#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 0.82 0.49 -4.62 0.05 -1.26 -4.90 118.68 109.27 2osq s LEU 8 Ca 0.00 1.37 0.08 0.00 0.05 0.00 0.00 54.13 55.63 2osq s LEU 8 Cb 0.00 -3.29 0.04 0.00 -2.05 0.00 0.00 46.19 40.89 2osq s LEU 8 CO 0.00 -4.08 0.62 -0.44 -0.55 0.00 0.00 176.35 171.90 2osq s SER 9 N -2.76 5.27 -0.15 1.48 0.01 -1.26 -5.03 113.70 111.26 2osq s SER 9 Ca 0.68 -0.70 -0.20 0.00 1.31 0.00 0.00 55.95 57.04 2osq s SER 9 Cb -0.23 -0.17 -0.24 0.00 0.21 0.00 0.00 66.02 65.59 2osq s SER 9 CO 0.63 -1.01 0.45 -1.13 0.41 0.00 0.00 173.24 172.59 2osq h ASN 10 N 0.51 0.16 -3.12 2.44 -1.24 -1.97 -3.44 115.58 108.93 2osq h ASN 10 Ca -0.36 -0.75 -0.59 0.00 0.71 0.00 0.00 56.30 55.31 2osq h ASN 10 Cb 1.28 -0.05 -0.40 0.00 0.73 0.00 0.00 38.32 39.88 2osq h ASN 10 CO 0.46 1.47 -0.78 0.42 -1.29 0.00 0.00 177.43 177.71 2osq s THR 11 N -2.39 0.83 -0.30 -3.57 -4.23 -1.26 -4.22 115.64 100.50 2osq s THR 11 Ca -0.23 -2.00 -0.20 0.00 -1.18 0.00 0.00 61.69 58.08 2osq s THR 11 Cb 0.04 -1.60 0.20 0.00 1.34 0.00 0.00 72.50 72.48 2osq s THR 11 CO 0.68 -0.88 1.31 -0.60 -0.54 0.00 0.00 174.62 174.59 2osq s ARG 12 N 0.88 0.02 -0.18 3.99 3.52 -1.26 -4.46 118.95 121.46 2osq s ARG 12 Ca 0.16 0.04 0.01 0.00 -0.13 0.00 0.00 55.73 55.81 2osq s ARG 12 Cb -0.22 0.02 0.03 0.00 -1.56 0.00 0.00 34.95 33.22 2osq s ARG 12 CO -0.05 -0.01 -0.16 -0.51 -0.81 0.00 0.00 175.30 173.76 2osq s LEU 13 N 1.98 2.09 -0.31 -0.88 1.43 0.11 -0.96 118.68 122.14 2osq s LEU 13 Ca 0.00 -0.67 -0.17 0.00 -1.03 0.00 0.00 54.13 52.26 2osq s LEU 13 Cb -0.00 -1.36 -0.02 0.00 0.03 0.00 0.00 46.19 44.84 2osq s LEU 13 CO -0.16 -0.05 0.48 0.12 0.23 0.00 0.00 176.35 176.97 2osq s PHE 14 N 1.35 3.21 0.36 0.29 5.36 0.14 -0.05 117.98 128.66 2osq s PHE 14 Ca 0.03 0.32 0.07 0.00 -0.96 0.00 0.00 56.93 56.39 2osq s PHE 14 Cb -0.14 -2.79 -0.01 0.00 -0.34 0.00 0.00 43.02 39.74 2osq s PHE 14 CO -0.11 -0.41 0.47 0.08 -1.46 0.00 0.00 175.22 173.78 2osq s VAL 15 N 2.29 3.60 0.87 3.12 1.01 0.11 -0.94 120.40 130.45 2osq s VAL 15 Ca 0.18 -1.07 -0.12 0.00 0.00 0.00 0.00 61.98 60.97 2osq s VAL 15 Cb -0.16 -3.23 0.11 0.00 0.00 0.00 0.00 36.38 33.10 2osq s VAL 15 CO 0.12 -0.10 1.16 -0.13 0.00 0.00 0.00 175.10 176.14 2osq s ARG 16 N -4.20 1.50 -0.04 2.72 3.00 -1.01 -1.93 118.95 119.00 2osq s ARG 16 Ca 0.48 0.19 -0.30 0.00 0.00 0.00 0.00 55.73 56.10 2osq s ARG 16 Cb -0.09 -1.89 -0.05 0.00 0.00 0.00 0.00 34.95 32.92 2osq s ARG 16 CO 0.31 -1.93 1.48 -1.25 0.00 0.00 0.00 175.30 173.91 2osq s PRO 17 N -5.43 4.23 0.35 3.54 0.04 -1.25 -3.93 135.00 132.55 2osq s PRO 17 Ca 0.63 2.02 -0.02 0.00 0.04 0.00 0.00 61.00 63.67 2osq s PRO 17 Cb -0.13 -3.74 -0.04 0.00 0.04 0.00 0.00 34.50 30.63 2osq s PRO 17 CO 0.51 -0.70 0.58 -0.06 0.04 0.00 0.00 177.00 177.38 2osq s PHE 18 N 3.13 3.50 0.00 0.56 0.40 -1.26 -4.96 117.98 119.35 2osq s PHE 18 Ca 0.66 0.51 0.00 0.00 -0.60 0.00 0.00 56.93 57.50 2osq s PHE 18 Cb -0.31 -2.02 0.00 0.00 0.51 0.00 0.00 43.02 41.20 2osq s PHE 18 CO 0.26 0.08 0.00 -0.35 0.70 0.00 0.00 175.22 175.91 2osq n PRO 19 N -1.58 0.71 0.32 0.24 -0.04 -1.26 -4.53 135.00 128.85 2osq n PRO 19 Ca -0.03 0.00 0.15 0.00 -0.04 0.00 0.00 63.50 63.58 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 -2.44 1.53 8.10 -2.05 0.38 115.31 120.84 2osq h LEU 20 Ca 0.00 0.00 -0.09 0.00 0.11 0.00 0.00 57.88 57.90 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 0.12 0.47 -4.11 0.00 0.00 178.44 174.92 2osq n ASP 21 N -2.93 3.21 -4.56 0.17 8.00 -1.26 -4.82 116.55 114.36 2osq n ASP 21 Ca -0.01 -2.54 -0.37 0.00 0.71 0.00 0.00 54.79 52.58 2osq n ASP 21 Cb 0.42 -0.61 -0.03 0.00 -0.02 0.00 0.00 41.12 40.87 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 -1.66 3.76 0.22 2.53 0.11 0.13 -4.79 120.40 120.70 2osq s VAL 22 Ca 0.25 -0.48 -0.08 0.00 -2.93 0.00 0.00 61.98 58.74 2osq s VAL 22 Cb 0.20 -4.74 -0.02 0.00 -1.53 0.00 0.00 36.38 30.29 2osq s VAL 22 CO 0.06 -1.65 0.33 0.00 -3.33 0.00 0.00 175.10 170.52 2osq s GLN 23 N 5.65 1.38 0.54 1.54 -2.07 -1.26 -4.93 119.66 120.50 2osq s GLN 23 Ca 0.51 -1.38 0.31 0.00 -1.82 0.00 0.00 55.36 52.99 2osq s GLN 23 Cb -0.03 0.39 1.44 0.00 -1.09 0.00 0.00 33.01 33.71 2osq s GLN 23 CO -0.03 -0.53 2.03 1.05 -1.32 0.00 0.00 175.29 176.49 2osq h GLU 24 N 2.42 0.00 -0.34 9.60 4.11 -1.95 -3.08 114.58 125.34 2osq h GLU 24 Ca -0.30 0.00 0.07 0.00 0.07 0.00 0.00 59.36 59.20 2osq h GLU 24 Cb 1.25 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.43 2osq h GLU 24 CO 0.43 0.08 -0.08 1.03 0.07 0.00 0.00 179.01 180.55 2osq h SER 25 N 0.00 -0.30 -0.03 3.06 0.87 -1.96 0.17 113.55 115.35 2osq h SER 25 Ca -0.00 0.10 -0.16 0.00 -1.23 0.00 0.00 61.79 60.50 2osq h SER 25 Cb 0.45 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 2osq h SER 25 CO 0.01 -0.11 -0.54 1.05 -0.53 0.00 0.00 176.83 176.72 2osq h GLU 26 N 0.01 0.61 -0.85 2.24 4.11 -1.84 -1.54 114.58 117.32 2osq h GLU 26 Ca 0.17 -0.38 -0.00 0.00 0.07 0.00 0.00 59.36 59.21 2osq h GLU 26 Cb 0.25 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 2osq h GLU 26 CO -0.35 0.99 0.52 -0.07 0.07 0.00 0.00 179.01 180.17 2osq h LEU 27 N 0.47 1.02 -0.07 3.06 3.38 -1.34 0.26 115.31 122.08 2osq h LEU 27 Ca 0.01 -0.06 -0.25 0.00 0.09 0.00 0.00 57.88 57.67 2osq h LEU 27 Cb 1.09 -0.26 0.01 0.00 0.09 0.00 0.00 40.66 41.59 2osq h LEU 27 CO 0.10 0.78 -1.00 0.78 0.09 0.00 0.00 178.44 179.20 2osq h ASN 28 N 1.17 0.77 1.19 -0.43 2.35 -0.65 0.34 115.58 120.32 2osq h ASN 28 Ca 0.31 -0.61 0.00 0.00 -0.55 0.00 0.00 56.30 55.45 2osq h ASN 28 Cb -0.06 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.08 2osq h ASN 28 CO -0.06 1.41 0.00 -0.33 -1.65 0.00 0.00 177.43 176.80 2osq h GLU 29 N 0.34 0.00 0.00 0.81 4.39 -0.98 0.40 114.58 119.54 2osq h GLU 29 Ca -0.11 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.34 2osq h GLU 29 Cb 1.64 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 30.25 2osq h GLU 29 CO 0.19 0.00 -1.80 -0.89 -1.16 0.00 0.00 179.01 175.35 2osq n ILE 30 N -2.98 1.51 1.79 3.13 5.41 0.87 -4.44 119.36 124.65 2osq n ILE 30 Ca 0.02 -0.14 0.15 0.00 1.00 0.00 0.00 62.75 63.78 2osq n ILE 30 Cb 0.34 -2.09 0.79 0.00 -0.71 0.00 0.00 39.64 37.97 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 -4.36 0.00 0.27 1.39 3.01 0.12 -4.17 117.46 113.73 2osq n PHE 31 Ca -0.36 0.00 -0.18 0.00 1.01 0.00 0.00 57.45 57.92 2osq n PHE 31 Cb 0.71 -0.02 -0.10 0.00 -0.01 0.00 0.00 39.48 40.06 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 4.95 -1.22 -5.53 1.37 0.00 -0.30 -3.17 103.07 99.17 2osq h GLY 32 Ca 0.00 0.58 -0.33 0.00 0.00 0.00 0.00 47.33 47.58 2osq h GLY 32 CO 0.00 -0.36 2.39 -1.55 0.00 0.00 0.00 176.54 177.02 2osq n PRO 33 N -5.55 1.80 0.00 4.80 -0.04 -1.26 -3.02 135.00 131.73 2osq n PRO 33 Ca -0.12 -1.33 0.00 0.00 -0.04 0.00 0.00 63.50 62.01 2osq n PRO 33 Cb 0.45 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.52 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 4.35 -0.31 0.00 0.54 3.72 -1.20 -5.08 117.46 119.48 2osq n PHE 34 Ca 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.79 2osq n PHE 34 Cb 0.12 0.11 0.00 0.00 -0.94 0.00 0.00 39.48 38.77 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 -0.12 -0.00 3.56 1.37 0.00 -1.17 -4.71 105.19 104.13 2osq n GLY 35 Ca 0.00 -1.15 -0.32 0.00 0.00 0.00 0.00 46.02 44.55 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 2.59 -0.25 1.61 0.04 -1.26 -4.85 135.00 130.88 2osq s PRO 36 Ca 0.00 0.15 -0.28 0.00 0.04 0.00 0.00 61.00 60.91 2osq s PRO 36 Cb 0.00 -4.73 -0.04 0.00 0.04 0.00 0.00 34.50 29.76 2osq s PRO 36 CO 0.00 -3.07 2.13 -1.64 0.04 0.00 0.00 177.00 174.46 2osq s MET 37 N 7.03 3.15 0.40 4.56 -1.94 -1.26 -0.96 119.30 130.28 2osq s MET 37 Ca 0.69 1.89 0.07 0.00 -1.71 0.00 0.00 55.69 56.63 2osq s MET 37 Cb -0.10 -4.34 0.84 0.00 2.01 0.00 0.00 34.83 33.25 2osq s MET 37 CO 0.10 -2.08 2.03 -0.22 -0.01 0.00 0.00 175.02 174.84 2osq h LYS 38 N 14.67 0.58 -2.32 2.03 1.63 -0.72 -3.44 116.57 129.00 2osq h LYS 38 Ca -0.39 -0.03 0.12 0.00 -0.85 0.00 0.00 60.65 59.50 2osq h LYS 38 Cb 1.22 -0.13 -0.13 0.00 -0.60 0.00 0.00 32.23 32.59 2osq h LYS 38 CO 0.98 0.38 0.48 -2.00 -3.45 0.00 0.00 179.45 175.84 2osq s GLU 39 N -5.53 0.93 -0.13 1.90 2.56 0.23 -4.97 118.70 113.69 2osq s GLU 39 Ca -0.09 -0.39 -0.06 0.00 0.00 0.00 0.00 54.97 54.43 2osq s GLU 39 Cb 0.18 0.39 0.05 0.00 2.00 0.00 0.00 34.13 36.76 2osq s GLU 39 CO 0.74 -0.41 0.29 0.14 -0.56 0.00 0.00 175.26 175.46 2osq s VAL 40 N -3.18 -0.13 -0.07 3.70 -7.23 -1.26 -0.62 120.40 111.61 2osq s VAL 40 Ca 0.07 0.16 0.04 0.00 -1.81 0.00 0.00 61.98 60.44 2osq s VAL 40 Cb -0.01 -0.45 -0.02 0.00 0.56 0.00 0.00 36.38 36.46 2osq s VAL 40 CO -0.06 0.07 -0.19 -0.54 -0.31 0.00 0.00 175.10 174.06 2osq s LYS 41 N 1.57 2.69 -0.20 4.82 -0.14 1.00 -5.00 119.74 124.48 2osq s LYS 41 Ca -0.07 -0.80 -0.02 0.00 -1.36 0.00 0.00 55.97 53.72 2osq s LYS 41 Cb -0.10 -2.32 0.06 0.00 -1.68 0.00 0.00 37.83 33.79 2osq s LYS 41 CO -0.10 0.43 0.02 0.96 -0.76 0.00 0.00 175.35 175.91 2osq s ILE 42 N -0.26 0.70 0.03 2.17 -0.00 -1.26 -0.11 121.20 122.46 2osq s ILE 42 Ca 0.00 -0.66 0.07 0.00 -0.00 0.00 0.00 60.65 60.06 2osq s ILE 42 Cb -0.13 -1.16 -0.02 0.00 -0.00 0.00 0.00 42.46 41.15 2osq s ILE 42 CO 0.03 -0.18 -0.21 -0.76 -0.00 0.00 0.00 174.94 173.81 2osq s LEU 43 N 1.78 2.13 -0.67 0.37 1.43 -0.62 -4.99 118.68 118.10 2osq s LEU 43 Ca -0.02 -0.48 -0.26 0.00 -1.03 0.00 0.00 54.13 52.34 2osq s LEU 43 Cb -0.17 -1.04 -0.12 0.00 0.03 0.00 0.00 46.19 44.89 2osq s LEU 43 CO -0.08 0.20 2.42 -3.20 0.23 0.00 0.00 176.35 175.92 2osq n ASN 44 N 2.06 1.88 0.00 2.29 2.85 -1.26 -0.86 115.26 122.22 2osq n ASN 44 Ca -0.17 -0.99 0.00 0.00 -0.11 0.00 0.00 54.58 53.31 2osq n ASN 44 Cb 0.53 -1.57 0.00 0.00 1.24 0.00 0.00 39.78 39.98 2osq n ASN 44 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2osq n GLY 45 N 6.41 1.28 3.55 8.20 0.00 -1.26 -5.10 105.19 118.27 2osq n GLY 45 Ca 0.44 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.35 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 -0.43 -0.41 0.16 1.61 -0.12 -0.04 -3.89 117.98 114.86 2osq s PHE 46 Ca 0.00 0.58 0.08 0.00 -0.05 0.00 0.00 56.93 57.55 2osq s PHE 46 Cb 0.00 0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 42.82 2osq s PHE 46 CO 0.00 -0.45 -0.18 0.00 -0.05 0.00 0.00 175.22 174.54 2osq s ALA 47 N -1.73 1.98 -0.00 1.99 0.00 -0.81 -1.59 121.76 121.59 2osq s ALA 47 Ca -0.01 -1.46 -0.01 0.00 0.00 0.00 0.00 51.96 50.47 2osq s ALA 47 Cb -0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 23.12 22.93 2osq s ALA 47 CO -0.00 0.24 0.02 -0.06 0.00 0.00 0.00 175.76 175.96 2osq s PHE 48 N -1.97 0.05 -0.14 0.00 0.08 0.84 0.05 117.98 116.89 2osq s PHE 48 Ca 0.15 -0.09 -0.04 0.00 0.12 0.00 0.00 56.93 57.07 2osq s PHE 48 Cb -0.06 -0.04 0.06 0.00 -0.57 0.00 0.00 43.02 42.40 2osq s PHE 48 CO 0.06 -0.07 0.10 0.08 -0.10 0.00 0.00 175.22 175.29 2osq s VAL 49 N -0.42 -0.12 -0.40 -0.44 1.01 0.93 -0.00 120.40 120.96 2osq s VAL 49 Ca -0.05 -0.00 -0.14 0.00 0.00 0.00 0.00 61.98 61.79 2osq s VAL 49 Cb -0.03 -0.47 0.02 0.00 0.00 0.00 0.00 36.38 35.90 2osq s VAL 49 CO -0.00 -0.15 0.27 -0.70 0.00 0.00 0.00 175.10 174.52 2osq s GLU 50 N 2.17 2.94 0.37 2.72 2.12 0.21 0.08 118.70 129.31 2osq s GLU 50 Ca 0.03 -1.03 -0.19 0.00 0.36 0.00 0.00 54.97 54.14 2osq s GLU 50 Cb -0.15 -3.91 -0.10 0.00 0.26 0.00 0.00 34.13 30.23 2osq s GLU 50 CO -0.08 -0.73 0.86 -0.06 -0.54 0.00 0.00 175.26 174.71 2osq s PHE 51 N 1.65 3.38 -1.66 5.30 0.08 -1.26 -0.10 117.98 125.36 2osq s PHE 51 Ca 0.04 1.48 0.24 0.00 0.12 0.00 0.00 56.93 58.81 2osq s PHE 51 Cb -0.19 -2.74 1.33 0.00 -0.57 0.00 0.00 43.02 40.85 2osq s PHE 51 CO 0.09 0.01 1.82 -1.91 -0.10 0.00 0.00 175.22 175.13 2osq n GLU 52 N -0.38 0.52 -3.72 0.44 2.13 -0.13 -4.43 120.64 115.06 2osq n GLU 52 Ca 0.05 0.04 -0.17 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 -2.34 -0.04 0.28 5.31 0.41 -1.26 -4.97 118.70 116.08 2osq s GLU 53 Ca 0.29 0.31 0.02 0.00 -0.41 0.00 0.00 54.97 55.18 2osq s GLU 53 Cb 0.17 -0.36 0.64 0.00 -1.78 0.00 0.00 34.13 32.80 2osq s GLU 53 CO 0.34 -0.25 1.74 0.00 -0.49 0.00 0.00 175.26 176.60 2osq h ALA 54 N 7.86 1.42 0.04 5.21 0.00 -1.82 -1.28 119.26 130.68 2osq h ALA 54 Ca -0.29 0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.75 2osq h ALA 54 Cb 1.12 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.91 2osq h ALA 54 CO 0.31 -0.17 -0.15 1.49 0.00 0.00 0.00 179.25 180.73 2osq h GLU 55 N 0.58 -0.26 -0.97 0.00 4.57 -1.96 0.20 114.58 116.73 2osq h GLU 55 Ca 0.52 0.02 0.11 0.00 -1.18 0.00 0.00 59.36 58.82 2osq h GLU 55 Cb 0.85 0.06 -0.08 0.00 -0.16 0.00 0.00 28.75 29.42 2osq h GLU 55 CO -0.42 -0.18 0.62 1.03 -1.18 0.00 0.00 179.01 178.88 2osq h SER 56 N -0.27 0.91 0.16 1.04 0.87 -1.54 -0.44 113.55 114.27 2osq h SER 56 Ca 0.04 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 2osq h SER 56 Cb 0.32 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 2osq h SER 56 CO -0.12 0.51 -0.08 0.00 -0.53 0.00 0.00 176.83 176.62 2osq h ALA 57 N 1.53 -0.21 -0.59 6.23 0.00 -0.73 -0.33 119.26 125.16 2osq h ALA 57 Ca 0.46 -0.21 0.14 0.00 0.00 0.00 0.00 54.91 55.30 2osq h ALA 57 Cb 0.42 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2osq h ALA 57 CO -0.22 -0.39 0.41 0.00 0.00 0.00 0.00 179.25 179.04 2osq h ALA 58 N 0.05 2.29 0.02 0.00 0.00 -0.24 -0.96 119.26 120.43 2osq h ALA 58 Ca -0.02 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 2osq h ALA 58 Cb 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2osq h ALA 58 CO 0.04 -0.45 -0.01 0.87 0.00 0.00 0.00 179.25 179.69 2osq h LYS 59 N 0.19 -0.02 -0.75 0.00 1.79 -1.02 -3.21 116.57 113.55 2osq h LYS 59 Ca 0.28 0.00 0.18 0.00 -2.18 0.00 0.00 60.65 58.93 2osq h LYS 59 Cb 0.85 0.01 -0.04 0.00 -1.58 0.00 0.00 32.23 31.47 2osq h LYS 59 CO -0.05 0.72 0.52 0.00 -1.08 0.00 0.00 179.45 179.55 2osq h ALA 60 N -0.12 2.36 -0.50 3.86 0.00 -0.53 0.43 119.26 124.76 2osq h ALA 60 Ca -0.00 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 2osq h ALA 60 Cb 0.75 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2osq h ALA 60 CO 0.00 -0.57 -0.13 0.82 0.00 0.00 0.00 179.25 179.37 2osq h ILE 61 N 0.24 1.27 0.00 0.00 2.04 -1.27 0.33 117.51 120.12 2osq h ILE 61 Ca 0.37 -1.26 0.00 0.00 1.00 0.00 0.00 64.86 64.97 2osq h ILE 61 Cb 1.11 1.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.20 2osq h ILE 61 CO -0.08 0.44 -0.51 -0.62 0.00 0.00 0.00 178.15 177.38 2osq n GLU 62 N -4.14 0.10 -0.03 2.37 1.02 0.11 -3.48 120.64 116.58 2osq n GLU 62 Ca 0.01 0.03 -0.03 0.00 -0.02 0.00 0.00 57.16 57.15 2osq n GLU 62 Cb 0.40 -1.56 -0.01 0.00 -0.02 0.00 0.00 31.44 30.25 2osq n GLU 62 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2osq n GLU 63 N -1.70 0.19 -0.24 3.49 -0.58 0.13 -4.46 120.64 117.48 2osq n GLU 63 Ca 0.05 0.19 0.26 0.00 -0.42 0.00 0.00 57.16 57.24 2osq n GLU 63 Cb 0.37 -0.96 0.63 0.00 -0.57 0.00 0.00 31.44 30.91 2osq n GLU 63 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2osq h VAL 64 N -0.39 0.56 -2.22 2.62 2.07 -0.56 -3.41 116.25 114.93 2osq h VAL 64 Ca 0.00 -0.06 -0.56 0.00 0.82 0.00 0.00 66.70 66.90 2osq h VAL 64 Cb 0.31 0.37 0.02 0.00 -1.52 0.00 0.00 31.29 30.47 2osq h VAL 64 CO 0.00 0.03 1.27 1.57 0.02 0.00 0.00 177.57 180.46 2osq n HIS 65 N -4.38 2.38 -0.07 1.57 -0.00 -1.23 -1.04 115.22 112.45 2osq n HIS 65 Ca 0.21 -0.27 0.00 0.00 -0.00 0.00 0.00 57.72 57.65 2osq n HIS 65 Cb 0.91 -2.77 0.00 0.00 -0.00 0.00 0.00 29.99 28.13 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 4.78 0.77 2.32 1.57 0.00 -1.09 -4.97 105.19 108.58 2osq n GLY 66 Ca 0.23 0.00 -0.19 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 -2.04 -1.90 -5.10 1.61 4.76 -0.21 -4.70 118.16 110.59 2osq n LYS 67 Ca 0.00 -1.19 -0.30 0.00 -2.87 0.00 0.00 58.31 53.95 2osq n LYS 67 Cb 0.00 -1.00 -0.15 0.00 -1.84 0.00 0.00 35.03 32.04 2osq n LYS 67 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2osq s SER 68 N -3.63 2.96 -0.29 4.39 1.04 -1.26 -0.46 113.70 116.44 2osq s SER 68 Ca 0.47 -0.50 -0.16 0.00 0.48 0.00 0.00 55.95 56.24 2osq s SER 68 Cb -0.03 -0.31 0.17 0.00 0.10 0.00 0.00 66.02 65.95 2osq s SER 68 CO 0.35 0.28 1.07 0.12 0.98 0.00 0.00 173.24 176.03 2osq s PHE 69 N -0.67 -0.41 -1.40 5.02 2.19 -0.08 -4.84 117.98 117.79 2osq s PHE 69 Ca 0.10 0.83 -0.06 0.00 0.33 0.00 0.00 56.93 58.13 2osq s PHE 69 Cb -0.10 0.25 0.01 0.00 -1.31 0.00 0.00 43.02 41.87 2osq s PHE 69 CO 0.00 -0.21 0.78 0.00 1.83 0.00 0.00 175.22 177.62 2osq n ALA 70 N 3.55 -1.03 -2.69 11.12 0.00 -1.26 -1.72 120.51 128.49 2osq n ALA 70 Ca -0.18 0.32 -0.22 0.00 0.00 0.00 0.00 53.44 53.36 2osq n ALA 70 Cb 0.57 -4.29 0.01 0.00 0.00 0.00 0.00 19.45 15.74 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 -2.45 -6.07 -3.70 0.00 3.02 -1.26 -4.97 115.26 99.83 2osq n ASN 71 Ca -0.06 -0.14 -0.14 0.00 -0.03 0.00 0.00 54.58 54.20 2osq n ASN 71 Cb 0.59 -4.98 -0.08 0.00 -0.61 0.00 0.00 39.78 34.70 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 -5.35 0.76 -0.01 3.52 -0.21 -0.70 -5.14 119.66 112.54 2osq s GLN 72 Ca 0.14 -0.08 -0.30 0.00 0.02 0.00 0.00 55.36 55.13 2osq s GLN 72 Cb -0.06 0.34 -0.06 0.00 1.00 0.00 0.00 33.01 34.24 2osq s GLN 72 CO 0.17 -0.22 1.45 -1.25 -2.12 0.00 0.00 175.29 173.33 2osq s PRO 73 N -1.29 4.26 0.78 2.91 0.04 -1.26 -0.90 135.00 139.53 2osq s PRO 73 Ca -0.13 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 62.82 2osq s PRO 73 Cb -0.04 -3.63 0.06 0.00 0.04 0.00 0.00 34.50 30.93 2osq s PRO 73 CO 0.06 -0.63 1.08 -0.51 0.04 0.00 0.00 177.00 177.04 2osq s LEU 74 N 2.68 2.75 -0.11 -3.56 1.43 0.39 -4.93 118.68 117.32 2osq s LEU 74 Ca 0.66 1.49 -0.06 0.00 -1.03 0.00 0.00 54.13 55.19 2osq s LEU 74 Cb -0.32 -4.16 0.05 0.00 0.03 0.00 0.00 46.19 41.79 2osq s LEU 74 CO 0.27 -1.94 0.26 -1.61 0.23 0.00 0.00 176.35 173.56 2osq s GLU 75 N -5.06 0.22 0.04 1.70 2.02 -1.26 -2.66 118.70 113.70 2osq s GLU 75 Ca 0.60 0.57 0.05 0.00 0.02 0.00 0.00 54.97 56.22 2osq s GLU 75 Cb -0.15 -0.11 -0.02 0.00 0.10 0.00 0.00 34.13 33.95 2osq s GLU 75 CO 0.55 -0.17 -0.15 0.08 0.02 0.00 0.00 175.26 175.58 2osq s VAL 76 N 1.37 1.22 0.15 2.63 1.01 -1.26 -2.41 120.40 123.11 2osq s VAL 76 Ca -0.09 -1.02 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 2osq s VAL 76 Cb -0.10 -1.09 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 2osq s VAL 76 CO -0.09 0.06 0.13 -0.69 0.00 0.00 0.00 175.10 174.51 2osq s VAL 77 N -0.81 0.08 -0.78 2.92 1.01 -0.12 -4.82 120.40 117.88 2osq s VAL 77 Ca 0.03 -1.79 -0.26 0.00 0.00 0.00 0.00 61.98 59.96 2osq s VAL 77 Cb -0.08 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 2osq s VAL 77 CO 0.01 -0.35 1.71 -0.31 0.00 0.00 0.00 175.10 176.16 2osq s TYR 78 N -4.05 1.96 0.02 5.22 2.02 -1.26 0.29 117.35 121.55 2osq s TYR 78 Ca 0.25 0.33 -0.35 0.00 -0.37 0.00 0.00 57.07 56.93 2osq s TYR 78 Cb 0.06 -4.28 -0.13 0.00 -0.40 0.00 0.00 41.96 37.21 2osq s TYR 78 CO 0.03 -2.05 1.70 0.45 -1.57 0.00 0.00 175.55 174.11 2osq n SER 79 N 11.83 3.11 0.00 2.29 2.88 -0.13 -4.54 113.62 129.05 2osq n SER 79 Ca 0.24 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.82 2osq n SER 79 Cb 0.50 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.59 2osq n SER 79 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10