#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2osq s LEU 8 N 0.00 2.07 0.52 -1.84 0.05 -1.26 -4.65 118.68 113.57 2osq s LEU 8 Ca 0.00 1.04 0.06 0.00 0.05 0.00 0.00 54.13 55.28 2osq s LEU 8 Cb 0.00 -3.40 0.03 0.00 -2.05 0.00 0.00 46.19 40.77 2osq s LEU 8 CO 0.00 -2.51 0.40 -0.44 -0.55 0.00 0.00 176.35 173.25 2osq s SER 9 N -3.96 4.69 -0.18 1.48 0.01 -1.26 -4.97 113.70 109.51 2osq s SER 9 Ca 0.63 -1.15 -0.24 0.00 1.31 0.00 0.00 55.95 56.51 2osq s SER 9 Cb -0.15 0.20 -0.21 0.00 0.21 0.00 0.00 66.02 66.07 2osq s SER 9 CO 0.54 -1.01 0.39 -1.13 0.41 0.00 0.00 173.24 172.43 2osq h ASN 10 N 0.82 0.00 -3.32 2.44 -1.24 -1.97 -3.44 115.58 108.86 2osq h ASN 10 Ca -0.38 -0.65 -0.60 0.00 0.71 0.00 0.00 56.30 55.38 2osq h ASN 10 Cb 1.29 0.00 -0.40 0.00 0.73 0.00 0.00 38.32 39.94 2osq h ASN 10 CO 0.57 1.31 -0.75 0.42 -1.29 0.00 0.00 177.43 177.68 2osq s THR 11 N -2.30 1.14 -0.30 -3.57 -4.23 -1.26 -4.26 115.64 100.86 2osq s THR 11 Ca -0.25 -2.19 -0.20 0.00 -1.18 0.00 0.00 61.69 57.88 2osq s THR 11 Cb 0.03 -1.81 0.20 0.00 1.34 0.00 0.00 72.50 72.26 2osq s THR 11 CO 0.61 -0.85 1.32 -0.60 -0.54 0.00 0.00 174.62 174.56 2osq s ARG 12 N 0.73 0.00 -0.14 3.99 3.52 -1.26 -4.49 118.95 121.31 2osq s ARG 12 Ca 0.16 0.01 0.01 0.00 -0.13 0.00 0.00 55.73 55.78 2osq s ARG 12 Cb -0.23 0.01 0.02 0.00 -1.56 0.00 0.00 34.95 33.19 2osq s ARG 12 CO -0.05 -0.00 -0.17 -0.51 -0.81 0.00 0.00 175.30 173.76 2osq s LEU 13 N 1.95 1.83 -0.27 -0.88 1.43 0.11 -0.59 118.68 122.25 2osq s LEU 13 Ca 0.00 -0.51 -0.17 0.00 -1.03 0.00 0.00 54.13 52.43 2osq s LEU 13 Cb -0.00 -1.24 -0.03 0.00 0.03 0.00 0.00 46.19 44.95 2osq s LEU 13 CO -0.16 -0.00 0.45 0.12 0.23 0.00 0.00 176.35 176.99 2osq s PHE 14 N 1.20 3.25 0.33 0.29 5.36 0.12 -0.04 117.98 128.48 2osq s PHE 14 Ca -0.01 0.49 0.07 0.00 -0.96 0.00 0.00 56.93 56.52 2osq s PHE 14 Cb -0.14 -2.67 -0.02 0.00 -0.34 0.00 0.00 43.02 39.86 2osq s PHE 14 CO -0.07 -0.28 0.40 0.08 -1.46 0.00 0.00 175.22 173.89 2osq s VAL 15 N 2.21 4.00 0.86 3.12 1.01 0.14 -1.31 120.40 130.42 2osq s VAL 15 Ca 0.18 -1.13 -0.12 0.00 0.00 0.00 0.00 61.98 60.91 2osq s VAL 15 Cb -0.16 -3.37 0.11 0.00 0.00 0.00 0.00 36.38 32.96 2osq s VAL 15 CO 0.10 -0.18 1.15 0.00 0.00 0.00 0.00 175.10 176.16 2osq s ARG 16 N -4.09 1.55 -0.03 2.72 1.70 -0.75 -2.16 118.95 117.88 2osq s ARG 16 Ca 0.42 0.27 -0.30 0.00 -0.47 0.00 0.00 55.73 55.65 2osq s ARG 16 Cb -0.08 -1.89 -0.05 0.00 -0.57 0.00 0.00 34.95 32.36 2osq s ARG 16 CO 0.29 -1.91 1.47 -1.25 -1.08 0.00 0.00 175.30 172.82 2osq s PRO 17 N -5.37 4.24 0.33 3.89 0.04 -1.26 -3.97 135.00 132.90 2osq s PRO 17 Ca 0.63 2.01 -0.01 0.00 0.04 0.00 0.00 61.00 63.67 2osq s PRO 17 Cb -0.13 -3.72 -0.04 0.00 0.04 0.00 0.00 34.50 30.65 2osq s PRO 17 CO 0.52 -0.68 0.55 -0.06 0.04 0.00 0.00 177.00 177.36 2osq s PHE 18 N 3.04 3.50 0.00 0.56 0.40 -1.26 -4.95 117.98 119.27 2osq s PHE 18 Ca 0.66 0.46 0.00 0.00 -0.60 0.00 0.00 56.93 57.45 2osq s PHE 18 Cb -0.31 -1.97 0.00 0.00 0.51 0.00 0.00 43.02 41.24 2osq s PHE 18 CO 0.26 0.13 0.00 -0.35 0.70 0.00 0.00 175.22 175.96 2osq n PRO 19 N -1.48 0.53 0.32 0.24 -0.04 -1.26 -4.56 135.00 128.75 2osq n PRO 19 Ca -0.04 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.57 2osq n PRO 19 Cb 0.55 0.00 0.79 0.00 -0.04 0.00 0.00 33.50 34.80 2osq n PRO 19 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 2osq h LEU 20 N 0.00 0.00 -2.43 1.53 8.10 -2.03 0.34 115.31 120.81 2osq h LEU 20 Ca 0.00 0.00 -0.08 0.00 0.11 0.00 0.00 57.88 57.91 2osq h LEU 20 Cb 0.00 0.00 -0.05 0.00 -0.44 0.00 0.00 40.66 40.17 2osq h LEU 20 CO 0.00 0.00 0.10 0.47 -4.11 0.00 0.00 178.44 174.90 2osq n ASP 21 N -2.80 3.25 -4.56 0.17 8.00 -1.26 -4.83 116.55 114.52 2osq n ASP 21 Ca -0.02 -2.54 -0.36 0.00 0.71 0.00 0.00 54.79 52.58 2osq n ASP 21 Cb 0.36 -0.61 -0.04 0.00 -0.02 0.00 0.00 41.12 40.81 2osq n ASP 21 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2osq s VAL 22 N -1.72 3.69 0.15 2.53 0.11 0.12 -4.79 120.40 120.49 2osq s VAL 22 Ca 0.26 -0.36 -0.09 0.00 -2.93 0.00 0.00 61.98 58.86 2osq s VAL 22 Cb 0.20 -4.61 -0.01 0.00 -1.53 0.00 0.00 36.38 30.44 2osq s VAL 22 CO 0.07 -1.53 0.26 0.00 -3.33 0.00 0.00 175.10 170.57 2osq s GLN 23 N 5.92 1.09 0.62 1.54 -2.07 -1.26 -4.89 119.66 120.61 2osq s GLN 23 Ca 0.54 -1.14 0.40 0.00 -1.82 0.00 0.00 55.36 53.34 2osq s GLN 23 Cb -0.05 0.37 1.99 0.00 -1.09 0.00 0.00 33.01 34.24 2osq s GLN 23 CO -0.00 -0.39 2.21 1.05 -1.32 0.00 0.00 175.29 176.84 2osq h GLU 24 N 2.59 0.00 0.02 9.60 4.11 -1.94 -2.97 114.58 125.98 2osq h GLU 24 Ca -0.32 0.00 0.03 0.00 0.07 0.00 0.00 59.36 59.13 2osq h GLU 24 Cb 1.22 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.44 2osq h GLU 24 CO 0.50 0.00 -0.21 1.03 0.07 0.00 0.00 179.01 180.40 2osq h SER 25 N 0.00 -0.61 -0.27 3.06 0.87 -1.95 0.35 113.55 115.00 2osq h SER 25 Ca -0.00 0.08 -0.11 0.00 -1.23 0.00 0.00 61.79 60.54 2osq h SER 25 Cb 0.22 0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 62.41 2osq h SER 25 CO 0.00 -0.28 -0.20 1.05 -0.53 0.00 0.00 176.83 176.87 2osq h GLU 26 N -0.35 0.73 -0.31 2.24 4.11 -1.83 -1.86 114.58 117.31 2osq h GLU 26 Ca 0.05 -0.28 -0.07 0.00 0.07 0.00 0.00 59.36 59.14 2osq h GLU 26 Cb 0.41 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 2osq h GLU 26 CO -0.18 0.87 -0.09 -0.07 0.07 0.00 0.00 179.01 179.61 2osq h LEU 27 N 0.64 0.49 -0.07 3.06 3.38 -1.42 0.12 115.31 121.52 2osq h LEU 27 Ca 0.10 -0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.82 2osq h LEU 27 Cb 0.69 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 41.31 2osq h LEU 27 CO 0.05 0.62 -0.47 0.78 0.09 0.00 0.00 178.44 179.51 2osq h ASN 28 N 0.47 0.53 1.28 -0.43 2.35 -0.06 0.30 115.58 120.03 2osq h ASN 28 Ca 0.09 -0.67 0.00 0.00 -0.55 0.00 0.00 56.30 55.17 2osq h ASN 28 Cb 0.45 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.67 2osq h ASN 28 CO 0.02 1.12 0.00 1.05 -1.65 0.00 0.00 177.43 177.98 2osq h GLU 29 N -0.01 0.00 0.00 0.81 4.11 -1.21 0.43 114.58 118.71 2osq h GLU 29 Ca -0.04 0.00 -0.09 0.00 0.07 0.00 0.00 59.36 59.30 2osq h GLU 29 Cb 1.13 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.37 2osq h GLU 29 CO 0.10 0.00 -0.91 -0.89 0.07 0.00 0.00 179.01 177.38 2osq n ILE 30 N -3.08 1.46 1.76 -1.06 5.41 0.42 -4.33 119.36 119.94 2osq n ILE 30 Ca 0.02 0.11 0.15 0.00 1.00 0.00 0.00 62.75 64.02 2osq n ILE 30 Cb 0.36 -2.27 0.79 0.00 -0.71 0.00 0.00 39.64 37.82 2osq n ILE 30 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2osq n PHE 31 N -4.52 0.00 0.28 1.39 3.01 0.10 -4.15 117.46 113.58 2osq n PHE 31 Ca -0.17 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 58.11 2osq n PHE 31 Cb 0.44 -0.05 -0.10 0.00 -0.01 0.00 0.00 39.48 39.77 2osq n PHE 31 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2osq h GLY 32 N 4.96 -1.20 -5.47 1.37 0.00 -0.22 -3.17 103.07 99.34 2osq h GLY 32 Ca 0.00 0.57 -0.32 0.00 0.00 0.00 0.00 47.33 47.58 2osq h GLY 32 CO 0.00 -0.36 2.31 -1.55 0.00 0.00 0.00 176.54 176.94 2osq n PRO 33 N -5.55 1.79 0.00 4.80 -0.04 -1.26 -3.01 135.00 131.72 2osq n PRO 33 Ca -0.12 -1.30 0.00 0.00 -0.04 0.00 0.00 63.50 62.04 2osq n PRO 33 Cb 0.45 -2.37 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 2osq n PRO 33 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2osq n PHE 34 N 4.24 -0.32 0.00 0.54 3.72 -1.20 -5.09 117.46 119.35 2osq n PHE 34 Ca 0.38 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.78 2osq n PHE 34 Cb 0.13 0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 2osq n PHE 34 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2osq n GLY 35 N -0.05 0.01 3.55 1.37 0.00 -1.17 -4.74 105.19 104.16 2osq n GLY 35 Ca 0.00 -1.17 -0.36 0.00 0.00 0.00 0.00 46.02 44.49 2osq n GLY 35 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2osq s PRO 36 N -2.00 2.61 -0.18 1.61 0.04 -1.26 -4.85 135.00 130.97 2osq s PRO 36 Ca 0.00 0.46 -0.29 0.00 0.04 0.00 0.00 61.00 61.21 2osq s PRO 36 Cb 0.00 -4.50 -0.05 0.00 0.04 0.00 0.00 34.50 29.99 2osq s PRO 36 CO 0.00 -2.84 1.95 -1.64 0.04 0.00 0.00 177.00 174.50 2osq s MET 37 N 7.04 3.55 0.38 4.56 -1.94 -1.26 -0.73 119.30 130.89 2osq s MET 37 Ca 0.68 1.97 0.08 0.00 -1.71 0.00 0.00 55.69 56.70 2osq s MET 37 Cb -0.12 -4.21 0.75 0.00 2.01 0.00 0.00 34.83 33.26 2osq s MET 37 CO 0.17 -1.62 1.92 -0.22 -0.01 0.00 0.00 175.02 175.27 2osq h LYS 38 N 12.67 0.34 -2.25 2.03 1.63 -0.66 -3.44 116.57 126.89 2osq h LYS 38 Ca -0.40 -0.07 0.14 0.00 -0.85 0.00 0.00 60.65 59.48 2osq h LYS 38 Cb 1.21 -0.05 -0.13 0.00 -0.60 0.00 0.00 32.23 32.66 2osq h LYS 38 CO 0.98 0.41 0.51 -2.00 -3.45 0.00 0.00 179.45 175.90 2osq s GLU 39 N -4.87 0.92 -0.06 1.90 2.12 0.29 -4.96 118.70 114.03 2osq s GLU 39 Ca -0.06 -0.41 -0.13 0.00 0.36 0.00 0.00 54.97 54.72 2osq s GLU 39 Cb 0.16 0.37 0.03 0.00 0.26 0.00 0.00 34.13 34.95 2osq s GLU 39 CO 0.74 -0.41 0.32 0.14 -0.54 0.00 0.00 175.26 175.51 2osq s VAL 40 N -3.13 0.03 -0.02 3.70 -7.23 -1.26 -0.74 120.40 111.75 2osq s VAL 40 Ca 0.08 -0.27 0.01 0.00 -1.81 0.00 0.00 61.98 59.99 2osq s VAL 40 Cb -0.01 -0.55 0.01 0.00 0.56 0.00 0.00 36.38 36.40 2osq s VAL 40 CO -0.05 -0.15 -0.02 -0.54 -0.31 0.00 0.00 175.10 174.03 2osq s LYS 41 N -0.67 0.32 -0.21 4.82 3.01 0.76 -4.99 119.74 122.79 2osq s LYS 41 Ca -0.08 -0.03 -0.02 0.00 -1.01 0.00 0.00 55.97 54.83 2osq s LYS 41 Cb -0.04 -0.40 0.06 0.00 -1.01 0.00 0.00 37.83 36.44 2osq s LYS 41 CO 0.03 -0.03 0.03 0.96 0.51 0.00 0.00 175.35 176.85 2osq s ILE 42 N 0.49 0.62 0.08 2.17 -0.00 -1.26 -0.28 121.20 123.01 2osq s ILE 42 Ca -0.05 -0.66 0.08 0.00 -0.00 0.00 0.00 60.65 60.02 2osq s ILE 42 Cb -0.08 -1.13 -0.03 0.00 -0.00 0.00 0.00 42.46 41.22 2osq s ILE 42 CO -0.01 -0.24 -0.22 -0.76 -0.00 0.00 0.00 174.94 173.71 2osq s LEU 43 N 1.81 2.23 -0.76 0.37 1.43 -0.54 -4.95 118.68 118.27 2osq s LEU 43 Ca -0.01 -0.62 -0.26 0.00 -1.03 0.00 0.00 54.13 52.22 2osq s LEU 43 Cb -0.17 -1.01 -0.11 0.00 0.03 0.00 0.00 46.19 44.93 2osq s LEU 43 CO -0.09 0.14 2.31 0.21 0.23 0.00 0.00 176.35 179.14 2osq s ASN 44 N -1.56 4.23 0.00 2.29 3.04 -1.26 -1.23 114.94 120.45 2osq s ASN 44 Ca 0.08 0.07 0.00 0.00 0.04 0.00 0.00 52.86 53.05 2osq s ASN 44 Cb -0.10 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 37.07 2osq s ASN 44 CO 0.03 -3.49 0.00 0.61 -3.04 0.00 0.00 177.10 171.21 2osq n GLY 45 N 6.67 1.22 3.56 1.21 0.00 -1.26 -5.09 105.19 111.50 2osq n GLY 45 Ca 0.43 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.34 2osq n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2osq s PHE 46 N -0.26 -0.39 0.12 1.61 -0.12 -0.36 -4.06 117.98 114.52 2osq s PHE 46 Ca 0.00 0.60 0.06 0.00 -0.05 0.00 0.00 56.93 57.53 2osq s PHE 46 Cb 0.00 0.46 -0.04 0.00 -0.63 0.00 0.00 43.02 42.82 2osq s PHE 46 CO 0.00 -0.41 -0.14 0.00 -0.05 0.00 0.00 175.22 174.63 2osq s ALA 47 N -1.52 1.48 0.02 1.99 0.00 -0.92 -1.47 121.76 121.34 2osq s ALA 47 Ca -0.01 -1.29 -0.01 0.00 0.00 0.00 0.00 51.96 50.66 2osq s ALA 47 Cb -0.01 -0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.03 2osq s ALA 47 CO 0.00 0.10 -0.01 -0.06 0.00 0.00 0.00 175.76 175.79 2osq s PHE 48 N -2.14 0.21 -0.17 0.00 0.40 0.61 0.23 117.98 117.12 2osq s PHE 48 Ca 0.09 -0.43 -0.04 0.00 -0.60 0.00 0.00 56.93 55.95 2osq s PHE 48 Cb -0.05 -0.15 0.08 0.00 0.51 0.00 0.00 43.02 43.41 2osq s PHE 48 CO 0.03 -0.17 0.24 0.08 0.70 0.00 0.00 175.22 176.10 2osq s VAL 49 N -1.27 -0.37 -0.36 -0.44 1.01 0.94 -0.17 120.40 119.73 2osq s VAL 49 Ca -0.14 0.07 -0.12 0.00 0.00 0.00 0.00 61.98 61.79 2osq s VAL 49 Cb -0.09 -0.57 0.01 0.00 0.00 0.00 0.00 36.38 35.73 2osq s VAL 49 CO -0.01 -0.05 0.22 -0.70 0.00 0.00 0.00 175.10 174.56 2osq s GLU 50 N 2.38 3.04 0.37 2.72 2.12 0.08 0.09 118.70 129.50 2osq s GLU 50 Ca 0.05 -0.94 -0.19 0.00 0.36 0.00 0.00 54.97 54.25 2osq s GLU 50 Cb -0.14 -3.75 -0.10 0.00 0.26 0.00 0.00 34.13 30.40 2osq s GLU 50 CO -0.11 -0.62 0.86 -0.06 -0.54 0.00 0.00 175.26 174.79 2osq s PHE 51 N 1.61 3.37 -1.58 5.30 0.08 -1.26 -0.03 117.98 125.46 2osq s PHE 51 Ca 0.04 1.45 0.23 0.00 0.12 0.00 0.00 56.93 58.77 2osq s PHE 51 Cb -0.18 -2.72 1.23 0.00 -0.57 0.00 0.00 43.02 40.78 2osq s PHE 51 CO 0.08 0.01 1.77 -1.91 -0.10 0.00 0.00 175.22 175.06 2osq n GLU 52 N -0.41 0.44 -3.77 0.44 2.13 0.09 -4.41 120.64 115.14 2osq n GLU 52 Ca 0.05 0.05 -0.19 0.00 0.66 0.00 0.00 57.16 57.73 2osq n GLU 52 Cb 0.53 -1.50 -0.17 0.00 0.27 0.00 0.00 31.44 30.57 2osq n GLU 52 CO 0.00 0.00 0.00 -1.21 -0.41 0.00 0.00 177.13 175.51 2osq s GLU 53 N -2.42 0.16 0.26 5.31 0.41 -1.26 -4.97 118.70 116.18 2osq s GLU 53 Ca 0.26 0.22 -0.02 0.00 -0.41 0.00 0.00 54.97 55.01 2osq s GLU 53 Cb 0.16 -0.55 0.53 0.00 -1.78 0.00 0.00 34.13 32.49 2osq s GLU 53 CO 0.33 -0.25 1.71 0.00 -0.49 0.00 0.00 175.26 176.57 2osq h ALA 54 N 7.92 1.14 -0.08 5.21 0.00 -1.82 -1.10 119.26 130.52 2osq h ALA 54 Ca -0.27 0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2osq h ALA 54 Cb 1.12 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 2osq h ALA 54 CO 0.31 -0.26 -0.09 1.49 0.00 0.00 0.00 179.25 180.70 2osq h GLU 55 N 0.41 -0.11 -0.96 0.00 4.57 -1.96 0.17 114.58 116.70 2osq h GLU 55 Ca 0.45 0.01 0.09 0.00 -1.18 0.00 0.00 59.36 58.73 2osq h GLU 55 Cb 0.75 0.02 -0.07 0.00 -0.16 0.00 0.00 28.75 29.29 2osq h GLU 55 CO -0.46 -0.07 0.60 1.03 -1.18 0.00 0.00 179.01 178.94 2osq h SER 56 N -0.11 0.92 0.20 1.04 0.87 -1.53 -0.54 113.55 114.40 2osq h SER 56 Ca 0.06 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.65 2osq h SER 56 Cb 0.20 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 2osq h SER 56 CO -0.15 0.54 -0.10 0.00 -0.53 0.00 0.00 176.83 176.59 2osq h ALA 57 N 1.48 -0.27 -0.71 6.23 0.00 -0.69 -0.78 119.26 124.53 2osq h ALA 57 Ca 0.45 -0.20 0.16 0.00 0.00 0.00 0.00 54.91 55.32 2osq h ALA 57 Cb 0.32 0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.17 2osq h ALA 57 CO -0.22 -0.44 0.48 0.00 0.00 0.00 0.00 179.25 179.07 2osq h ALA 58 N -0.02 2.28 0.10 0.00 0.00 -0.36 -0.80 119.26 120.46 2osq h ALA 58 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2osq h ALA 58 Cb 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2osq h ALA 58 CO 0.04 -0.48 -0.05 0.87 0.00 0.00 0.00 179.25 179.64 2osq h LYS 59 N 0.27 -0.13 -0.88 0.00 1.79 -1.02 -3.24 116.57 113.35 2osq h LYS 59 Ca 0.35 0.01 0.23 0.00 -2.18 0.00 0.00 60.65 59.05 2osq h LYS 59 Cb 0.97 0.03 -0.05 0.00 -1.58 0.00 0.00 32.23 31.60 2osq h LYS 59 CO -0.08 0.30 0.61 0.00 -1.08 0.00 0.00 179.45 179.20 2osq h ALA 60 N -0.45 2.48 -0.80 3.86 0.00 -0.66 0.37 119.26 124.07 2osq h ALA 60 Ca -0.01 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2osq h ALA 60 Cb 0.50 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 2osq h ALA 60 CO 0.02 -0.75 0.32 0.82 0.00 0.00 0.00 179.25 179.66 2osq h ILE 61 N 0.22 1.26 0.00 0.00 2.04 -1.22 0.31 117.51 120.12 2osq h ILE 61 Ca 0.44 -0.82 -0.06 0.00 1.00 0.00 0.00 64.86 65.42 2osq h ILE 61 Cb 1.39 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.76 2osq h ILE 61 CO -0.10 0.34 -0.91 -0.08 0.00 0.00 0.00 178.15 177.39 2osq h GLU 62 N 1.17 0.00 0.00 2.37 4.81 -0.80 -3.17 114.58 118.96 2osq h GLU 62 Ca 0.27 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.50 2osq h GLU 62 Cb 0.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.59 2osq h GLU 62 CO -0.02 0.15 -0.04 0.93 -0.73 0.00 0.00 179.01 179.29 2osq h GLU 63 N 0.00 0.00 -0.68 1.92 4.39 -0.10 -3.38 114.58 116.73 2osq h GLU 63 Ca -0.05 0.00 0.12 0.00 0.34 0.00 0.00 59.36 59.77 2osq h GLU 63 Cb 1.22 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.78 2osq h GLU 63 CO 0.02 0.00 0.24 0.28 -1.16 0.00 0.00 179.01 178.39 2osq h VAL 64 N -0.38 0.68 -1.78 3.13 2.07 -0.60 -3.42 116.25 115.96 2osq h VAL 64 Ca 0.00 -0.13 -0.68 0.00 0.82 0.00 0.00 66.70 66.71 2osq h VAL 64 Cb 0.04 0.26 0.02 0.00 -1.52 0.00 0.00 31.29 30.09 2osq h VAL 64 CO 0.00 0.07 0.94 1.57 0.02 0.00 0.00 177.57 180.17 2osq n HIS 65 N -5.03 2.14 -0.15 1.57 -0.00 -1.20 -0.59 115.22 111.96 2osq n HIS 65 Ca 0.12 0.32 0.00 0.00 -0.00 0.00 0.00 57.72 58.15 2osq n HIS 65 Cb 0.35 -2.54 0.00 0.00 -0.00 0.00 0.00 29.99 27.81 2osq n HIS 65 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2osq n GLY 66 N 4.12 0.83 2.96 1.57 0.00 -1.13 -4.92 105.19 108.62 2osq n GLY 66 Ca 0.24 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.05 2osq n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2osq n LYS 67 N -2.11 -0.68 -4.26 1.61 5.02 0.25 -4.82 118.16 113.17 2osq n LYS 67 Ca 0.00 -1.72 -0.22 0.00 -2.02 0.00 0.00 58.31 54.34 2osq n LYS 67 Cb 0.00 -0.89 -0.12 0.00 -0.02 0.00 0.00 35.03 34.00 2osq n LYS 67 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2osq s SER 68 N -4.54 2.32 -0.29 4.39 1.04 -1.26 -0.12 113.70 115.24 2osq s SER 68 Ca 0.56 -0.68 -0.21 0.00 0.48 0.00 0.00 55.95 56.10 2osq s SER 68 Cb -0.02 -0.12 0.15 0.00 0.10 0.00 0.00 66.02 66.14 2osq s SER 68 CO 0.38 0.02 1.12 0.12 0.98 0.00 0.00 173.24 175.86 2osq s PHE 69 N -1.24 -0.38 -1.49 5.02 5.36 0.12 -4.84 117.98 120.54 2osq s PHE 69 Ca 0.05 0.85 -0.12 0.00 -0.96 0.00 0.00 56.93 56.75 2osq s PHE 69 Cb -0.10 0.34 0.07 0.00 -0.34 0.00 0.00 43.02 42.99 2osq s PHE 69 CO 0.04 -0.19 0.93 0.00 -1.46 0.00 0.00 175.22 174.54 2osq n ALA 70 N 2.69 -1.23 -2.68 11.12 0.00 -1.26 -0.64 120.51 128.51 2osq n ALA 70 Ca -0.15 0.23 -0.21 0.00 0.00 0.00 0.00 53.44 53.31 2osq n ALA 70 Cb 0.57 -4.44 0.01 0.00 0.00 0.00 0.00 19.45 15.58 2osq n ALA 70 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2osq n ASN 71 N -2.77 -5.91 -3.82 0.00 3.02 -1.26 -4.98 115.26 99.54 2osq n ASN 71 Ca 0.02 -0.13 -0.12 0.00 -0.03 0.00 0.00 54.58 54.32 2osq n ASN 71 Cb 0.54 -4.86 -0.11 0.00 -0.61 0.00 0.00 39.78 34.74 2osq n ASN 71 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2osq s GLN 72 N -5.34 0.38 0.04 3.52 -0.21 0.19 -5.14 119.66 113.10 2osq s GLN 72 Ca 0.13 0.01 -0.30 0.00 0.02 0.00 0.00 55.36 55.22 2osq s GLN 72 Cb -0.06 0.17 -0.06 0.00 1.00 0.00 0.00 33.01 34.06 2osq s GLN 72 CO 0.17 -0.08 1.42 -1.25 -2.12 0.00 0.00 175.29 173.43 2osq s PRO 73 N -0.56 4.29 0.55 2.91 0.04 -1.26 -0.70 135.00 140.27 2osq s PRO 73 Ca -0.07 2.02 -0.08 0.00 0.04 0.00 0.00 61.00 62.92 2osq s PRO 73 Cb -0.04 -3.50 -0.04 0.00 0.04 0.00 0.00 34.50 30.97 2osq s PRO 73 CO 0.01 -0.55 0.90 -0.51 0.04 0.00 0.00 177.00 176.89 2osq s LEU 74 N 2.10 3.43 -0.17 -3.56 1.43 0.83 -4.92 118.68 117.81 2osq s LEU 74 Ca 0.65 1.15 -0.09 0.00 -1.03 0.00 0.00 54.13 54.80 2osq s LEU 74 Cb -0.33 -4.14 0.06 0.00 0.03 0.00 0.00 46.19 41.81 2osq s LEU 74 CO 0.28 -0.73 0.42 -0.70 0.23 0.00 0.00 176.35 175.84 2osq s GLU 75 N -4.95 0.39 0.00 1.70 2.12 -1.26 -2.84 118.70 113.86 2osq s GLU 75 Ca 0.51 0.81 0.02 0.00 0.36 0.00 0.00 54.97 56.67 2osq s GLU 75 Cb -0.11 0.00 -0.01 0.00 0.26 0.00 0.00 34.13 34.28 2osq s GLU 75 CO 0.49 -0.17 -0.06 0.08 -0.54 0.00 0.00 175.26 175.07 2osq s VAL 76 N 1.49 0.45 0.24 3.70 1.01 -1.26 -1.81 120.40 124.21 2osq s VAL 76 Ca -0.09 -0.39 -0.03 0.00 0.00 0.00 0.00 61.98 61.48 2osq s VAL 76 Cb -0.09 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.86 2osq s VAL 76 CO -0.13 0.03 0.25 0.68 0.00 0.00 0.00 175.10 175.92 2osq s VAL 77 N -0.36 0.00 -0.59 2.92 -7.23 -0.43 -4.62 120.40 110.09 2osq s VAL 77 Ca -0.00 -1.85 -0.27 0.00 -1.81 0.00 0.00 61.98 58.05 2osq s VAL 77 Cb -0.04 -2.45 -0.01 0.00 0.56 0.00 0.00 36.38 34.44 2osq s VAL 77 CO -0.00 0.00 1.75 -0.31 -0.31 0.00 0.00 175.10 176.22 2osq s TYR 78 N -3.96 1.81 -0.16 2.82 2.02 -1.26 0.15 117.35 118.76 2osq s TYR 78 Ca 0.35 0.65 -0.29 0.00 -0.37 0.00 0.00 57.07 57.42 2osq s TYR 78 Cb 0.04 -4.18 -0.05 0.00 -0.40 0.00 0.00 41.96 37.37 2osq s TYR 78 CO 0.14 -2.31 2.03 0.45 -1.57 0.00 0.00 175.55 174.29 2osq s SER 79 N 7.06 5.88 0.00 2.29 0.15 0.24 -4.62 113.70 124.70 2osq s SER 79 Ca 0.63 2.00 0.18 0.00 0.70 0.00 0.00 55.95 59.47 2osq s SER 79 Cb -0.13 -2.52 1.07 0.00 -1.71 0.00 0.00 66.02 62.73 2osq s SER 79 CO 0.22 -1.61 1.47 0.29 1.20 0.00 0.00 173.24 174.81