0.00 0.00 51.96 50.56 1pfm s ALA 43 Cb -0.01 1.37 0.02 0.00 0.00 0.00 0.00 23.12 24.50 1pfm s ALA 43 CO 0.26 -0.68 0.13 0.99 0.00 0.00 0.00 175.76 176.46 1pfm s THR 44 N -3.56 -0.01 0.11 0.00 2.01 0.21 -2.87 115.64 111.53 1pfm s THR 44 Ca 0.37 0.03 0.02 0.00 0.31 0.00 0.00 61.69 62.42 1pfm s THR 44 Cb 0.03 -0.20 0.02 0.00 0.01 0.00 0.00 72.50 72.36 1pfm s THR 44 CO 0.22 0.01 0.14 0.18 -0.69 0.00 0.00 174.62 174.48 1pfm n LEU 45 N 3.19 0.00 0.10 4.42 7.99 -1.07 -1.97 117.00 129.66 1pfm n LEU 45 Ca -0.14 -0.49 -0.05 0.00 -0.01 0.00 0.00 56.01 55.31 1pfm n LEU 45 Cb 0.58 -0.07 0.07 0.00 -0.11 0.00 0.00 43.42 43.89 1pfm n LEU 45 CO 0.21 -0.51 0.38 0.07 -1.51 0.00 0.00 177.39 176.03 1pfm h LYS 46 N 0.00 0.14 -5.20 3.23 2.10 -1.61 -3.32 116.57 111.91 1pfm h LYS 46 Ca -0.05 -0.12 -0.67 0.00 -2.00 0.00 0.00 60.65 57.80 1pfm h LYS 46 Cb 0.24 0.03 -0.16 0.00 -0.90 0.00 0.00 32.23 31.44 1pfm h LYS 46 CO 0.08 0.81 0.80 -0.80 -2.00 0.00 0.00 179.45 178.33 1pfm s ASN 47 N -6.88 6.50 -0.09 7.07 -0.87 -1.26 -4.86 114.94 114.55 1pfm s ASN 47 Ca -0.02 -1.73 -0.01 0.00 -1.57 0.00 0.00 52.86 49.53 1pfm s ASN 47 Cb 0.11 -2.41 -0.03 0.00 -0.02 0.00 0.00 41.25 38.90 1pfm s ASN 47 CO 0.80 -1.19 0.67 0.61 -2.57 0.00 0.00 177.10 175.42 1pfm n GLY 48 N 5.55 -0.05 3.26 0.66 0.00 -1.25 -4.76 105.19 108.62 1pfm n GLY 48 Ca 0.17 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.03 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 3.03 1.49 -0.10 1.61 1.70 -1.26 -4.97 118.95 120.44 1pfm s ARG 49 Ca 0.12 -1.83 -0.04 0.00 -0.47 0.00 0.00 55.73 53.51 1pfm s ARG 49 Cb -0.08 0.18 0.05 0.00 -0.57 0.00 0.00 34.95 34.54 1pfm s ARG 49 CO 0.05 -0.49 0.21 0.15 -1.08 0.00 0.00 175.30 174.14 1pfm s LYS 50 N -3.83 0.12 0.00 3.89 3.01 -1.26 -2.58 119.74 119.09 1pfm s LYS 50 Ca 0.39 0.57 0.00 0.00 -1.01 0.00 0.00 55.97 55.92 1pfm s LYS 50 Cb 0.05 -0.15 0.00 0.00 -1.01 0.00 0.00 37.83 36.72 1pfm s LYS 50 CO 0.19 -0.24 0.00 0.44 0.51 0.00 0.00 175.35 176.25 1pfm n ILE 51 N 4.82 0.00 -3.63 2.17 -6.64 -1.14 -4.87 119.36 110.08 1pfm n ILE 51 Ca -0.15 0.00 -0.05 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 1.04 0.00 0.00 0.00 4.77 -1.06 -1.19 117.00 120.56 1pfm n LEU 53 Ca -0.06 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.70 1pfm n LEU 53 Cb 0.58 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.70 1pfm n LEU 53 CO 0.07 0.00 0.21 -0.90 -1.33 0.00 0.00 177.39 175.44 1pfm n ASP 54 N -1.91 2.34 -0.26 -1.43 5.68 -1.26 -4.16 116.55 115.54 1pfm n ASP 54 Ca 0.00 -2.63 0.00 0.00 -0.50 0.00 0.00 54.79 51.66 1pfm n ASP 54 Cb 0.00 -0.23 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 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 0.03 -0.44 -2.12 -0.00 -1.26 -4.45 117.00 108.76 1pfm n LEU 55 Ca 0.07 -0.55 0.09 0.00 -0.00 0.00 0.00 56.01 55.62 1pfm n LEU 55 Cb 0.58 -0.00 0.18 0.00 -0.00 0.00 0.00 43.42 44.18 1pfm n LEU 55 CO 0.36 0.14 0.63 1.67 -0.00 0.00 0.00 177.39 180.18 1pfm n GLN 56 N -0.01 2.16 -4.21 1.47 7.27 -1.26 -5.02 117.38 117.77 1pfm n GLN 56 Ca 0.00 -2.59 -0.15 0.00 0.07 0.00 0.00 57.00 54.33 1pfm n GLN 56 Cb 0.60 -1.60 -0.08 0.00 2.41 0.00 0.00 30.24 31.57 1pfm n GLN 56 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1pfm s ALA 57 N -2.63 1.33 -2.00 1.69 0.00 -1.26 -5.02 121.76 113.87 1pfm s ALA 57 Ca 0.34 -1.79 0.27 0.00 0.00 0.00 0.00 51.96 50.78 1pfm s ALA 57 Cb 0.28 1.38 1.62 0.00 0.00 0.00 0.00 23.12 26.40 1pfm s ALA 57 CO 0.06 -0.66 2.00 -0.35 0.00 0.00 0.00 175.76 176.81 1pfm n PRO 58 N -0.46 0.93 0.16 0.00 -0.04 -1.26 -3.87 135.00 130.46 1pfm n PRO 58 Ca 0.04 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.37 1pfm n PRO 58 Cb 0.64 -1.46 -0.08 0.00 -0.04 0.00 0.00 33.50 32.56 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 -0.36 -1.41 1.53 5.85 -1.95 -2.63 115.31 116.33 1pfm h LEU 59 Ca 0.00 -0.18 -0.02 0.00 0.84 0.00 0.00 57.88 58.53 1pfm h LEU 59 Cb 0.00 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1pfm h LEU 59 CO 0.00 0.04 -0.08 0.10 -0.34 0.00 0.00 178.44 178.16 1pfm h TYR 60 N -0.83 0.00 0.00 1.25 -0.00 -1.78 -1.77 116.97 113.84 1pfm h TYR 60 Ca -0.04 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.67 1pfm h TYR 60 Cb 0.52 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.25 1pfm h TYR 60 CO 0.03 0.08 -0.08 -0.22 -0.00 0.00 0.00 178.16 177.96 1pfm h LYS 61 N 0.00 0.00 0.00 0.10 3.64 -1.63 0.64 116.57 119.32 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 0.56 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.36 1pfm h LYS 61 CO 0.01 0.08 -0.75 0.87 -2.27 0.00 0.00 179.45 177.39 1pfm h LYS 62 N 0.00 0.00 0.46 1.90 1.57 -0.95 -1.19 116.57 118.35 1pfm h LYS 62 Ca -0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1pfm h LYS 62 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1pfm h LYS 62 CO 0.01 0.75 -0.22 0.82 -0.57 0.00 0.00 179.45 180.24 1pfm h ILE 63 N 0.00 0.12 -0.91 1.86 2.04 -0.93 -1.01 117.51 118.68 1pfm h ILE 63 Ca -0.01 -0.57 0.06 0.00 1.00 0.00 0.00 64.86 65.34 1pfm h ILE 63 Cb 1.38 0.19 -0.06 0.00 -0.74 0.00 0.00 36.82 37.59 1pfm h ILE 63 CO 0.10 0.03 0.60 0.40 0.00 0.00 0.00 178.15 179.27 1pfm h ILE 64 N -1.12 1.09 -0.42 -0.67 2.04 -1.38 0.14 117.51 117.18 1pfm h ILE 64 Ca -0.06 -0.37 -0.03 0.00 1.00 0.00 0.00 64.86 65.40 1pfm h ILE 64 Cb 0.52 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 36.50 1pfm h ILE 64 CO 0.10 0.19 0.15 0.11 0.00 0.00 0.00 178.15 178.71 1pfm h LYS 65 N 1.07 0.61 0.00 2.37 1.57 -1.21 0.43 116.57 121.40 1pfm h LYS 65 Ca 0.39 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 59.02 1pfm h LYS 65 Cb 0.15 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 1pfm h LYS 65 CO -0.14 0.52 -0.26 0.87 -0.57 0.00 0.00 179.45 179.87 1pfm h LYS 66 N 0.60 0.00 0.00 3.15 1.57 0.61 -2.17 116.57 120.33 1pfm h LYS 66 Ca 0.15 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1pfm h LYS 66 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 1pfm h LYS 66 CO -0.01 0.26 -0.48 -0.07 -0.57 0.00 0.00 179.45 178.57 1pfm h LEU 67 N 0.00 0.00 0.20 2.94 3.38 0.35 -3.33 115.31 118.85 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 0.79 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.56 1pfm h LEU 67 CO 0.03 0.02 -1.68 -0.07 0.09 0.00 0.00 178.44 176.83 1pfm h LEU 68 N 0.00 0.65 -1.71 1.67 3.38 -0.69 -3.29 115.31 115.33 1pfm h LEU 68 Ca -0.00 -0.90 0.22 0.00 0.09 0.00 0.00 57.88 57.29 1pfm h LEU 68 Cb 1.02 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.52 1pfm h LEU 68 CO 0.00 1.75 0.78 1.05 0.09 0.00 0.00 178.44 182.10 1pfm h GLU 69 N 0.11 0.00 -0.01 1.13 4.11 -1.51 -3.51 114.58 114.90 1pfm h GLU 69 Ca -0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.11 1pfm h GLU 69 Cb 2.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.36 1pfm h GLU 69 CO 0.20 0.00 0.00 0.45 0.07 0.00 0.00 179.01 179.73