#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f1f s LYS 2 N 0.00 0.48 -0.34 0.03 2.47 -1.26 -5.14 119.74 115.98 3f1f s LYS 2 Ca 0.00 1.09 -0.19 0.00 -1.56 0.00 0.00 55.97 55.31 3f1f s LYS 2 Cb 0.00 0.65 -0.00 0.00 -1.46 0.00 0.00 37.83 37.01 3f1f s LYS 2 CO 0.00 -0.28 0.58 0.15 0.16 0.00 0.00 175.35 175.96 3f1f s LYS 3 N 2.79 3.71 0.44 4.03 -0.14 -1.26 -5.06 119.74 124.25 3f1f s LYS 3 Ca 0.02 0.02 0.07 0.00 -1.36 0.00 0.00 55.97 54.72 3f1f s LYS 3 Cb -0.11 -3.79 -0.02 0.00 -1.68 0.00 0.00 37.83 32.23 3f1f s LYS 3 CO -0.18 -0.65 0.30 0.08 -0.76 0.00 0.00 175.35 174.13 3f1f s VAL 4 N 2.55 2.29 0.02 3.17 1.01 -1.26 -2.19 120.40 125.99 3f1f s VAL 4 Ca 0.22 -1.53 0.00 0.00 0.00 0.00 0.00 61.98 60.68 3f1f s VAL 4 Cb -0.15 -2.81 0.00 0.00 0.00 0.00 0.00 36.38 33.42 3f1f s VAL 4 CO 0.13 0.00 0.00 0.52 0.00 0.00 0.00 175.10 175.75 3f1f n VAL 5 N -1.46 0.00 -3.65 2.92 0.31 0.19 -4.18 118.33 112.46 3f1f n VAL 5 Ca 0.00 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.32 3f1f n VAL 5 Cb 0.63 -0.54 -0.04 0.00 -0.91 0.00 0.00 33.84 32.99 3f1f n VAL 5 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3f1f s ALA 6 N -2.00 -2.02 0.23 3.52 0.00 -1.08 -4.94 121.76 115.46 3f1f s ALA 6 Ca 0.00 2.34 -0.30 0.00 0.00 0.00 0.00 51.96 54.00 3f1f s ALA 6 Cb 0.00 -1.76 -0.09 0.00 0.00 0.00 0.00 23.12 21.28 3f1f s ALA 6 CO 0.00 -0.90 1.19 0.54 0.00 0.00 0.00 175.76 176.59 3f1f s VAL 7 N 2.84 3.42 -0.19 0.00 0.11 -1.26 0.61 120.40 125.93 3f1f s VAL 7 Ca -0.06 1.29 -0.04 0.00 -2.93 0.00 0.00 61.98 60.23 3f1f s VAL 7 Cb -0.12 -3.82 0.08 0.00 -1.53 0.00 0.00 36.38 31.00 3f1f s VAL 7 CO -0.19 0.25 0.20 0.54 -3.33 0.00 0.00 175.10 172.56 3f1f s VAL 8 N -0.50 -0.28 -0.10 2.04 0.11 0.12 -4.92 120.40 116.87 3f1f s VAL 8 Ca 0.50 -0.10 -0.22 0.00 -2.93 0.00 0.00 61.98 59.24 3f1f s VAL 8 Cb -0.33 -0.64 -0.04 0.00 -1.53 0.00 0.00 36.38 33.84 3f1f s VAL 8 CO 0.40 -0.20 0.64 -0.54 -3.33 0.00 0.00 175.10 172.07 3f1f s LYS 9 N 2.29 4.38 0.02 1.54 1.02 -1.26 -2.33 119.74 125.40 3f1f s LYS 9 Ca 0.06 0.75 0.02 0.00 0.02 0.00 0.00 55.97 56.82 3f1f s LYS 9 Cb -0.16 -3.47 -0.01 0.00 -0.52 0.00 0.00 37.83 33.68 3f1f s LYS 9 CO -0.11 0.03 -0.08 -0.51 -0.92 0.00 0.00 175.35 173.77 3f1f s LEU 10 N 0.95 2.11 -0.08 3.17 2.01 -1.25 -5.00 118.68 120.59 3f1f s LEU 10 Ca 0.34 -0.29 0.00 0.00 0.01 0.00 0.00 54.13 54.19 3f1f s LEU 10 Cb -0.17 -0.31 -0.03 0.00 0.01 0.00 0.00 46.19 45.70 3f1f s LEU 10 CO 0.15 -0.02 -0.07 -1.10 1.01 0.00 0.00 176.35 176.32 3f1f s GLN 11 N -0.72 2.84 0.20 1.70 -0.21 -1.26 -2.89 119.66 119.32 3f1f s GLN 11 Ca -0.02 -0.55 -0.23 0.00 0.02 0.00 0.00 55.36 54.58 3f1f s GLN 11 Cb -0.05 -2.62 0.05 0.00 1.00 0.00 0.00 33.01 31.39 3f1f s GLN 11 CO 0.00 0.62 0.78 -0.48 -2.12 0.00 0.00 175.29 174.09 3f1f s LEU 12 N -0.69 -0.30 0.21 2.90 2.34 -1.19 -5.02 118.68 116.94 3f1f s LEU 12 Ca 0.10 -0.40 -0.30 0.00 0.06 0.00 0.00 54.13 53.59 3f1f s LEU 12 Cb -0.11 2.50 -0.08 0.00 -0.56 0.00 0.00 46.19 47.93 3f1f s LEU 12 CO 0.02 -1.11 1.20 -2.84 -1.06 0.00 0.00 176.35 172.55 3f1f s PRO 13 N -3.66 4.50 -0.31 1.48 0.02 -1.24 -2.43 135.00 133.36 3f1f s PRO 13 Ca 0.09 1.89 -0.29 0.00 0.02 0.00 0.00 61.00 62.71 3f1f s PRO 13 Cb -0.04 -3.22 0.01 0.00 0.02 0.00 0.00 34.50 31.27 3f1f s PRO 13 CO 0.01 -0.06 1.18 0.00 -0.33 0.00 0.00 177.00 177.80 3f1f s ALA 14 N -0.25 3.44 0.00 -1.55 0.00 -1.22 -3.01 121.76 119.17 3f1f s ALA 14 Ca 0.52 0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.50 3f1f s ALA 14 Cb -0.33 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.07 3f1f s ALA 14 CO 0.38 -1.62 0.00 0.41 0.00 0.00 0.00 175.76 174.94 3f1f n GLY 15 N 4.08 0.62 3.01 0.00 0.00 -1.26 -4.17 105.19 107.47 3f1f n GLY 15 Ca 0.13 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 3f1f n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f1f s LYS 16 N -0.21 0.15 0.00 1.61 1.02 -1.16 -5.08 119.74 116.07 3f1f s LYS 16 Ca 0.00 0.75 0.00 0.00 0.02 0.00 0.00 55.97 56.74 3f1f s LYS 16 Cb 0.00 -0.03 0.00 0.00 -0.52 0.00 0.00 37.83 37.28 3f1f s LYS 16 CO 0.00 -0.28 0.00 0.00 -0.92 0.00 0.00 175.35 174.15 3f1f n ALA 17 N 5.32 0.00 -3.91 5.17 0.00 -1.26 -3.97 120.51 121.85 3f1f n ALA 17 Ca -0.07 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.27 3f1f n ALA 17 Cb 0.50 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.93 3f1f n ALA 17 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3f1f n THR 18 N -0.34 0.00 -0.11 0.00 -2.24 -1.26 -5.06 114.28 105.27 3f1f n THR 18 Ca 0.00 -1.49 -0.05 0.00 -2.27 0.00 0.00 64.05 60.24 3f1f n THR 18 Cb 0.00 0.99 0.01 0.00 -2.10 0.00 0.00 70.33 69.24 3f1f n THR 18 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3f1f h PRO 19 N 0.00 -0.05 0.00 -0.78 0.11 -2.00 -3.46 132.00 125.82 3f1f h PRO 19 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3f1f h PRO 19 Cb 1.11 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3f1f h PRO 19 CO 0.35 -0.03 0.00 0.00 -0.21 0.00 0.00 178.00 178.11 3f1f n ALA 20 N -2.76 -0.13 -0.81 -0.75 0.00 -1.26 0.37 120.51 115.17 3f1f n ALA 20 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.13 3f1f n ALA 20 Cb 0.24 0.00 0.13 0.00 0.00 0.00 0.00 19.45 19.83 3f1f n ALA 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3f1f n PRO 21 N 0.04 -0.27 0.00 0.00 -0.04 -1.26 -2.50 135.00 130.97 3f1f n PRO 21 Ca 0.00 -0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.46 3f1f n PRO 21 Cb 0.00 -2.06 0.15 0.00 -0.04 0.00 0.00 33.50 31.55 3f1f n PRO 21 CO 0.00 0.00 0.00 -2.30 -0.04 0.00 0.00 175.50 173.16 3f1f n PRO 22 N -2.54 0.67 0.05 0.54 -0.02 -1.26 -4.73 135.00 127.71 3f1f n PRO 22 Ca 0.09 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.53 3f1f n PRO 22 Cb 0.53 -1.12 0.17 0.00 -0.02 0.00 0.00 33.50 33.05 3f1f n PRO 22 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3f1f h VAL 23 N 0.00 1.31 -0.04 -1.45 2.07 -1.62 -3.13 116.25 113.38 3f1f h VAL 23 Ca 0.00 -1.55 0.01 0.00 0.82 0.00 0.00 66.70 65.98 3f1f h VAL 23 Cb 0.00 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 3f1f h VAL 23 CO 0.00 0.48 -0.02 1.23 0.02 0.00 0.00 177.57 179.27 3f1f h GLY 24 N 1.15 0.02 0.35 2.17 0.00 -0.04 -3.08 103.07 103.64 3f1f h GLY 24 Ca 0.03 0.03 0.01 0.00 0.00 0.00 0.00 47.33 47.40 3f1f h GLY 24 CO 0.07 -0.03 -0.44 -2.55 0.00 0.00 0.00 176.54 173.59 3f1f h PRO 25 N -0.02 -0.71 0.00 4.80 0.11 -1.86 -0.10 132.00 134.22 3f1f h PRO 25 Ca 0.03 0.05 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3f1f h PRO 25 Cb 0.06 0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.33 3f1f h PRO 25 CO -0.06 -0.48 0.00 0.00 -0.21 0.00 0.00 178.00 177.26 3f1f n ALA 26 N -2.82 0.00 1.34 -0.75 0.00 -1.19 -0.94 120.51 116.16 3f1f n ALA 26 Ca -0.09 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.40 3f1f n ALA 26 Cb 0.40 0.10 0.26 0.00 0.00 0.00 0.00 19.45 20.21 3f1f n ALA 26 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 3f1f n LEU 27 N -0.61 0.00 -0.06 0.00 -0.00 -1.17 -2.64 117.00 112.52 3f1f n LEU 27 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 56.01 55.80 3f1f n LEU 27 Cb 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 43.42 43.29 3f1f n LEU 27 CO 0.00 0.00 -0.94 0.61 -0.00 0.00 0.00 177.39 177.06 3f1f n GLY 28 N 0.24 -0.55 0.49 1.47 0.00 -0.05 -2.95 105.19 103.84 3f1f n GLY 28 Ca 0.07 -0.18 0.11 0.00 0.00 0.00 0.00 46.02 46.02 3f1f n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f1f n GLN 29 N -3.66 1.66 0.00 1.61 10.64 -0.12 -3.67 117.38 123.85 3f1f n GLN 29 Ca -0.37 -0.98 0.00 0.00 -1.83 0.00 0.00 57.00 53.82 3f1f n GLN 29 Cb 0.96 -1.41 0.00 0.00 -0.86 0.00 0.00 30.24 28.93 3f1f n GLN 29 CO 0.00 0.00 0.00 0.72 -1.83 0.00 0.00 177.06 175.95 3f1f n HIS 30 N 0.19 0.00 0.00 2.61 8.25 -1.08 -5.08 115.22 120.10 3f1f n HIS 30 Ca 0.17 -0.14 0.00 0.00 -0.26 0.00 0.00 57.72 57.49 3f1f n HIS 30 Cb 0.32 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.41 3f1f n HIS 30 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3f1f n GLY 31 N -0.14 -1.51 3.54 -1.41 0.00 -1.15 -4.94 105.19 99.58 3f1f n GLY 31 Ca 0.00 -1.56 -0.01 0.00 0.00 0.00 0.00 46.02 44.46 3f1f n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3f1f s ALA 32 N -2.89 -2.34 -0.72 4.61 0.00 -1.22 -4.48 121.76 114.71 3f1f s ALA 32 Ca 0.00 2.21 -0.03 0.00 0.00 0.00 0.00 51.96 54.14 3f1f s ALA 32 Cb 0.00 -1.85 0.27 0.00 0.00 0.00 0.00 23.12 21.54 3f1f s ALA 32 CO 0.00 -0.80 2.25 -1.71 0.00 0.00 0.00 175.76 175.50 3f1f n ASN 33 N 4.87 7.22 0.00 0.00 2.85 -1.26 -4.83 115.26 124.12 3f1f n ASN 33 Ca -0.13 -3.64 0.00 0.00 -0.11 0.00 0.00 54.58 50.70 3f1f n ASN 33 Cb 0.53 -1.11 0.00 0.00 1.24 0.00 0.00 39.78 40.43 3f1f n ASN 33 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 3f1f n ILE 34 N -0.13 0.58 0.15 -1.44 -5.35 -1.26 -2.00 119.36 109.91 3f1f n ILE 34 Ca 0.53 0.21 -0.06 0.00 -0.27 0.00 0.00 62.75 63.16 3f1f n ILE 34 Cb 0.34 -1.21 -0.03 0.00 -1.74 0.00 0.00 39.64 37.00 3f1f n ILE 34 CO 0.00 0.00 0.00 -0.03 -1.76 0.00 0.00 176.55 174.76 3f1f h MET 35 N 0.00 -0.37 0.00 6.28 4.05 -1.97 -1.24 114.93 121.69 3f1f h MET 35 Ca 0.00 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.45 3f1f h MET 35 Cb 0.13 0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.02 3f1f h MET 35 CO 0.00 -0.24 -0.33 1.49 0.23 0.00 0.00 176.91 178.05 3f1f h GLU 36 N -0.38 0.00 -0.09 0.39 4.57 -1.85 -3.17 114.58 114.05 3f1f h GLU 36 Ca -0.04 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.09 3f1f h GLU 36 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 3f1f h GLU 36 CO 0.06 0.00 -0.16 0.74 -1.18 0.00 0.00 179.01 178.47 3f1f h PHE 37 N 0.00 0.33 -0.05 0.92 -1.00 -1.47 -3.10 116.94 112.57 3f1f h PHE 37 Ca 0.00 -0.12 0.00 0.00 2.81 0.00 0.00 57.97 60.66 3f1f h PHE 37 Cb 0.80 -0.06 0.00 0.00 3.61 0.00 0.00 35.95 40.30 3f1f h PHE 37 CO 0.00 0.75 0.00 0.28 -1.61 0.00 0.00 178.31 177.73 3f1f n VAL 38 N -4.58 0.06 0.02 -0.55 0.31 -0.47 -3.29 118.33 109.83 3f1f n VAL 38 Ca -0.07 -0.15 -0.09 0.00 -0.01 0.00 0.00 64.34 64.01 3f1f n VAL 38 Cb 0.38 0.01 -0.13 0.00 -0.91 0.00 0.00 33.84 33.19 3f1f n VAL 38 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 3f1f h LYS 39 N 1.09 0.04 0.00 5.55 6.56 -1.51 -3.02 116.57 125.28 3f1f h LYS 39 Ca 0.00 -0.07 0.00 0.00 -1.06 0.00 0.00 60.65 59.52 3f1f h LYS 39 Cb 0.24 0.03 0.00 0.00 -0.57 0.00 0.00 32.23 31.92 3f1f h LYS 39 CO 0.00 0.77 -0.22 0.00 -2.06 0.00 0.00 179.45 177.94 3f1f h ALA 40 N 0.91 0.87 0.10 3.86 0.00 -1.54 -3.29 119.26 120.17 3f1f h ALA 40 Ca -0.19 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.44 3f1f h ALA 40 Cb 1.93 0.00 0.02 0.00 0.00 0.00 0.00 17.79 19.74 3f1f h ALA 40 CO 0.11 0.00 -1.18 0.35 0.00 0.00 0.00 179.25 178.52 3f1f h PHE 41 N 0.00 0.78 0.00 0.00 3.57 -1.62 -2.44 116.94 117.23 3f1f h PHE 41 Ca 0.00 -0.50 -0.11 0.00 3.53 0.00 0.00 57.97 60.90 3f1f h PHE 41 Cb 0.83 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 39.50 3f1f h PHE 41 CO 0.00 1.35 -0.50 -0.91 -2.23 0.00 0.00 178.31 176.01 3f1f h ASN 42 N 0.21 0.00 0.63 0.41 4.21 -1.62 -1.81 115.58 117.61 3f1f h ASN 42 Ca -0.15 0.00 -0.27 0.00 1.21 0.00 0.00 56.30 57.08 3f1f h ASN 42 Cb 1.86 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 39.04 3f1f h ASN 42 CO 0.21 0.50 -1.38 0.00 -1.29 0.00 0.00 177.43 175.48 3f1f h ALA 43 N 1.50 0.35 0.00 -0.83 0.00 -1.66 0.12 119.26 118.74 3f1f h ALA 43 Ca -0.01 -1.08 0.00 0.00 0.00 0.00 0.00 54.91 53.82 3f1f h ALA 43 Cb 0.99 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.94 3f1f h ALA 43 CO 0.07 1.22 0.00 0.00 0.00 0.00 0.00 179.25 180.53 3f1f n ALA 44 N -2.55 2.05 -2.76 0.00 0.00 -0.92 -2.55 120.51 113.78 3f1f n ALA 44 Ca -0.11 -0.09 0.01 0.00 0.00 0.00 0.00 53.44 53.24 3f1f n ALA 44 Cb 1.01 -1.32 0.04 0.00 0.00 0.00 0.00 19.45 19.19 3f1f n ALA 44 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3f1f n THR 45 N -1.27 0.98 -0.00 0.00 -2.24 -0.69 -4.78 114.28 106.28 3f1f n THR 45 Ca 0.10 -2.48 -0.00 0.00 -2.27 0.00 0.00 64.05 59.40 3f1f n THR 45 Cb 0.15 1.23 -0.00 0.00 -2.10 0.00 0.00 70.33 69.61 3f1f n THR 45 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3f1f h ALA 46 N 2.23 -0.07 -0.01 6.98 0.00 -0.47 -3.37 119.26 124.56 3f1f h ALA 46 Ca -0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3f1f h ALA 46 Cb 1.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.21 3f1f h ALA 46 CO 0.16 -0.07 -0.02 0.27 0.00 0.00 0.00 179.25 179.59 3f1f n ASN 47 N -2.22 0.55 -4.75 0.00 6.94 -1.26 -4.89 115.26 109.62 3f1f n ASN 47 Ca -0.00 -1.04 -0.39 0.00 -0.02 0.00 0.00 54.58 53.13 3f1f n ASN 47 Cb 0.00 -0.02 -0.05 0.00 -2.36 0.00 0.00 39.78 37.35 3f1f n ASN 47 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 3f1f s MET 48 N -2.11 4.35 0.91 -3.83 1.00 -1.26 -5.07 119.30 113.29 3f1f s MET 48 Ca 0.40 0.77 -0.15 0.00 0.00 0.00 0.00 55.69 56.72 3f1f s MET 48 Cb 0.21 -3.36 0.16 0.00 0.00 0.00 0.00 34.83 31.83 3f1f s MET 48 CO 0.38 0.30 1.27 0.20 0.00 0.00 0.00 175.02 177.17 3f1f s GLY 49 N 0.01 1.71 0.62 -0.03 0.00 -1.26 -4.83 107.32 103.53 3f1f s GLY 49 Ca 0.32 -0.99 -0.13 0.00 0.00 0.00 0.00 44.72 43.92 3f1f s GLY 49 CO 0.17 -0.32 1.04 0.99 0.00 0.00 0.00 173.10 174.98 3f1f s ASP 50 N -4.76 5.94 0.00 1.64 1.11 -1.26 -4.61 116.67 114.73 3f1f s ASP 50 Ca 0.70 1.60 0.00 0.00 0.18 0.00 0.00 52.55 55.02 3f1f s ASP 50 Cb -0.07 -2.50 0.00 0.00 1.07 0.00 0.00 42.92 41.42 3f1f s ASP 50 CO 0.52 -1.06 0.00 0.00 1.18 0.00 0.00 175.17 175.80 3f1f n ALA 51 N -2.49 0.00 -1.70 5.23 0.00 -1.26 -4.85 120.51 115.45 3f1f n ALA 51 Ca 0.07 0.00 -0.31 0.00 0.00 0.00 0.00 53.44 53.20 3f1f n ALA 51 Cb 0.54 0.00 0.05 0.00 0.00 0.00 0.00 19.45 20.04 3f1f n ALA 51 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 3f1f n ILE 52 N 1.69 3.16 -1.69 0.00 2.08 -1.26 -3.42 119.36 119.93 3f1f n ILE 52 Ca 0.00 -3.63 -0.56 0.00 0.56 0.00 0.00 62.75 59.12 3f1f n ILE 52 Cb 0.00 -1.17 -0.07 0.00 -0.75 0.00 0.00 39.64 37.65 3f1f n ILE 52 CO 0.00 0.00 0.00 0.55 0.56 0.00 0.00 176.55 177.66 3f1f n VAL 53 N -0.79 0.32 -2.82 1.39 3.14 -1.02 -4.05 118.33 114.51 3f1f n VAL 53 Ca 0.54 -0.07 -0.43 0.00 -2.96 0.00 0.00 64.34 61.42 3f1f n VAL 53 Cb 0.74 -1.30 -0.01 0.00 -1.06 0.00 0.00 33.84 32.21 3f1f n VAL 53 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 3f1f s PRO 54 N 3.83 3.87 -0.51 1.45 0.02 -1.24 -3.16 135.00 139.25 3f1f s PRO 54 Ca 0.99 -2.05 -0.28 0.00 0.02 0.00 0.00 61.00 59.68 3f1f s PRO 54 Cb -1.04 -5.15 0.02 0.00 0.02 0.00 0.00 34.50 28.35 3f1f s PRO 54 CO 0.64 -1.92 1.32 0.08 -0.33 0.00 0.00 177.00 176.79 3f1f s VAL 55 N 2.83 3.94 -0.96 3.83 1.01 -1.14 -3.33 120.40 126.59 3f1f s VAL 55 Ca 0.42 0.88 -0.24 0.00 0.00 0.00 0.00 61.98 63.04 3f1f s VAL 55 Cb -0.02 -4.47 -0.07 0.00 0.00 0.00 0.00 36.38 31.83 3f1f s VAL 55 CO -0.03 -1.07 1.98 -0.70 0.00 0.00 0.00 175.10 175.28 3f1f s GLU 56 N 5.06 2.44 0.56 2.72 2.12 -0.40 -3.88 118.70 127.32 3f1f s GLU 56 Ca 0.52 -0.42 -0.18 0.00 0.36 0.00 0.00 54.97 55.25 3f1f s GLU 56 Cb -0.10 -5.08 -0.05 0.00 0.26 0.00 0.00 34.13 29.16 3f1f s GLU 56 CO 0.28 -3.63 1.07 0.42 -0.54 0.00 0.00 175.26 172.86 3f1f s ILE 57 N 10.79 3.59 -0.34 -3.70 -1.09 -0.98 -3.63 121.20 125.83 3f1f s ILE 57 Ca 0.72 0.88 0.05 0.00 -2.23 0.00 0.00 60.65 60.06 3f1f s ILE 57 Cb -0.06 -3.35 0.17 0.00 -1.58 0.00 0.00 42.46 37.65 3f1f s ILE 57 CO 0.03 -0.33 0.50 -0.89 -1.23 0.00 0.00 174.94 173.03 3f1f s THR 58 N -2.14 -0.74 0.40 2.92 2.01 -0.99 0.15 115.64 117.25 3f1f s THR 58 Ca 0.67 -0.30 -0.22 0.00 0.31 0.00 0.00 61.69 62.15 3f1f s THR 58 Cb -0.18 -0.64 -0.15 0.00 0.01 0.00 0.00 72.50 71.54 3f1f s THR 58 CO 0.30 -0.21 0.22 -0.38 -0.69 0.00 0.00 174.62 173.85 3f1f n ILE 59 N 4.86 1.00 -3.13 1.82 5.41 0.20 -0.22 119.36 129.29 3f1f n ILE 59 Ca 0.07 -0.50 -0.19 0.00 1.00 0.00 0.00 62.75 63.13 3f1f n ILE 59 Cb 0.52 -0.13 0.02 0.00 -0.71 0.00 0.00 39.64 39.33 3f1f n ILE 59 CO 0.00 0.00 0.00 -0.31 0.00 0.00 0.00 176.55 176.24 3f1f s TYR 60 N -1.60 2.22 0.32 1.39 2.02 -0.91 0.54 117.35 121.33 3f1f s TYR 60 Ca 0.61 -0.56 0.15 0.00 -0.37 0.00 0.00 57.07 56.90 3f1f s TYR 60 Cb -0.64 -2.27 0.73 0.00 -0.40 0.00 0.00 41.96 39.38 3f1f s TYR 60 CO 0.61 -0.66 1.80 0.00 -1.57 0.00 0.00 175.55 175.74 3f1f h ALA 61 N 0.52 1.24 -0.06 3.71 0.00 -1.60 0.15 119.26 123.22 3f1f h ALA 61 Ca -0.36 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.20 3f1f h ALA 61 Cb 1.28 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3f1f h ALA 61 CO 0.46 0.48 0.00 -0.40 0.00 0.00 0.00 179.25 179.79 3f1f n ASP 62 N -3.90 0.72 -1.24 0.00 5.75 -1.26 -4.85 116.55 111.77 3f1f n ASP 62 Ca -0.01 -2.03 -0.12 0.00 -0.01 0.00 0.00 54.79 52.62 3f1f n ASP 62 Cb 0.44 -0.21 -0.02 0.00 -1.03 0.00 0.00 41.12 40.30 3f1f n ASP 62 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3f1f n ARG 63 N -0.18 -0.92 0.00 0.11 1.74 0.54 -5.01 116.66 112.94 3f1f n ARG 63 Ca 0.02 0.68 0.00 0.00 -0.77 0.00 0.00 57.85 57.78 3f1f n ARG 63 Cb 0.15 -4.80 0.00 0.00 -1.02 0.00 0.00 32.46 26.80 3f1f n ARG 63 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3f1f n SER 64 N -0.18 0.00 -3.62 0.55 2.88 -1.23 -4.63 113.62 107.39 3f1f n SER 64 Ca -0.14 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.36 3f1f n SER 64 Cb 0.55 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.97 3f1f n SER 64 CO 0.00 0.00 0.00 0.72 -1.23 0.00 0.00 175.04 174.53 3f1f s PHE 65 N 2.31 -0.13 -0.54 0.66 -0.00 -1.26 -2.14 117.98 116.88 3f1f s PHE 65 Ca 0.00 0.21 -0.18 0.00 -0.00 0.00 0.00 56.93 56.96 3f1f s PHE 65 Cb 0.00 0.49 0.09 0.00 -0.00 0.00 0.00 43.02 43.60 3f1f s PHE 65 CO 0.00 -0.13 0.59 0.99 -0.00 0.00 0.00 175.22 176.67 3f1f s THR 66 N -1.21 4.99 -0.39 -4.49 2.01 0.69 -4.79 115.64 112.45 3f1f s THR 66 Ca 0.06 -0.99 -0.02 0.00 0.31 0.00 0.00 61.69 61.05 3f1f s THR 66 Cb -0.01 -4.35 0.20 0.00 0.01 0.00 0.00 72.50 68.36 3f1f s THR 66 CO -0.05 -0.90 2.20 2.22 -0.69 0.00 0.00 174.62 177.40 3f1f n PHE 67 N 5.86 1.73 -1.62 4.92 -1.74 -1.26 -2.34 117.46 123.01 3f1f n PHE 67 Ca -0.10 -2.07 -0.38 0.00 -0.56 0.00 0.00 57.45 54.33 3f1f n PHE 67 Cb 0.43 -1.11 -0.03 0.00 1.52 0.00 0.00 39.48 40.29 3f1f n PHE 67 CO 0.00 0.00 0.00 0.08 -0.56 0.00 0.00 176.76 176.28 3f1f s VAL 68 N -2.55 3.05 0.32 1.97 1.01 -1.24 -4.82 120.40 118.14 3f1f s VAL 68 Ca 0.41 0.04 -0.29 0.00 0.00 0.00 0.00 61.98 62.14 3f1f s VAL 68 Cb 0.30 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.49 3f1f s VAL 68 CO -0.06 -0.08 1.24 0.28 0.00 0.00 0.00 175.10 176.48 3f1f s THR 69 N 10.71 2.94 0.27 3.92 -1.32 -1.26 -1.28 115.64 129.62 3f1f s THR 69 Ca 0.96 0.93 0.03 0.00 -1.21 0.00 0.00 61.69 62.41 3f1f s THR 69 Cb -0.22 -3.59 -0.06 0.00 -1.51 0.00 0.00 72.50 67.13 3f1f s THR 69 CO 0.29 0.21 0.03 -0.54 -2.21 0.00 0.00 174.62 172.40 3f1f s LYS 70 N -1.75 1.46 0.09 7.08 -0.14 -1.21 -4.91 119.74 120.36 3f1f s LYS 70 Ca 0.48 -1.77 -0.31 0.00 -1.36 0.00 0.00 55.97 53.01 3f1f s LYS 70 Cb -0.37 -0.66 -0.08 0.00 -1.68 0.00 0.00 37.83 35.04 3f1f s LYS 70 CO 0.49 -0.15 1.46 0.95 -0.76 0.00 0.00 175.35 177.33 3f1f s THR 71 N -3.42 3.28 0.35 2.17 -4.23 -1.26 -3.64 115.64 108.90 3f1f s THR 71 Ca 0.33 0.84 -0.25 0.00 -1.18 0.00 0.00 61.69 61.43 3f1f s THR 71 Cb 0.07 -3.54 -0.13 0.00 1.34 0.00 0.00 72.50 70.24 3f1f s THR 71 CO 0.12 0.04 0.82 -2.65 -0.54 0.00 0.00 174.62 172.40 3f1f n PRO 72 N 4.57 0.97 -0.67 3.99 -0.02 -1.26 -4.42 135.00 138.16 3f1f n PRO 72 Ca 0.13 0.35 -0.31 0.00 -2.02 0.00 0.00 63.50 61.64 3f1f n PRO 72 Cb 0.42 -1.70 0.17 0.00 -0.02 0.00 0.00 33.50 32.37 3f1f n PRO 72 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3f1f n PRO 73 N 0.57 -0.69 -0.33 0.52 -0.02 -1.26 -4.69 135.00 129.10 3f1f n PRO 73 Ca 0.11 -0.14 0.06 0.00 -2.02 0.00 0.00 63.50 61.51 3f1f n PRO 73 Cb 0.35 -2.25 0.22 0.00 -0.02 0.00 0.00 33.50 31.81 3f1f n PRO 73 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3f1f h ALA 74 N -1.94 1.40 -0.53 3.55 0.00 -1.99 -0.25 119.26 119.50 3f1f h ALA 74 Ca -0.45 0.04 0.05 0.00 0.00 0.00 0.00 54.91 54.54 3f1f h ALA 74 Cb 1.28 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 3f1f h ALA 74 CO 0.41 0.14 0.35 0.66 0.00 0.00 0.00 179.25 180.81 3f1f h SER 75 N 0.88 0.47 0.14 0.00 4.64 -1.95 -1.82 113.55 115.92 3f1f h SER 75 Ca 0.47 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.78 3f1f h SER 75 Cb 0.49 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3f1f h SER 75 CO -0.28 0.31 -0.07 0.22 -0.87 0.00 0.00 176.83 176.15 3f1f h TYR 76 N 0.54 -0.18 -0.75 4.77 3.20 -1.36 -2.76 116.97 120.42 3f1f h TYR 76 Ca 0.22 -0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.10 3f1f h TYR 76 Cb 0.21 0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.50 3f1f h TYR 76 CO -0.00 0.03 0.49 -0.07 -1.64 0.00 0.00 178.16 176.97 3f1f h LEU 77 N -0.36 0.84 -0.44 2.82 4.07 -1.21 -2.21 115.31 118.82 3f1f h LEU 77 Ca -0.02 -0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.91 3f1f h LEU 77 Cb 0.29 -0.20 -0.02 0.00 1.08 0.00 0.00 40.66 41.80 3f1f h LEU 77 CO 0.03 0.60 0.21 0.40 -1.08 0.00 0.00 178.44 178.60 3f1f h ILE 78 N 0.99 1.18 0.00 1.22 5.03 -1.34 -1.54 117.51 123.06 3f1f h ILE 78 Ca 0.28 -0.52 0.00 0.00 -0.12 0.00 0.00 64.86 64.50 3f1f h ILE 78 Cb -0.08 0.72 0.00 0.00 -3.03 0.00 0.00 36.82 34.43 3f1f h ILE 78 CO -0.08 0.20 0.00 -2.11 -0.68 0.00 0.00 178.15 175.48 3f1f n ARG 79 N -4.65 0.70 0.24 2.37 1.85 -1.05 -1.19 116.66 114.93 3f1f n ARG 79 Ca 0.01 0.01 0.16 0.00 -1.00 0.00 0.00 57.85 57.03 3f1f n ARG 79 Cb 0.12 -1.50 0.59 0.00 -1.05 0.00 0.00 32.46 30.62 3f1f n ARG 79 CO 0.00 0.00 0.00 -0.22 -0.01 0.00 0.00 177.63 177.40 3f1f h LYS 80 N 0.00 0.00 0.00 2.89 3.11 -0.64 -2.44 116.57 119.48 3f1f h LYS 80 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 3f1f h LYS 80 Cb 0.09 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.32 3f1f h LYS 80 CO 0.00 0.00 -0.51 0.00 -2.81 0.00 0.00 179.45 176.13 3f1f n ALA 81 N -2.02 0.44 0.75 5.00 0.00 -0.33 -4.41 120.51 119.94 3f1f n ALA 81 Ca 0.01 -0.42 0.09 0.00 0.00 0.00 0.00 53.44 53.12 3f1f n ALA 81 Cb 0.32 0.02 0.43 0.00 0.00 0.00 0.00 19.45 20.21 3f1f n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3f1f n ALA 82 N -3.61 1.91 -1.82 0.00 0.00 -1.18 -4.87 120.51 110.94 3f1f n ALA 82 Ca -0.07 -0.07 -0.08 0.00 0.00 0.00 0.00 53.44 53.21 3f1f n ALA 82 Cb 0.26 -1.30 -0.02 0.00 0.00 0.00 0.00 19.45 18.40 3f1f n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f1f n GLY 83 N 0.34 0.40 0.00 0.00 0.00 -0.95 -5.03 105.19 99.96 3f1f n GLY 83 Ca 0.06 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.50 3f1f n GLY 83 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3f1f n LEU 84 N -1.10 0.00 -0.74 0.99 4.77 -1.06 -5.05 117.00 114.81 3f1f n LEU 84 Ca -0.09 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 55.87 3f1f n LEU 84 Cb 0.46 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 3f1f n LEU 84 CO 0.12 0.00 0.27 -1.84 -1.33 0.00 0.00 177.39 174.61 3f1f n GLU 85 N 0.00 0.00 0.00 3.23 0.00 -1.26 -4.82 120.64 117.78 3f1f n GLU 85 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 57.16 56.56 3f1f n GLU 85 Cb 0.00 0.10 0.00 0.00 0.00 0.00 0.00 31.44 31.54 3f1f n GLU 85 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 3f1f n LYS 86 N 0.04 0.00 -3.85 3.44 2.85 -1.26 -5.14 118.16 114.24 3f1f n LYS 86 Ca -0.08 0.00 -0.09 0.00 -1.05 0.00 0.00 58.31 57.08 3f1f n LYS 86 Cb 0.64 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.98 3f1f n LYS 86 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 3f1f s GLY 87 N 0.00 0.15 0.40 2.58 0.00 -1.26 -4.82 107.32 104.37 3f1f s GLY 87 Ca 0.00 -0.50 -0.27 0.00 0.00 0.00 0.00 44.72 43.95 3f1f s GLY 87 CO 0.00 -0.43 1.43 0.00 0.00 0.00 0.00 173.10 174.10 3f1f s ALA 88 N -3.93 3.41 0.28 3.20 0.00 -0.36 -4.91 121.76 119.45 3f1f s ALA 88 Ca 0.14 1.46 -0.02 0.00 0.00 0.00 0.00 51.96 53.55 3f1f s ALA 88 Cb -0.01 -3.57 0.39 0.00 0.00 0.00 0.00 23.12 19.93 3f1f s ALA 88 CO 0.01 -1.04 1.84 0.45 0.00 0.00 0.00 175.76 177.03 3f1f h HIS 89 N 2.76 0.90 -2.33 0.00 3.86 -1.96 -3.39 115.15 115.00 3f1f h HIS 89 Ca -0.51 -0.07 -0.51 0.00 -1.16 0.00 0.00 60.37 58.13 3f1f h HIS 89 Cb 1.25 -0.27 -0.36 0.00 1.06 0.00 0.00 27.41 29.09 3f1f h HIS 89 CO 0.52 0.72 -0.81 0.15 0.86 0.00 0.00 177.93 179.38 3f1f s LYS 90 N -5.30 0.63 -0.81 2.45 1.02 -1.26 -5.08 119.74 111.38 3f1f s LYS 90 Ca -0.10 -1.28 -0.23 0.00 0.02 0.00 0.00 55.97 54.39 3f1f s LYS 90 Cb 0.16 -1.11 -0.18 0.00 -0.52 0.00 0.00 37.83 36.18 3f1f s LYS 90 CO 0.80 -1.23 2.37 -2.30 -0.92 0.00 0.00 175.35 174.07 3f1f n PRO 91 N 3.93 0.47 0.00 -1.68 -0.02 -1.26 -3.59 135.00 132.86 3f1f n PRO 91 Ca 0.14 -0.60 0.00 0.00 -2.02 0.00 0.00 63.50 61.02 3f1f n PRO 91 Cb 0.41 -3.10 0.00 0.00 -0.02 0.00 0.00 33.50 30.79 3f1f n PRO 91 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3f1f n GLY 92 N 6.49 -1.85 0.07 -1.23 0.00 -1.26 -4.92 105.19 102.49 3f1f n GLY 92 Ca 0.51 0.61 -0.13 0.00 0.00 0.00 0.00 46.02 47.01 3f1f n GLY 92 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3f1f h ARG 93 N 0.00 -0.03 -6.92 1.61 -0.00 -2.04 -3.45 114.38 103.55 3f1f h ARG 93 Ca 0.00 0.00 -0.49 0.00 -0.00 0.00 0.00 59.98 59.49 3f1f h ARG 93 Cb 0.00 0.01 0.02 0.00 -0.00 0.00 0.00 29.97 30.00 3f1f h ARG 93 CO 0.00 0.53 0.14 -1.83 -0.00 0.00 0.00 179.97 178.80 3f1f s GLU 94 N -3.84 3.66 -0.30 0.08 -1.05 -1.24 -5.07 118.70 110.94 3f1f s GLU 94 Ca -0.16 0.38 0.04 0.00 -0.15 0.00 0.00 54.97 55.08 3f1f s GLU 94 Cb 0.01 -2.36 0.18 0.00 -0.44 0.00 0.00 34.13 31.52 3f1f s GLU 94 CO 0.65 -0.15 0.50 0.21 0.95 0.00 0.00 175.26 177.42 3f1f s LYS 95 N -4.33 0.50 0.24 -4.83 2.20 -1.26 -4.69 119.74 107.57 3f1f s LYS 95 Ca 0.50 0.29 -0.04 0.00 -0.36 0.00 0.00 55.97 56.35 3f1f s LYS 95 Cb -0.10 -0.04 0.26 0.00 -1.51 0.00 0.00 37.83 36.44 3f1f s LYS 95 CO 0.39 -1.05 1.77 -0.39 -0.36 0.00 0.00 175.35 175.71 3f1f h VAL 96 N 6.02 1.25 -4.02 4.02 -1.51 -1.91 -3.46 116.25 116.65 3f1f h VAL 96 Ca -0.04 -0.91 -0.12 0.00 -1.23 0.00 0.00 66.70 64.40 3f1f h VAL 96 Cb 1.15 0.62 -0.13 0.00 -2.13 0.00 0.00 31.29 30.80 3f1f h VAL 96 CO 0.20 0.34 -0.41 -0.83 -1.23 0.00 0.00 177.57 175.64 3f1f s GLY 97 N -3.56 0.56 -0.16 5.19 0.00 -1.26 -5.12 107.32 102.98 3f1f s GLY 97 Ca -0.11 -1.01 -0.04 0.00 0.00 0.00 0.00 44.72 43.56 3f1f s GLY 97 CO 0.82 -0.97 0.08 -1.60 0.00 0.00 0.00 173.10 171.43 3f1f s ARG 98 N -3.98 0.16 0.00 2.90 3.00 -1.26 -3.76 118.95 116.01 3f1f s ARG 98 Ca 0.17 -0.09 0.00 0.00 -1.00 0.00 0.00 55.73 54.81 3f1f s ARG 98 Cb 0.05 -1.73 0.00 0.00 0.00 0.00 0.00 34.95 33.26 3f1f s ARG 98 CO -0.01 -0.62 0.00 0.44 0.00 0.00 0.00 175.30 175.11 3f1f n ILE 99 N 5.24 0.00 -4.66 4.11 -5.35 -0.40 -4.96 119.36 113.34 3f1f n ILE 99 Ca -0.07 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.07 3f1f n ILE 99 Cb 0.49 -0.78 -0.12 0.00 -1.74 0.00 0.00 39.64 37.49 3f1f n ILE 99 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3f1f s THR 100 N 0.67 3.59 -2.00 7.28 -4.23 -1.26 -3.19 115.64 116.50 3f1f s THR 100 Ca 0.00 -0.52 0.12 0.00 -1.18 0.00 0.00 61.69 60.11 3f1f s THR 100 Cb 0.00 -2.46 0.33 0.00 1.34 0.00 0.00 72.50 71.71 3f1f s THR 100 CO 0.00 0.59 1.16 -2.67 -0.54 0.00 0.00 174.62 173.16 3f1f n TRP 101 N 2.32 0.00 -0.10 3.99 4.27 -1.12 -2.46 117.44 124.34 3f1f n TRP 101 Ca -0.18 0.00 -0.20 0.00 -3.89 0.00 0.00 57.50 53.24 3f1f n TRP 101 Cb 0.53 0.00 -0.12 0.00 -1.36 0.00 0.00 31.31 30.36 3f1f n TRP 101 CO 0.00 0.00 0.00 1.49 -2.29 0.00 0.00 177.69 176.89 3f1f h GLU 102 N 0.00 0.00 -0.39 -2.67 4.81 -1.94 -3.38 114.58 111.01 3f1f h GLU 102 Ca 0.00 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 3f1f h GLU 102 Cb 0.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 3f1f h GLU 102 CO 0.00 0.97 0.09 1.96 -0.73 0.00 0.00 179.01 181.30 3f1f h GLN 103 N -1.00 0.58 -0.85 1.92 1.08 -1.90 -2.11 115.11 112.82 3f1f h GLN 103 Ca -0.27 -0.10 0.17 0.00 -1.45 0.00 0.00 58.65 57.01 3f1f h GLN 103 Cb 1.21 -0.10 -0.06 0.00 -0.05 0.00 0.00 27.48 28.48 3f1f h GLN 103 CO -0.16 0.54 0.56 0.28 -0.95 0.00 0.00 178.83 179.10 3f1f h VAL 104 N 0.57 0.75 0.35 -0.54 2.07 -1.73 -3.01 116.25 114.71 3f1f h VAL 104 Ca 0.13 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 3f1f h VAL 104 Cb 0.23 0.23 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 3f1f h VAL 104 CO -0.00 0.09 -0.17 -0.07 0.02 0.00 0.00 177.57 177.43 3f1f h LEU 105 N 0.47 -0.40 -1.16 2.57 3.38 -1.56 0.13 115.31 118.75 3f1f h LEU 105 Ca 0.44 -0.14 -0.03 0.00 0.09 0.00 0.00 57.88 58.24 3f1f h LEU 105 Cb 0.97 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 3f1f h LEU 105 CO -0.17 -0.06 -0.13 1.05 0.09 0.00 0.00 178.44 179.22 3f1f h GLU 106 N -0.77 0.00 0.00 1.13 4.11 -1.66 -0.02 114.58 117.37 3f1f h GLU 106 Ca -0.05 0.00 -0.16 0.00 0.07 0.00 0.00 59.36 59.22 3f1f h GLU 106 Cb 0.51 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.74 3f1f h GLU 106 CO 0.08 0.13 -1.07 0.97 0.07 0.00 0.00 179.01 179.19 3f1f h ILE 107 N 0.00 0.78 0.00 -1.06 6.09 -1.52 -3.25 117.51 118.55 3f1f h ILE 107 Ca -0.00 -2.28 -0.14 0.00 -1.37 0.00 0.00 64.86 61.07 3f1f h ILE 107 Cb 0.69 2.28 -0.02 0.00 0.47 0.00 0.00 36.82 40.24 3f1f h ILE 107 CO 0.02 0.45 -0.67 0.00 -3.07 0.00 0.00 178.15 174.88 3f1f h ALA 108 N 1.37 0.80 -0.03 0.18 0.00 0.03 -2.73 119.26 118.89 3f1f h ALA 108 Ca -0.10 -0.61 -0.06 0.00 0.00 0.00 0.00 54.91 54.15 3f1f h ALA 108 Cb 1.57 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 3f1f h ALA 108 CO 0.06 0.83 -0.25 0.87 0.00 0.00 0.00 179.25 180.76 3f1f h LYS 109 N 0.00 0.05 0.00 0.00 1.57 -1.09 -0.80 116.57 116.30 3f1f h LYS 109 Ca -0.01 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3f1f h LYS 109 Cb 1.25 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.56 3f1f h LYS 109 CO 0.09 0.30 -0.01 1.96 -0.57 0.00 0.00 179.45 181.22 3f1f h GLN 110 N 0.05 0.00 0.00 3.15 1.08 -1.52 -3.14 115.11 114.72 3f1f h GLN 110 Ca 0.01 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.13 3f1f h GLN 110 Cb 0.48 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.89 3f1f h GLN 110 CO 0.03 0.01 -1.64 1.17 -0.95 0.00 0.00 178.83 177.45 3f1f n LYS 111 N -3.11 0.64 0.22 1.46 4.81 -0.34 -4.36 118.16 117.49 3f1f n LYS 111 Ca -0.00 0.00 0.10 0.00 -0.87 0.00 0.00 58.31 57.54 3f1f n LYS 111 Cb 0.25 -1.67 0.43 0.00 0.02 0.00 0.00 35.03 34.06 3f1f n LYS 111 CO 0.00 0.00 0.00 1.98 1.17 0.00 0.00 177.40 180.55 3f1f h MET 112 N 0.00 0.00 0.00 1.64 4.05 -1.40 -2.07 114.93 117.15 3f1f h MET 112 Ca -0.10 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.32 3f1f h MET 112 Cb 1.26 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.06 3f1f h MET 112 CO 0.01 0.20 0.00 -0.35 0.23 0.00 0.00 176.91 177.00 3f1f n PRO 113 N -3.31 0.19 0.00 0.39 -0.04 -1.26 -3.39 135.00 127.58 3f1f n PRO 113 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 3f1f n PRO 113 Cb 0.45 -1.21 0.00 0.00 -0.04 0.00 0.00 33.50 32.70 3f1f n PRO 113 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3f1f n ASP 114 N -0.71 0.00 -4.48 3.54 8.00 -1.18 -5.05 116.55 116.67 3f1f n ASP 114 Ca 0.02 0.00 -0.34 0.00 0.71 0.00 0.00 54.79 55.18 3f1f n ASP 114 Cb 0.01 0.03 0.11 0.00 -0.02 0.00 0.00 41.12 41.24 3f1f n ASP 114 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 3f1f n LEU 115 N -1.84 1.00 0.04 0.64 0.00 -0.78 -4.95 117.00 111.11 3f1f n LEU 115 Ca 0.00 0.46 0.02 0.00 0.00 0.00 0.00 56.01 56.49 3f1f n LEU 115 Cb 0.00 -1.27 -0.08 0.00 0.00 0.00 0.00 43.42 42.08 3f1f n LEU 115 CO 0.00 -3.10 -0.30 -0.46 0.00 0.00 0.00 177.39 173.53 3f1f n ASN 116 N -1.39 0.80 -4.58 1.96 6.94 -1.26 -4.86 115.26 112.87 3f1f n ASN 116 Ca 0.09 0.35 -0.52 0.00 -0.02 0.00 0.00 54.58 54.48 3f1f n ASN 116 Cb 0.52 0.29 -0.06 0.00 -2.36 0.00 0.00 39.78 38.17 3f1f n ASN 116 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 3f1f n THR 117 N -2.83 0.17 0.13 5.53 -1.04 -1.26 -4.93 114.28 110.05 3f1f n THR 117 Ca -0.09 -0.04 -0.05 0.00 -2.04 0.00 0.00 64.05 61.82 3f1f n THR 117 Cb 0.80 -0.77 -0.03 0.00 -1.82 0.00 0.00 70.33 68.52 3f1f n THR 117 CO 0.00 0.00 0.00 0.71 -0.64 0.00 0.00 175.07 175.14 3f1f h THR 118 N 3.17 0.00 -2.20 12.58 1.35 -1.99 -3.46 112.91 122.36 3f1f h THR 118 Ca -0.47 -0.08 -0.47 0.00 -0.55 0.00 0.00 66.41 64.84 3f1f h THR 118 Cb 1.34 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 67.75 3f1f h THR 118 CO 0.75 0.00 -0.45 1.51 -0.25 0.00 0.00 175.52 177.09 3f1f s ASP 119 N -2.97 6.19 0.05 5.36 3.84 -1.26 -5.00 116.67 122.88 3f1f s ASP 119 Ca -0.05 0.02 0.25 0.00 -0.00 0.00 0.00 52.55 52.77 3f1f s ASP 119 Cb 0.01 -1.79 1.04 0.00 -1.38 0.00 0.00 42.92 40.80 3f1f s ASP 119 CO 0.15 -0.06 1.80 -0.11 -0.00 0.00 0.00 175.17 176.95 3f1f n LEU 120 N -1.36 0.16 0.05 2.11 7.94 -1.26 -2.55 117.00 122.09 3f1f n LEU 120 Ca -0.09 0.52 -0.13 0.00 -1.11 0.00 0.00 56.01 55.20 3f1f n LEU 120 Cb 0.57 -0.48 -0.02 0.00 0.53 0.00 0.00 43.42 44.02 3f1f n LEU 120 CO 0.45 -0.11 0.26 -0.08 -1.11 0.00 0.00 177.39 176.80 3f1f h GLU 121 N 0.00 0.48 0.00 1.96 4.81 -2.00 -2.29 114.58 117.55 3f1f h GLU 121 Ca 0.00 -0.45 -0.09 0.00 -0.13 0.00 0.00 59.36 58.69 3f1f h GLU 121 Cb 0.48 0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.96 3f1f h GLU 121 CO 0.00 1.09 -0.43 0.00 -0.73 0.00 0.00 179.01 178.94 3f1f h ALA 122 N 0.77 0.75 -0.03 2.92 0.00 -1.96 -3.05 119.26 118.66 3f1f h ALA 122 Ca -0.06 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3f1f h ALA 122 Cb 1.45 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.17 3f1f h ALA 122 CO 0.15 0.54 0.00 0.00 0.00 0.00 0.00 179.25 179.94 3f1f n ALA 123 N -2.22 2.58 0.01 0.00 0.00 -1.06 -3.25 120.51 116.58 3f1f n ALA 123 Ca 0.02 -0.18 -0.21 0.00 0.00 0.00 0.00 53.44 53.06 3f1f n ALA 123 Cb 0.68 -1.23 -0.14 0.00 0.00 0.00 0.00 19.45 18.76 3f1f n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3f1f h ALA 124 N 3.60 0.20 -0.06 0.00 0.00 -1.29 -3.30 119.26 118.41 3f1f h ALA 124 Ca 0.00 -1.12 -0.12 0.00 0.00 0.00 0.00 54.91 53.66 3f1f h ALA 124 Cb 0.09 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 3f1f h ALA 124 CO 0.00 0.87 -0.52 0.00 0.00 0.00 0.00 179.25 179.60 3f1f h ARG 125 N -0.28 0.18 -0.03 0.00 -0.00 -1.69 -1.37 114.38 111.19 3f1f h ARG 125 Ca -0.32 -0.10 -0.00 0.00 -0.50 0.00 0.00 59.98 59.05 3f1f h ARG 125 Cb 1.78 0.01 -0.00 0.00 0.00 0.00 0.00 29.97 31.76 3f1f h ARG 125 CO 0.05 0.66 0.00 0.52 0.00 0.00 0.00 179.97 181.21 3f1f h MET 126 N 0.14 0.05 -0.04 0.04 2.86 -1.72 0.92 114.93 117.18 3f1f h MET 126 Ca 0.00 -0.01 -0.20 0.00 -2.06 0.00 0.00 59.70 57.43 3f1f h MET 126 Cb 0.97 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.62 3f1f h MET 126 CO 0.08 0.30 -0.82 0.82 1.06 0.00 0.00 176.91 178.34 3f1f h ILE 127 N -0.21 1.40 -0.50 -1.22 1.08 -1.63 0.12 117.51 116.56 3f1f h ILE 127 Ca 0.01 -2.32 -0.09 0.00 -0.39 0.00 0.00 64.86 62.07 3f1f h ILE 127 Cb 0.27 2.27 -0.02 0.00 -3.07 0.00 0.00 36.82 36.28 3f1f h ILE 127 CO 0.00 0.69 -0.05 0.00 -0.69 0.00 0.00 178.15 178.11 3f1f h ALA 128 N 0.88 0.67 -0.32 1.87 0.00 -1.24 -2.01 119.26 119.10 3f1f h ALA 128 Ca -0.05 -0.31 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 3f1f h ALA 128 Cb 1.43 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 3f1f h ALA 128 CO 0.14 0.52 -0.09 0.78 0.00 0.00 0.00 179.25 180.61 3f1f h GLY 129 N 0.76 0.58 0.99 0.00 0.00 0.11 0.31 103.07 105.82 3f1f h GLY 129 Ca 0.13 -0.39 -0.12 0.00 0.00 0.00 0.00 47.33 46.96 3f1f h GLY 129 CO 0.03 0.36 -0.25 1.48 0.00 0.00 0.00 176.54 178.17 3f1f h SER 130 N 0.50 0.79 0.46 0.19 4.64 -0.90 -2.62 113.55 116.61 3f1f h SER 130 Ca 0.10 -0.44 -0.05 0.00 -0.47 0.00 0.00 61.79 60.92 3f1f h SER 130 Cb 0.46 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.32 3f1f h SER 130 CO 0.02 1.07 -0.25 0.00 -0.87 0.00 0.00 176.83 176.80 3f1f h ALA 131 N 0.75 1.30 0.11 5.18 0.00 -0.93 -3.18 119.26 122.49 3f1f h ALA 131 Ca 0.06 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3f1f h ALA 131 Cb 0.81 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3f1f h ALA 131 CO 0.07 0.32 -0.05 0.00 0.00 0.00 0.00 179.25 179.58 3f1f h ARG 132 N 0.00 -0.15 -2.69 0.00 3.08 -0.10 -2.47 114.38 112.05 3f1f h ARG 132 Ca -0.00 0.01 -0.50 0.00 0.07 0.00 0.00 59.98 59.55 3f1f h ARG 132 Cb 0.55 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 3f1f h ARG 132 CO 0.03 -0.10 2.45 0.43 -1.07 0.00 0.00 179.97 181.72 3f1f n SER 133 N -2.41 7.50 0.00 7.04 7.64 -1.01 -2.76 113.62 129.61 3f1f n SER 133 Ca -0.02 -2.53 0.00 0.00 1.01 0.00 0.00 58.87 57.33 3f1f n SER 133 Cb 0.06 -1.49 0.00 0.00 -1.01 0.00 0.00 64.21 61.77 3f1f n SER 133 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 3f1f n MET 134 N 3.25 0.00 -0.79 1.43 0.00 -1.20 -4.95 117.12 114.85 3f1f n MET 134 Ca 0.66 0.00 0.00 0.00 0.00 0.00 0.00 57.70 58.36 3f1f n MET 134 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.67 3f1f n MET 134 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3f1f n GLY 135 N 0.00 0.57 3.54 3.17 0.00 -1.11 -1.23 105.19 110.13 3f1f n GLY 135 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 46.02 45.82 3f1f n GLY 135 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3f1f s VAL 136 N -1.87 -0.30 0.13 1.61 0.11 -0.94 -2.88 120.40 116.27 3f1f s VAL 136 Ca 0.00 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.07 3f1f s VAL 136 Cb 0.00 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.87 3f1f s VAL 136 CO 0.00 0.00 0.15 -0.62 -3.33 0.00 0.00 175.10 171.30 3f1f n GLU 137 N 4.43 1.05 -1.16 1.54 1.02 -1.25 -3.80 120.64 122.48 3f1f n GLU 137 Ca -0.14 -0.75 0.00 0.00 -0.02 0.00 0.00 57.16 56.25 3f1f n GLU 137 Cb 0.55 -0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.96 3f1f n GLU 137 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 3f1f n VAL 138 N -1.12 0.00 -3.74 2.62 0.24 -1.26 -1.28 118.33 113.80 3f1f n VAL 138 Ca 0.02 0.00 -0.13 0.00 -2.04 0.00 0.00 64.34 62.19 3f1f n VAL 138 Cb 0.14 0.00 -0.10 0.00 -1.47 0.00 0.00 33.84 32.41 3f1f n VAL 138 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 3f1f s VAL 139 N -1.87 -0.00 0.24 3.34 -7.23 -1.19 -4.91 120.40 108.77 3f1f s VAL 139 Ca 0.00 0.01 0.01 0.00 -1.81 0.00 0.00 61.98 60.18 3f1f s VAL 139 Cb 0.00 -0.55 -0.03 0.00 0.56 0.00 0.00 36.38 36.36 3f1f s VAL 139 CO 0.00 0.00 0.19 -0.83 -0.31 0.00 0.00 175.10 174.16 3f1f s GLY 140 N 0.28 1.65 0.00 2.32 0.00 -1.26 -2.80 107.32 107.50 3f1f s GLY 140 Ca -0.01 -1.76 0.00 0.00 0.00 0.00 0.00 44.72 42.95 3f1f s GLY 140 CO -0.00 -1.38 0.00 0.00 0.00 0.00 0.00 173.10 171.72 3f1f n ALA 141 N -0.38 2.85 0.15 3.20 0.00 -1.26 -5.00 120.51 120.08 3f1f n ALA 141 Ca 0.03 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.41 3f1f n ALA 141 Cb 0.65 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.07 3f1f n ALA 141 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3f1f h PRO 142 N 0.00 -0.41 0.00 0.00 0.11 -2.04 -3.48 132.00 126.19 3f1f h PRO 142 Ca 0.00 0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.14 3f1f h PRO 142 Cb 0.00 0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.20 3f1f h PRO 142 CO 0.00 -0.27 0.00 0.39 -0.21 0.00 0.00 178.00 177.91 3f1f n GLU 143 N -3.91 0.00 -0.04 1.05 4.71 -1.26 -3.82 120.64 117.37 3f1f n GLU 143 Ca -0.05 0.00 -0.14 0.00 -0.01 0.00 0.00 57.16 56.96 3f1f n GLU 143 Cb 0.17 0.00 -0.12 0.00 -1.01 0.00 0.00 31.44 30.48 3f1f n GLU 143 CO 0.00 0.00 0.00 -0.24 0.09 0.00 0.00 177.13 176.98 3f1f h VAL 144 N 0.00 1.62 0.00 2.62 3.04 -2.05 -3.48 116.25 117.99 3f1f h VAL 144 Ca 0.00 -1.83 0.00 0.00 -1.01 0.00 0.00 66.70 63.86 3f1f h VAL 144 Cb 0.00 2.86 0.00 0.00 -2.01 0.00 0.00 31.29 32.14 3f1f h VAL 144 CO 0.00 0.48 0.00 1.17 -1.01 0.00 0.00 177.57 178.21 3f1f n LYS 145 N -4.71 0.00 0.00 4.17 4.81 -1.25 -5.01 118.16 116.17 3f1f n LYS 145 Ca -0.09 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.35 3f1f n LYS 145 Cb 0.38 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.43 3f1f n LYS 145 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 3f1f n ASP 146 N 6.53 -3.69 0.00 3.14 2.03 -1.26 -5.26 116.55 118.04 3f1f n ASP 146 Ca 0.00 0.00 0.15 0.00 0.52 0.00 0.00 54.79 55.46 3f1f n ASP 146 Cb 0.00 0.00 0.90 0.00 -0.72 0.00 0.00 41.12 41.30 3f1f n ASP 146 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28