#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pfn s SER 4 N 0.00 7.17 -0.42 6.12 0.15 -1.26 -5.02 113.70 120.44 1pfn s SER 4 Ca 0.00 1.48 0.05 0.00 0.70 0.00 0.00 55.95 58.18 1pfn s SER 4 Cb 0.00 -2.44 0.19 0.00 -1.71 0.00 0.00 66.02 62.06 1pfn s SER 4 CO 0.00 0.12 0.42 0.00 1.20 0.00 0.00 173.24 174.99 1pfn n ALA 5 N 1.15 2.32 -3.15 5.45 0.00 -1.26 -4.96 120.51 120.05 1pfn n ALA 5 Ca -0.05 -2.98 0.06 0.00 0.00 0.00 0.00 53.44 50.47 1pfn n ALA 5 Cb 0.50 -0.83 -0.00 0.00 0.00 0.00 0.00 19.45 19.12 1pfn n ALA 5 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1pfn s LYS 6 N -0.15 0.13 -0.17 0.00 2.36 -1.26 -5.07 119.74 115.58 1pfn s LYS 6 Ca 0.33 0.16 -0.08 0.00 -2.55 0.00 0.00 55.97 53.83 1pfn s LYS 6 Cb 0.07 0.08 0.03 0.00 -1.05 0.00 0.00 37.83 36.96 1pfn s LYS 6 CO -0.17 -0.22 0.16 0.39 1.55 0.00 0.00 175.35 177.06 1pfn n GLU 7 N 5.19 -3.76 -1.59 4.03 1.02 -1.26 -5.04 120.64 119.24 1pfn n GLU 7 Ca 0.05 2.91 0.00 0.00 -0.02 0.00 0.00 57.16 60.11 1pfn n GLU 7 Cb 0.57 -4.29 0.00 0.00 -0.02 0.00 0.00 31.44 27.70 1pfn n GLU 7 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1pfn n LEU 8 N 1.68 0.00 -3.23 -4.62 7.99 -1.26 -5.03 117.00 112.53 1pfn n LEU 8 Ca -0.28 0.00 -0.01 0.00 -0.01 0.00 0.00 56.01 55.71 1pfn n LEU 8 Cb 0.45 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.74 1pfn n LEU 8 CO 0.33 -0.07 0.06 -0.13 -1.51 0.00 0.00 177.39 176.08 1pfn s ARG 9 N -1.53 0.80 0.33 3.23 1.81 -0.38 -5.03 118.95 118.17 1pfn s ARG 9 Ca 0.00 -0.33 -0.26 0.00 -1.72 0.00 0.00 55.73 53.42 1pfn s ARG 9 Cb 0.00 0.00 -0.10 0.00 -0.45 0.00 0.00 34.95 34.40 1pfn s ARG 9 CO 0.00 -1.19 0.95 0.00 -0.68 0.00 0.00 175.30 174.38 1pfn h GLN 11 N 3.14 0.30 -4.89 0.00 4.20 -2.00 -3.41 115.11 112.45 1pfn h GLN 11 Ca -0.47 -0.17 -0.65 0.00 0.06 0.00 0.00 58.65 57.42 1pfn h GLN 11 Cb 1.19 0.01 -0.36 0.00 0.30 0.00 0.00 27.48 28.63 1pfn h GLN 11 CO 0.65 0.74 -0.84 0.00 -0.67 0.00 0.00 178.83 178.70 1pfn n VAL 13 N 4.63 0.00 -0.12 0.00 0.24 -1.26 -4.92 118.33 116.90 1pfn n VAL 13 Ca -0.18 0.00 -0.04 0.00 -2.04 0.00 0.00 64.34 62.08 1pfn n VAL 13 Cb 0.48 0.00 0.04 0.00 -1.47 0.00 0.00 33.84 32.89 1pfn n VAL 13 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1pfn n LYS 14 N 0.00 -0.37 -2.68 7.34 5.02 -1.26 -4.84 118.16 121.36 1pfn n LYS 14 Ca 0.00 -0.19 -0.42 0.00 -2.02 0.00 0.00 58.31 55.69 1pfn n LYS 14 Cb 0.00 -0.37 -0.03 0.00 -0.02 0.00 0.00 35.03 34.61 1pfn n LYS 14 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1pfn s THR 15 N -0.89 4.67 -1.28 -0.18 2.01 -1.26 -4.94 115.64 113.77 1pfn s THR 15 Ca 0.09 1.99 -0.05 0.00 0.31 0.00 0.00 61.69 64.02 1pfn s THR 15 Cb -0.02 -4.27 0.15 0.00 0.01 0.00 0.00 72.50 68.37 1pfn s THR 15 CO 0.07 0.20 2.26 0.41 -0.69 0.00 0.00 174.62 176.86 1pfn n THR 16 N 3.60 5.27 0.85 -0.82 -1.04 -0.13 -4.65 114.28 117.36 1pfn n THR 16 Ca 0.05 -4.55 0.11 0.00 -2.04 0.00 0.00 64.05 57.62 1pfn n THR 16 Cb 0.50 -2.04 0.51 0.00 -1.82 0.00 0.00 70.33 67.48 1pfn n THR 16 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1pfn n SER 17 N 1.71 0.00 0.25 8.00 7.64 -1.26 -3.44 113.62 126.52 1pfn n SER 17 Ca 0.58 0.43 0.17 0.00 1.01 0.00 0.00 58.87 61.06 1pfn n SER 17 Cb 0.26 -0.47 0.82 0.00 -1.01 0.00 0.00 64.21 63.81 1pfn n SER 17 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1pfn h GLN 18 N 0.00 0.00 -7.31 1.43 4.20 -1.92 -3.41 115.11 108.10 1pfn h GLN 18 Ca 0.00 0.00 -0.52 0.00 0.06 0.00 0.00 58.65 58.19 1pfn h GLN 18 Cb 0.38 0.00 0.13 0.00 0.30 0.00 0.00 27.48 28.29 1pfn h GLN 18 CO 0.00 0.00 0.32 0.08 -0.67 0.00 0.00 178.83 178.56 1pfn s VAL 19 N -4.32 3.27 -0.20 -0.54 1.01 -1.22 -5.02 120.40 113.38 1pfn s VAL 19 Ca -0.04 0.42 -0.04 0.00 0.00 0.00 0.00 61.98 62.32 1pfn s VAL 19 Cb 0.12 -2.89 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 1pfn s VAL 19 CO 0.39 -0.53 -0.02 -0.13 0.00 0.00 0.00 175.10 174.81 1pfn s ARG 20 N -4.86 3.54 -0.78 2.72 3.00 -1.26 -5.05 118.95 116.25 1pfn s ARG 20 Ca 0.62 -0.56 -0.26 0.00 0.00 0.00 0.00 55.73 55.53 1pfn s ARG 20 Cb -0.17 -3.04 0.03 0.00 0.00 0.00 0.00 34.95 31.77 1pfn s ARG 20 CO 0.56 -0.03 1.32 -1.25 0.00 0.00 0.00 175.30 175.89 1pfn s PRO 21 N 1.09 3.24 0.00 3.54 0.04 -1.26 -4.44 135.00 137.21 1pfn s PRO 21 Ca 0.02 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 60.70 1pfn s PRO 21 Cb -0.14 -4.37 0.00 0.00 0.04 0.00 0.00 34.50 30.02 1pfn s PRO 21 CO 0.01 -2.18 0.00 -2.13 0.04 0.00 0.00 177.00 172.74 1pfn n ARG 22 N 9.30 0.00 -2.36 4.56 0.63 -1.26 -4.94 116.66 122.59 1pfn n ARG 22 Ca 0.08 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.75 1pfn n ARG 22 Cb 0.49 -0.06 0.01 0.00 0.45 0.00 0.00 32.46 33.35 1pfn n ARG 22 CO 0.00 0.00 0.00 -2.39 -2.51 0.00 0.00 177.63 172.73 1pfn n HIS 23 N -1.84 3.21 -1.24 -0.14 1.44 -1.26 -5.05 115.22 110.34 1pfn n HIS 23 Ca 0.00 -2.88 -0.30 0.00 -2.01 0.00 0.00 57.72 52.53 1pfn n HIS 23 Cb 0.00 -0.15 0.23 0.00 0.12 0.00 0.00 29.99 30.19 1pfn n HIS 23 CO 0.00 0.00 0.00 -1.50 -2.81 0.00 0.00 176.34 172.03 1pfn s ILE 24 N -5.26 1.65 0.00 0.61 2.07 -1.26 -0.84 121.20 118.17 1pfn s ILE 24 Ca 0.49 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.73 1pfn s ILE 24 Cb 0.40 -2.59 0.00 0.00 0.13 0.00 0.00 42.46 40.41 1pfn s ILE 24 CO -0.13 0.00 0.00 1.07 -1.91 0.00 0.00 174.94 173.97 1pfn n THR 25 N -4.61 0.00 -3.53 4.00 5.66 -0.79 -4.23 114.28 110.78 1pfn n THR 25 Ca 0.14 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 61.06 1pfn n THR 25 Cb 0.60 -0.32 -0.02 0.00 -1.55 0.00 0.00 70.33 69.03 1pfn n THR 25 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1pfn s SER 26 N -4.01 -0.32 -0.05 1.09 1.04 -1.16 -5.04 113.70 105.25 1pfn s SER 26 Ca 0.00 0.05 -0.10 0.00 0.48 0.00 0.00 55.95 56.39 1pfn s SER 26 Cb 0.00 0.32 0.02 0.00 0.10 0.00 0.00 66.02 66.46 1pfn s SER 26 CO 0.00 -0.50 0.23 -1.48 0.98 0.00 0.00 173.24 172.47 1pfn s LEU 27 N -2.23 1.14 0.25 2.42 0.05 -1.26 0.78 118.68 119.84 1pfn s LEU 27 Ca 0.05 0.22 -0.09 0.00 0.05 0.00 0.00 54.13 54.36 1pfn s LEU 27 Cb -0.01 0.90 -0.07 0.00 -2.05 0.00 0.00 46.19 44.96 1pfn s LEU 27 CO -0.07 -0.24 0.56 -1.61 -0.55 0.00 0.00 176.35 174.44 1pfn s GLU 28 N -0.60 3.76 -0.35 1.48 2.02 0.72 -4.92 118.70 120.80 1pfn s GLU 28 Ca -0.07 0.22 0.01 0.00 0.02 0.00 0.00 54.97 55.15 1pfn s GLU 28 Cb -0.04 -2.63 0.11 0.00 0.10 0.00 0.00 34.13 31.67 1pfn s GLU 28 CO 0.02 0.27 0.13 0.08 0.02 0.00 0.00 175.26 175.78 1pfn s VAL 29 N -1.91 1.27 -0.01 2.63 1.01 -1.26 -1.76 120.40 120.36 1pfn s VAL 29 Ca 0.47 -1.89 0.05 0.00 0.00 0.00 0.00 61.98 60.61 1pfn s VAL 29 Cb -0.11 -1.93 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 1pfn s VAL 29 CO 0.24 -0.72 -0.15 -0.63 0.00 0.00 0.00 175.10 173.83 1pfn s ILE 30 N 1.14 3.00 0.00 2.22 1.09 -0.34 -4.99 121.20 123.32 1pfn s ILE 30 Ca 0.12 -0.90 0.00 0.00 -1.10 0.00 0.00 60.65 58.77 1pfn s ILE 30 Cb -0.20 -2.22 0.00 0.00 -1.06 0.00 0.00 42.46 38.99 1pfn s ILE 30 CO -0.15 0.48 0.00 1.17 -0.10 0.00 0.00 174.94 176.34 1pfn n LYS 31 N 1.96 1.14 -2.52 2.79 4.81 -1.26 -0.85 118.16 124.22 1pfn n LYS 31 Ca -0.16 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 56.86 1pfn n LYS 31 Cb 0.52 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.55 1pfn n LYS 31 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1pfn s ALA 32 N -3.95 2.92 1.00 3.14 0.00 -1.24 -2.22 121.76 121.41 1pfn s ALA 32 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 51.96 51.14 1pfn s ALA 32 Cb 0.00 -4.07 0.00 0.00 0.00 0.00 0.00 23.12 19.05 1pfn s ALA 32 CO 0.00 -2.79 0.00 0.41 0.00 0.00 0.00 175.76 173.38 1pfn n GLY 33 N 5.14 -2.20 0.07 0.00 0.00 0.47 -4.71 105.19 103.96 1pfn n GLY 33 Ca 0.09 -1.43 -0.08 0.00 0.00 0.00 0.00 46.02 44.61 1pfn n GLY 33 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pfn h PRO 34 N 0.00 -0.01 0.00 1.61 0.13 -1.94 -3.17 132.00 128.61 1pfn h PRO 34 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1pfn h PRO 34 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1pfn h PRO 34 CO 0.00 0.54 0.00 -2.39 -0.23 0.00 0.00 178.00 175.92 1pfn n HIS 35 N -4.70 0.13 -3.65 1.56 1.44 -1.26 -4.08 115.22 104.66 1pfn n HIS 35 Ca -0.06 0.05 -0.29 0.00 -2.01 0.00 0.00 57.72 55.41 1pfn n HIS 35 Cb 0.27 -0.58 -0.13 0.00 0.12 0.00 0.00 29.99 29.66 1pfn n HIS 35 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1pfn h PRO 37 N 7.22 0.00 -6.62 0.00 0.13 -1.70 1.38 132.00 132.42 1pfn h PRO 37 Ca -0.03 0.00 -0.50 0.00 -0.87 0.00 0.00 66.00 64.60 1pfn h PRO 37 Cb 0.96 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.10 1pfn h PRO 37 CO 0.42 0.00 -0.08 -0.08 -0.23 0.00 0.00 178.00 178.03 1pfn s THR 38 N -3.53 5.00 0.27 1.56 -1.32 -1.26 -4.63 115.64 111.74 1pfn s THR 38 Ca 0.03 -0.01 -0.30 0.00 -1.21 0.00 0.00 61.69 60.19 1pfn s THR 38 Cb 0.09 -3.79 -0.12 0.00 -1.51 0.00 0.00 72.50 67.16 1pfn s THR 38 CO 0.51 -0.51 1.50 0.00 -2.21 0.00 0.00 174.62 173.92 1pfn n ALA 39 N -1.46 1.88 -4.01 11.08 0.00 -1.26 -3.61 120.51 123.13 1pfn n ALA 39 Ca -0.02 0.39 -0.31 0.00 0.00 0.00 0.00 53.44 53.50 1pfn n ALA 39 Cb 0.55 -2.37 -0.15 0.00 0.00 0.00 0.00 19.45 17.47 1pfn n ALA 39 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1pfn s GLN 40 N -0.54 1.59 -0.13 0.00 -0.44 -0.03 -4.82 119.66 115.30 1pfn s GLN 40 Ca 0.65 -1.68 -0.01 0.00 -2.50 0.00 0.00 55.36 51.82 1pfn s GLN 40 Cb -0.56 -3.04 -0.02 0.00 -1.64 0.00 0.00 33.01 27.74 1pfn s GLN 40 CO 0.50 -0.85 -0.08 -1.17 0.50 0.00 0.00 175.29 174.19 1pfn s LEU 41 N 1.01 3.03 0.39 3.68 2.96 -1.24 -1.19 118.68 127.31 1pfn s LEU 41 Ca 0.06 -0.18 0.08 0.00 -0.22 0.00 0.00 54.13 53.87 1pfn s LEU 41 Cb -0.19 -1.70 -0.05 0.00 0.50 0.00 0.00 46.19 44.75 1pfn s LEU 41 CO -0.08 0.21 0.13 -0.63 -1.32 0.00 0.00 176.35 174.65 1pfn s ILE 42 N 0.11 2.42 0.34 6.68 -1.09 -0.72 -2.34 121.20 126.59 1pfn s ILE 42 Ca -0.03 -1.78 0.04 0.00 -2.23 0.00 0.00 60.65 56.65 1pfn s ILE 42 Cb -0.14 -2.95 -0.02 0.00 -1.58 0.00 0.00 42.46 37.77 1pfn s ILE 42 CO 0.04 -0.06 0.35 0.00 -1.23 0.00 0.00 174.94 174.04 1pfn s ALA 43 N -2.57 1.48 -0.08 9.38 0.00 -0.79 -0.20 121.76 128.97 1pfn s ALA 43 Ca 0.39 -1.88 -0.07 0.00 0.00 0.00 0.00 51.96 50.39 1pfn s ALA 43 Cb 0.03 1.36 0.02 0.00 0.00 0.00 0.00 23.12 24.53 1pfn s ALA 43 CO 0.21 -0.71 0.20 0.99 0.00 0.00 0.00 175.76 176.46 1pfn s THR 44 N -3.27 -0.00 0.11 0.00 2.01 0.23 -3.06 115.64 111.66 1pfn s THR 44 Ca 0.37 0.00 0.02 0.00 0.31 0.00 0.00 61.69 62.39 1pfn s THR 44 Cb 0.01 -0.29 0.02 0.00 0.01 0.00 0.00 72.50 72.25 1pfn s THR 44 CO 0.25 0.00 0.13 0.18 -0.69 0.00 0.00 174.62 174.50 1pfn n LEU 45 N 2.98 0.00 -0.06 4.42 4.77 -1.10 -1.88 117.00 126.13 1pfn n LEU 45 Ca -0.13 -0.51 -0.14 0.00 -0.03 0.00 0.00 56.01 55.21 1pfn n LEU 45 Cb 0.59 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 1pfn n LEU 45 CO 0.19 -0.48 0.44 0.11 -1.33 0.00 0.00 177.39 176.33 1pfn h LYS 46 N 0.00 0.82 -5.93 3.23 1.57 -1.16 -3.31 116.57 111.78 1pfn h LYS 46 Ca -0.06 -0.52 -0.60 0.00 -1.87 0.00 0.00 60.65 57.60 1pfn h LYS 46 Cb 0.24 0.06 -0.11 0.00 0.08 0.00 0.00 32.23 32.50 1pfn h LYS 46 CO 0.08 1.15 1.13 -0.80 -0.57 0.00 0.00 179.45 180.44 1pfn s ASN 47 N -6.95 6.37 -0.06 0.86 0.01 -1.26 -4.82 114.94 109.08 1pfn s ASN 47 Ca -0.10 -1.16 -0.01 0.00 -0.71 0.00 0.00 52.86 50.88 1pfn s ASN 47 Cb 0.10 -2.52 -0.02 0.00 0.41 0.00 0.00 41.25 39.22 1pfn s ASN 47 CO 0.88 -1.54 0.69 0.61 -1.51 0.00 0.00 177.10 176.23 1pfn n GLY 48 N 5.99 -0.03 3.30 0.66 0.00 -1.24 -4.76 105.19 109.11 1pfn n GLY 48 Ca 0.17 -0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1pfn n GLY 48 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1pfn n ARG 49 N 2.82 0.49 -3.69 1.61 1.85 -1.26 -4.96 116.66 113.50 1pfn n ARG 49 Ca 0.04 -3.42 -0.11 0.00 -1.00 0.00 0.00 57.85 53.37 1pfn n ARG 49 Cb 0.28 2.34 -0.11 0.00 -1.05 0.00 0.00 32.46 33.92 1pfn n ARG 49 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1pfn s LYS 50 N -3.46 0.33 0.00 2.89 3.01 -1.26 -2.73 119.74 118.52 1pfn s LYS 50 Ca 0.31 0.77 0.00 0.00 -1.01 0.00 0.00 55.97 56.04 1pfn s LYS 50 Cb 0.02 0.00 0.00 0.00 -1.01 0.00 0.00 37.83 36.84 1pfn s LYS 50 CO 0.22 -0.18 0.00 0.44 0.51 0.00 0.00 175.35 176.34 1pfn n ILE 51 N 4.47 0.00 -3.61 2.17 -6.64 -1.17 -4.89 119.36 109.69 1pfn n ILE 51 Ca -0.21 0.00 -0.08 0.00 -1.77 0.00 0.00 62.75 60.69 1pfn n ILE 51 Cb 0.54 0.00 -0.06 0.00 -1.44 0.00 0.00 39.64 38.68 1pfn n ILE 51 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1pfn n LEU 53 N 1.09 0.00 -4.74 0.00 4.77 -0.99 -0.95 117.00 116.18 1pfn n LEU 53 Ca -0.09 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.66 1pfn n LEU 53 Cb 0.57 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.61 1pfn n LEU 53 CO 0.11 0.00 -0.23 1.51 -1.33 0.00 0.00 177.39 177.44 1pfn s ASP 54 N -0.95 4.95 -0.00 -1.43 1.47 -1.26 -3.98 116.67 115.47 1pfn s ASP 54 Ca 0.00 -0.53 0.09 0.00 1.18 0.00 0.00 52.55 53.29 1pfn s ASP 54 Cb 0.00 -1.02 -0.10 0.00 -0.34 0.00 0.00 42.92 41.46 1pfn s ASP 54 CO 0.00 -0.09 0.37 0.00 0.68 0.00 0.00 175.17 176.12 1pfn n LEU 55 N -1.07 0.39 -1.60 2.11 -0.00 -1.26 -4.43 117.00 111.13 1pfn n LEU 55 Ca -0.06 -0.46 -0.02 0.00 -0.00 0.00 0.00 56.01 55.46 1pfn n LEU 55 Cb 0.59 0.00 0.23 0.00 -0.00 0.00 0.00 43.42 44.24 1pfn n LEU 55 CO 0.42 0.10 0.81 1.67 -0.00 0.00 0.00 177.39 180.38 1pfn n GLN 56 N -1.26 3.11 -4.13 1.47 7.27 -1.26 -4.89 117.38 117.69 1pfn n GLN 56 Ca 0.01 -2.17 -0.10 0.00 0.07 0.00 0.00 57.00 54.82 1pfn n GLN 56 Cb 0.15 -1.97 -0.10 0.00 2.41 0.00 0.00 30.24 30.73 1pfn n GLN 56 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1pfn s ALA 57 N -2.25 0.76 -1.74 1.69 0.00 -1.26 -5.02 121.76 113.94 1pfn s ALA 57 Ca 0.39 -1.23 0.30 0.00 0.00 0.00 0.00 51.96 51.41 1pfn s ALA 57 Cb 0.31 0.19 1.66 0.00 0.00 0.00 0.00 23.12 25.27 1pfn s ALA 57 CO 0.10 -0.26 2.08 -0.35 0.00 0.00 0.00 175.76 177.33 1pfn n PRO 58 N 0.19 0.71 0.13 0.00 -0.04 -1.26 -3.88 135.00 130.84 1pfn n PRO 58 Ca -0.14 0.01 -0.13 0.00 -0.04 0.00 0.00 63.50 63.19 1pfn n PRO 58 Cb 0.60 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.48 1pfn n PRO 58 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1pfn h LEU 59 N 0.00 -0.27 -1.36 1.53 5.85 -1.95 -2.49 115.31 116.62 1pfn h LEU 59 Ca 0.00 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.54 1pfn h LEU 59 Cb 0.12 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.22 1pfn h LEU 59 CO 0.00 0.05 0.00 0.10 -0.34 0.00 0.00 178.44 178.25 1pfn h TYR 60 N -0.61 0.00 0.00 1.25 -0.00 -1.78 -1.69 116.97 114.15 1pfn h TYR 60 Ca -0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.68 1pfn h TYR 60 Cb 0.44 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.17 1pfn h TYR 60 CO 0.02 0.00 -0.10 -0.22 -0.00 0.00 0.00 178.16 177.86 1pfn h LYS 61 N 0.00 0.00 0.00 0.10 3.64 -1.59 -0.05 116.57 118.67 1pfn h LYS 61 Ca 0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 1pfn h LYS 61 Cb 0.47 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.27 1pfn h LYS 61 CO 0.00 0.10 -0.47 1.57 -2.27 0.00 0.00 179.45 178.37 1pfn h LYS 62 N 0.00 0.00 0.17 1.90 2.10 -0.97 -1.55 116.57 118.22 1pfn h LYS 62 Ca -0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 1pfn h LYS 62 Cb 0.51 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.84 1pfn h LYS 62 CO 0.01 0.47 -0.08 0.82 -2.00 0.00 0.00 179.45 178.67 1pfn h ILE 63 N 0.00 0.77 -0.50 0.07 2.04 -1.05 -0.45 117.51 118.40 1pfn h ILE 63 Ca -0.00 -1.12 -0.01 0.00 1.00 0.00 0.00 64.86 64.73 1pfn h ILE 63 Cb 1.29 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 38.65 1pfn h ILE 63 CO 0.06 0.20 0.26 0.40 0.00 0.00 0.00 178.15 179.08 1pfn h ILE 64 N -0.89 1.18 -0.12 -0.67 2.04 -1.39 -0.10 117.51 117.56 1pfn h ILE 64 Ca -0.02 -0.47 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 1pfn h ILE 64 Cb 0.51 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1pfn h ILE 64 CO 0.04 0.19 -0.12 0.11 0.00 0.00 0.00 178.15 178.37 1pfn h LYS 65 N 0.66 0.18 0.00 2.37 1.57 -1.36 -0.37 116.57 119.62 1pfn h LYS 65 Ca 0.17 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.87 1pfn h LYS 65 Cb 0.07 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.35 1pfn h LYS 65 CO -0.03 0.31 -0.23 0.87 -0.57 0.00 0.00 179.45 179.80 1pfn h LYS 66 N 0.17 0.00 0.00 3.15 1.57 -0.06 -2.18 116.57 119.22 1pfn h LYS 66 Ca 0.04 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 1pfn h LYS 66 Cb 0.33 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.62 1pfn h LYS 66 CO 0.02 0.23 -0.86 -0.07 -0.57 0.00 0.00 179.45 178.20 1pfn h LEU 67 N 0.00 0.00 0.23 2.94 3.38 0.52 -3.33 115.31 119.05 1pfn h LEU 67 Ca -0.00 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.64 1pfn h LEU 67 Cb 0.91 0.00 0.03 0.00 0.09 0.00 0.00 40.66 41.69 1pfn h LEU 67 CO 0.03 0.45 -1.46 -0.07 0.09 0.00 0.00 178.44 177.48 1pfn h LEU 68 N 0.00 0.74 -1.72 1.67 3.38 -0.97 -3.24 115.31 115.18 1pfn h LEU 68 Ca -0.06 -0.82 0.24 0.00 0.09 0.00 0.00 57.88 57.33 1pfn h LEU 68 Cb 1.40 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 1pfn h LEU 68 CO 0.05 1.65 0.80 1.05 0.09 0.00 0.00 178.44 182.07 1pfn h GLU 69 N 0.13 0.00 -0.00 1.13 -0.00 -1.50 -3.51 114.58 110.82 1pfn h GLU 69 Ca -0.24 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.12 1pfn h GLU 69 Cb 2.13 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.88 1pfn h GLU 69 CO 0.25 0.00 0.00 -1.13 -0.00 0.00 0.00 179.01 178.13