#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 2.43 0.52 -1.84 0.05 -1.26 -4.77 118.68 113.81 2osq s LEU 8 Ca 0.00 0.80 0.07 0.00 0.05 0.00 0.00 54.13 55.04 2osq s LEU 8 Cb 0.00 -3.25 0.03 0.00 -2.05 0.00 0.00 46.19 40.92 2osq s LEU 8 CO 0.00 -2.03 0.45 -0.44 -0.55 0.00 0.00 176.35 173.79 2osq s SER 9 N -4.50 4.79 -0.18 1.48 0.01 -1.26 -5.01 113.70 109.03 2osq s SER 9 Ca 0.63 -1.07 -0.22 0.00 1.31 0.00 0.00 55.95 56.60 2osq s SER 9 Cb -0.11 0.16 -0.21 0.00 0.21 0.00 0.00 66.02 66.06 2osq s SER 9 CO 0.50 -1.03 0.34 -1.13 0.41 0.00 0.00 173.24 172.33 2osq h ASN 10 N 0.74 0.06 -3.27 2.44 -1.24 -1.97 -3.44 115.58 108.89 2osq h ASN 10 Ca -0.37 -0.64 -0.60 0.00 0.71 0.00 0.00 56.30 55.40 2osq h ASN 10 Cb 1.29 -0.02 -0.40 0.00 0.73 0.00 0.00 38.32 39.92 2osq h ASN 10 CO 0.55 1.44 -0.76 0.42 -1.29 0.00 0.00 177.43 177.79 2osq s THR 11 N -2.36 1.07 -0.30 -3.57 -4.23 -1.26 -4.30 115.64 100.69 2osq s THR 11 Ca -0.26 -2.17 -0.20 0.00 -1.18 0.00 0.00 61.69 57.89 2osq s THR 11 Cb 0.04 -1.76 0.20 0.00 1.34 0.00 0.00 72.50 72.32 2osq s THR 11 CO 0.63 -0.87 1.32 -0.60 -0.54 0.00 0.00 174.62 174.56 2osq s ARG 12 N 0.74 0.00 -0.17 3.99 3.52 -1.26 -4.46 118.95 121.31 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 0.03 0.00 -1.56 0.00 0.00 34.95 33.19 2osq s ARG 12 CO -0.04 -0.00 -0.16 -0.51 -0.81 0.00 0.00 175.30 173.78 2osq s LEU 13 N 1.91 2.00 -0.31 -0.88 1.43 0.12 -1.12 118.68 121.82 2osq s LEU 13 Ca 0.00 -0.64 -0.17 0.00 -1.03 0.00 0.00 54.13 52.29 2osq s LEU 13 Cb -0.00 -1.32 -0.02 0.00 0.03 0.00 0.00 46.19 44.88 2osq s LEU 13 CO -0.15 -0.05 0.49 0.12 0.23 0.00 0.00 176.35 176.99 2osq s PHE 14 N 1.38 3.22 0.37 0.29 5.36 0.14 0.04 117.98 128.78 2osq s PHE 14 Ca 0.04 0.36 0.07 0.00 -0.96 0.00 0.00 56.93 56.44 2osq s PHE 14 Cb -0.14 -2.80 -0.00 0.00 -0.34 0.00 0.00 43.02 39.74 2osq s PHE 14 CO -0.11 -0.40 0.49 0.08 -1.46 0.00 0.00 175.22 173.81 2osq s VAL 15 N 2.31 3.56 0.86 3.12 1.01 0.10 -0.87 120.40 130.48 2osq s VAL 15 Ca 0.19 -1.05 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 2osq s VAL 15 Cb -0.16 -3.22 0.11 0.00 0.00 0.00 0.00 36.38 33.11 2osq s VAL 15 CO 0.11 -0.09 1.15 -0.13 0.00 0.00 0.00 175.10 176.14 2osq s ARG 16 N -4.22 1.60 -0.03 2.72 0.52 -0.93 -1.96 118.95 116.65 2osq s ARG 16 Ca 0.48 0.24 -0.30 0.00 -0.52 0.00 0.00 55.73 55.63 2osq s ARG 16 Cb -0.09 -1.90 -0.05 0.00 0.52 0.00 0.00 34.95 33.43 2osq s ARG 16 CO 0.31 -1.87 1.47 -1.25 0.02 0.00 0.00 175.30 173.98 2osq s PRO 17 N -5.40 4.24 0.34 3.54 0.04 -1.25 -3.93 135.00 132.57 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 -3.70 -0.04 0.00 0.04 0.00 0.00 34.50 30.67 2osq s PRO 17 CO 0.51 -0.67 0.56 -0.06 0.04 0.00 0.00 177.00 177.38 2osq s PHE 18 N 2.96 3.50 0.00 0.56 0.40 -1.26 -4.96 117.98 119.18 2osq s PHE 18 Ca 0.66 0.47 0.00 0.00 -0.60 0.00 0.00 56.93 57.46 2osq s PHE 18 Cb -0.32 -1.99 0.00 0.00 0.51 0.00 0.00 43.02 41.23 2osq s PHE 18 CO 0.26 0.11 0.00 -0.35 0.70 0.00 0.00 175.22 175.94 2osq n PRO 19 N -1.55 0.48 0.33 0.24 -0.04 -1.26 -4.56 135.00 128.64 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 0.81 0.00 -0.04 0.00 0.00 33.50 34.82 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 -2.37 1.53 8.10 -2.04 0.35 115.31 120.87 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 -0.67 -4.11 0.00 0.00 178.44 173.76 2osq n ASP 21 N -2.86 3.16 -4.56 0.17 2.03 -1.26 -4.83 116.55 108.40 2osq n ASP 21 Ca -0.02 -2.50 -0.38 0.00 0.52 0.00 0.00 54.79 52.40 2osq n ASP 21 Cb 0.37 -0.60 -0.03 0.00 -0.72 0.00 0.00 41.12 40.14 2osq n ASP 21 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2osq s VAL 22 N -1.65 3.69 0.21 5.18 0.11 0.12 -4.81 120.40 123.24 2osq s VAL 22 Ca 0.24 -0.17 -0.09 0.00 -2.93 0.00 0.00 61.98 59.04 2osq s VAL 22 Cb 0.19 -4.67 -0.01 0.00 -1.53 0.00 0.00 36.38 30.36 2osq s VAL 22 CO 0.06 -1.59 0.33 0.00 -3.33 0.00 0.00 175.10 170.57 2osq s GLN 23 N 5.88 1.33 0.54 1.54 -2.07 -1.26 -4.94 119.66 120.68 2osq s GLN 23 Ca 0.50 -1.31 0.32 0.00 -1.82 0.00 0.00 55.36 53.05 2osq s GLN 23 Cb -0.06 0.39 1.44 0.00 -1.09 0.00 0.00 33.01 33.69 2osq s GLN 23 CO 0.04 -0.51 2.02 1.05 -1.32 0.00 0.00 175.29 176.58 2osq h GLU 24 N 2.44 0.00 -0.21 9.60 4.11 -1.93 -3.10 114.58 125.48 2osq h GLU 24 Ca -0.30 0.00 0.05 0.00 0.07 0.00 0.00 59.36 59.18 2osq h GLU 24 Cb 1.24 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 30.44 2osq h GLU 24 CO 0.44 0.06 -0.11 1.03 0.07 0.00 0.00 179.01 180.50 2osq h SER 25 N 0.00 -0.37 -0.15 3.06 0.87 -1.96 0.28 113.55 115.29 2osq h SER 25 Ca -0.00 0.09 -0.15 0.00 -1.23 0.00 0.00 61.79 60.50 2osq h SER 25 Cb 0.46 0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.62 2osq h SER 25 CO 0.01 -0.14 -0.41 1.05 -0.53 0.00 0.00 176.83 176.80 2osq h GLU 26 N -0.09 0.70 -0.67 2.24 4.11 -1.86 -1.61 114.58 117.40 2osq h GLU 26 Ca 0.12 -0.37 -0.04 0.00 0.07 0.00 0.00 59.36 59.14 2osq h GLU 26 Cb 0.26 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 2osq h GLU 26 CO -0.27 0.98 0.26 -0.07 0.07 0.00 0.00 179.01 179.98 2osq h LEU 27 N 0.57 0.91 -0.07 3.06 3.38 -1.39 0.23 115.31 122.01 2osq h LEU 27 Ca 0.04 -0.13 -0.23 0.00 0.09 0.00 0.00 57.88 57.66 2osq h LEU 27 Cb 0.95 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.48 2osq h LEU 27 CO 0.09 0.82 -0.84 0.78 0.09 0.00 0.00 178.44 179.38 2osq h ASN 28 N 0.97 0.86 1.29 -0.43 2.35 -0.35 0.34 115.58 120.61 2osq h ASN 28 Ca 0.23 -0.69 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 2osq h ASN 28 Cb 0.20 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.32 2osq h ASN 28 CO -0.02 1.42 0.00 -0.33 -1.65 0.00 0.00 177.43 176.85 2osq h GLU 29 N 0.36 0.00 0.00 0.81 4.39 -1.07 0.41 114.58 119.48 2osq h GLU 29 Ca -0.09 0.00 -0.23 0.00 0.34 0.00 0.00 59.36 59.38 2osq h GLU 29 Cb 1.49 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 30.11 2osq h GLU 29 CO 0.17 0.00 -1.56 -0.89 -1.16 0.00 0.00 179.01 175.57 2osq n ILE 30 N -2.99 1.51 1.67 3.13 5.41 0.79 -4.38 119.36 124.49 2osq n ILE 30 Ca 0.02 -0.08 0.15 0.00 1.00 0.00 0.00 62.75 63.83 2osq n ILE 30 Cb 0.37 -2.10 0.72 0.00 -0.71 0.00 0.00 39.64 37.91 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 -4.40 0.00 0.28 1.39 3.01 0.12 -4.20 117.46 113.66 2osq n PHE 31 Ca -0.33 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 57.96 2osq n PHE 31 Cb 0.66 -0.06 -0.09 0.00 -0.01 0.00 0.00 39.48 39.97 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 -1.25 -5.54 1.37 0.00 -0.27 -3.19 103.07 99.14 2osq h GLY 32 Ca 0.00 0.58 -0.34 0.00 0.00 0.00 0.00 47.33 47.57 2osq h GLY 32 CO 0.00 -0.37 2.39 -1.55 0.00 0.00 0.00 176.54 177.01 2osq n PRO 33 N -5.36 1.79 0.00 4.80 -0.04 -1.26 -3.05 135.00 131.89 2osq n PRO 33 Ca -0.12 -1.34 0.00 0.00 -0.04 0.00 0.00 63.50 62.00 2osq n PRO 33 Cb 0.44 -2.40 0.00 0.00 -0.04 0.00 0.00 33.50 31.50 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 4.41 -0.28 0.00 0.54 3.72 -1.20 -5.09 117.46 119.56 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 0.02 -0.32 3.57 1.37 0.00 -1.17 -4.69 105.19 103.96 2osq n GLY 35 Ca 0.00 -1.14 -0.27 0.00 0.00 0.00 0.00 46.02 44.61 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 2.52 -0.25 1.61 0.04 -1.26 -4.85 135.00 130.80 2osq s PRO 36 Ca 0.00 -0.67 -0.28 0.00 0.04 0.00 0.00 61.00 60.09 2osq s PRO 36 Cb 0.00 -5.14 -0.05 0.00 0.04 0.00 0.00 34.50 29.35 2osq s PRO 36 CO 0.00 -3.66 2.23 0.00 0.04 0.00 0.00 177.00 175.62 2osq s MET 37 N 6.79 3.01 0.25 4.56 0.23 -1.26 -1.07 119.30 131.82 2osq s MET 37 Ca 0.69 1.95 -0.03 0.00 -1.03 0.00 0.00 55.69 57.27 2osq s MET 37 Cb -0.04 -4.39 0.43 0.00 -1.53 0.00 0.00 34.83 29.29 2osq s MET 37 CO 0.05 -2.24 1.82 0.87 -2.03 0.00 0.00 175.02 173.50 2osq h LYS 38 N 15.54 0.85 -2.36 3.16 1.79 -0.96 -3.45 116.57 131.14 2osq h LYS 38 Ca -0.39 -0.05 0.13 0.00 -2.18 0.00 0.00 60.65 58.16 2osq h LYS 38 Cb 1.24 -0.19 -0.12 0.00 -1.58 0.00 0.00 32.23 31.58 2osq h LYS 38 CO 0.98 0.56 0.47 -2.00 -1.08 0.00 0.00 179.45 178.38 2osq s GLU 39 N -6.02 1.03 -0.08 3.15 2.56 -0.41 -4.99 118.70 113.95 2osq s GLU 39 Ca -0.12 -0.48 -0.04 0.00 0.00 0.00 0.00 54.97 54.33 2osq s GLU 39 Cb 0.20 0.41 0.04 0.00 2.00 0.00 0.00 34.13 36.78 2osq s GLU 39 CO 0.79 -0.46 0.17 0.14 -0.56 0.00 0.00 175.26 175.34 2osq s VAL 40 N -3.24 -0.04 -0.08 3.70 -7.23 -1.26 -0.56 120.40 111.68 2osq s VAL 40 Ca 0.08 0.16 0.01 0.00 -1.81 0.00 0.00 61.98 60.42 2osq s VAL 40 Cb -0.01 -0.28 -0.02 0.00 0.56 0.00 0.00 36.38 36.63 2osq s VAL 40 CO -0.04 0.07 -0.11 -0.54 -0.31 0.00 0.00 175.10 174.16 2osq s LYS 41 N 1.13 2.89 -0.20 4.82 -0.14 0.93 -4.98 119.74 124.18 2osq s LYS 41 Ca -0.09 -0.64 -0.02 0.00 -1.36 0.00 0.00 55.97 53.86 2osq s LYS 41 Cb -0.11 -2.54 0.06 0.00 -1.68 0.00 0.00 37.83 33.57 2osq s LYS 41 CO -0.06 0.49 0.02 0.96 -0.76 0.00 0.00 175.35 176.01 2osq s ILE 42 N -0.38 0.66 0.03 2.17 -0.00 -1.26 -0.10 121.20 122.32 2osq s ILE 42 Ca 0.04 -0.65 0.07 0.00 -0.00 0.00 0.00 60.65 60.12 2osq s ILE 42 Cb -0.12 -1.13 -0.02 0.00 -0.00 0.00 0.00 42.46 41.18 2osq s ILE 42 CO 0.02 -0.19 -0.21 -0.76 -0.00 0.00 0.00 174.94 173.79 2osq s LEU 43 N 1.80 2.14 -0.68 0.37 1.43 -0.58 -4.98 118.68 118.17 2osq s LEU 43 Ca -0.02 -0.50 -0.26 0.00 -1.03 0.00 0.00 54.13 52.33 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 0.19 2.42 -3.20 0.23 0.00 0.00 176.35 175.91 2osq n ASN 44 N 1.99 1.89 0.00 2.29 2.85 -1.26 -0.89 115.26 122.13 2osq n ASN 44 Ca -0.17 -1.06 0.00 0.00 -0.11 0.00 0.00 54.58 53.24 2osq n ASN 44 Cb 0.53 -1.59 0.00 0.00 1.24 0.00 0.00 39.78 39.96 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 6.46 1.27 3.54 8.20 0.00 -1.26 -5.10 105.19 118.31 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 -0.40 -0.40 0.16 1.61 -0.12 -0.07 -3.95 117.98 114.82 2osq s PHE 46 Ca 0.00 0.54 0.08 0.00 -0.05 0.00 0.00 56.93 57.50 2osq s PHE 46 Cb 0.00 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 42.83 2osq s PHE 46 CO 0.00 -0.45 -0.17 0.00 -0.05 0.00 0.00 175.22 174.55 2osq s ALA 47 N -1.86 1.90 -0.00 1.99 0.00 -0.83 -1.53 121.76 121.43 2osq s ALA 47 Ca -0.00 -1.48 -0.02 0.00 0.00 0.00 0.00 51.96 50.45 2osq s ALA 47 Cb -0.01 -0.14 -0.00 0.00 0.00 0.00 0.00 23.12 22.97 2osq s ALA 47 CO -0.01 0.18 0.04 -0.06 0.00 0.00 0.00 175.76 175.91 2osq s PHE 48 N -2.23 0.08 -0.13 0.00 0.08 0.86 0.03 117.98 116.67 2osq s PHE 48 Ca 0.15 -0.16 -0.04 0.00 0.12 0.00 0.00 56.93 57.00 2osq s PHE 48 Cb -0.05 -0.07 0.06 0.00 -0.57 0.00 0.00 43.02 42.39 2osq s PHE 48 CO 0.06 -0.15 0.12 0.08 -0.10 0.00 0.00 175.22 175.23 2osq s VAL 49 N -0.84 -0.16 -0.37 -0.44 1.01 0.11 -0.05 120.40 119.65 2osq s VAL 49 Ca -0.09 0.09 -0.13 0.00 0.00 0.00 0.00 61.98 61.85 2osq s VAL 49 Cb -0.06 -0.43 0.01 0.00 0.00 0.00 0.00 36.38 35.90 2osq s VAL 49 CO -0.00 -0.08 0.24 -0.70 0.00 0.00 0.00 175.10 174.56 2osq s GLU 50 N 2.21 3.09 0.20 2.72 2.12 0.28 0.11 118.70 129.43 2osq s GLU 50 Ca 0.04 -0.92 -0.17 0.00 0.36 0.00 0.00 54.97 54.28 2osq s GLU 50 Cb -0.14 -3.81 -0.08 0.00 0.26 0.00 0.00 34.13 30.36 2osq s GLU 50 CO -0.07 -0.62 0.66 -0.06 -0.54 0.00 0.00 175.26 174.62 2osq s PHE 51 N 1.64 3.60 -1.65 5.30 0.08 -1.26 -0.40 117.98 125.30 2osq s PHE 51 Ca 0.04 1.23 0.21 0.00 0.12 0.00 0.00 56.93 58.54 2osq s PHE 51 Cb -0.18 -2.51 1.14 0.00 -0.57 0.00 0.00 43.02 40.90 2osq s PHE 51 CO 0.09 0.34 1.67 -1.91 -0.10 0.00 0.00 175.22 175.31 2osq n GLU 52 N 0.61 0.44 -3.76 0.44 0.00 -0.23 -4.54 120.64 113.61 2osq n GLU 52 Ca -0.03 0.06 -0.20 0.00 0.00 0.00 0.00 57.16 56.99 2osq n GLU 52 Cb 0.52 -1.50 -0.17 0.00 0.00 0.00 0.00 31.44 30.28 2osq n GLU 52 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 2osq s GLU 53 N -2.35 0.19 0.28 5.31 2.02 -1.26 -4.99 118.70 117.90 2osq s GLU 53 Ca 0.25 0.23 0.02 0.00 0.02 0.00 0.00 54.97 55.48 2osq s GLU 53 Cb 0.14 -0.61 0.64 0.00 0.10 0.00 0.00 34.13 34.40 2osq s GLU 53 CO 0.29 -0.27 1.73 0.00 0.02 0.00 0.00 175.26 177.03 2osq h ALA 54 N 8.08 1.37 -0.14 5.21 0.00 -1.81 -0.82 119.26 131.15 2osq h ALA 54 Ca -0.23 0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.83 2osq h ALA 54 Cb 1.12 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 2osq h ALA 54 CO 0.27 -0.21 -0.04 1.49 0.00 0.00 0.00 179.25 180.76 2osq h GLU 55 N 0.52 -0.01 -0.63 0.00 4.81 -1.96 0.20 114.58 117.51 2osq h GLU 55 Ca 0.52 0.00 0.05 0.00 -0.13 0.00 0.00 59.36 59.79 2osq h GLU 55 Cb 0.87 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.21 2osq h GLU 55 CO -0.44 -0.01 0.42 0.77 -0.73 0.00 0.00 179.01 179.02 2osq h SER 56 N -0.01 0.59 0.11 1.04 0.02 -1.46 -0.84 113.55 113.00 2osq h SER 56 Ca 0.07 -0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 2osq h SER 56 Cb 0.12 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.53 2osq h SER 56 CO -0.15 0.39 -0.05 0.00 -1.14 0.00 0.00 176.83 175.88 2osq h ALA 57 N 1.65 -0.15 -0.73 3.77 0.00 -0.57 -0.95 119.26 122.28 2osq h ALA 57 Ca 0.26 -0.25 0.14 0.00 0.00 0.00 0.00 54.91 55.06 2osq h ALA 57 Cb 0.18 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 2osq h ALA 57 CO -0.08 -0.27 0.49 0.00 0.00 0.00 0.00 179.25 179.40 2osq h ALA 58 N -0.10 2.09 0.06 0.00 0.00 -0.37 -1.04 119.26 119.90 2osq h ALA 58 Ca -0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2osq h ALA 58 Cb 0.56 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2osq h ALA 58 CO 0.03 -0.28 -0.03 0.87 0.00 0.00 0.00 179.25 179.84 2osq h LYS 59 N 0.43 -0.08 -0.93 0.00 1.79 -1.18 -3.21 116.57 113.40 2osq h LYS 59 Ca 0.36 0.01 0.24 0.00 -2.18 0.00 0.00 60.65 59.07 2osq h LYS 59 Cb 0.79 0.02 -0.06 0.00 -1.58 0.00 0.00 32.23 31.40 2osq h LYS 59 CO -0.11 0.49 0.63 0.00 -1.08 0.00 0.00 179.45 179.38 2osq h ALA 60 N -0.24 2.49 -0.60 3.86 0.00 -0.74 0.46 119.26 124.48 2osq h ALA 60 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 2osq h ALA 60 Cb 0.61 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2osq h ALA 60 CO 0.01 -0.78 0.04 0.82 0.00 0.00 0.00 179.25 179.35 2osq h ILE 61 N 0.23 1.26 0.00 0.00 2.04 -1.26 0.34 117.51 120.13 2osq h ILE 61 Ca 0.47 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 65.24 2osq h ILE 61 Cb 1.46 0.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.32 2osq h ILE 61 CO -0.12 0.40 -0.45 -0.62 0.00 0.00 0.00 178.15 177.36 2osq n GLU 62 N -4.23 0.06 -0.04 2.37 -0.58 0.44 -3.49 120.64 115.16 2osq n GLU 62 Ca 0.03 0.02 -0.03 0.00 -0.42 0.00 0.00 57.16 56.75 2osq n GLU 62 Cb 0.32 -1.54 -0.01 0.00 -0.57 0.00 0.00 31.44 29.64 2osq n GLU 62 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2osq n GLU 63 N -1.62 0.24 -0.20 3.49 -0.58 0.13 -4.41 120.64 117.70 2osq n GLU 63 Ca 0.05 0.26 0.28 0.00 -0.42 0.00 0.00 57.16 57.33 2osq n GLU 63 Cb 0.36 -1.10 0.69 0.00 -0.57 0.00 0.00 31.44 30.82 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 -0.50 0.56 -2.41 2.62 2.07 -0.53 -3.40 116.25 114.66 2osq h VAL 64 Ca 0.00 -0.02 -0.55 0.00 0.82 0.00 0.00 66.70 66.95 2osq h VAL 64 Cb 0.37 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.63 2osq h VAL 64 CO 0.00 0.01 1.24 -2.28 0.02 0.00 0.00 177.57 176.56 2osq s HIS 65 N -5.05 1.52 0.00 1.57 5.65 -1.23 -1.63 115.29 116.13 2osq s HIS 65 Ca -0.06 0.02 0.00 0.00 0.25 0.00 0.00 55.06 55.27 2osq s HIS 65 Cb 0.22 -4.08 0.00 0.00 -1.18 0.00 0.00 32.58 27.54 2osq s HIS 65 CO 0.78 -4.54 0.00 0.41 -0.65 0.00 0.00 174.74 170.74 2osq n GLY 66 N 4.72 0.71 1.87 1.59 0.00 -1.16 -4.97 105.19 107.95 2osq n GLY 66 Ca 0.21 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 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 -1.49 -1.67 -5.07 1.61 4.76 -0.64 -4.73 118.16 110.92 2osq n LYS 67 Ca 0.00 -0.95 -0.28 0.00 -2.87 0.00 0.00 58.31 54.21 2osq n LYS 67 Cb 0.00 -0.80 -0.16 0.00 -1.84 0.00 0.00 35.03 32.23 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 -3.18 2.55 -0.29 4.39 1.04 -1.26 -1.17 113.70 115.78 2osq s SER 68 Ca 0.37 -0.40 -0.18 0.00 0.48 0.00 0.00 55.95 56.22 2osq s SER 68 Cb -0.03 -0.32 0.16 0.00 0.10 0.00 0.00 66.02 65.93 2osq s SER 68 CO 0.28 0.26 1.11 0.12 0.98 0.00 0.00 173.24 175.99 2osq s PHE 69 N -0.47 -0.37 -1.43 5.02 2.19 -0.29 -4.86 117.98 117.77 2osq s PHE 69 Ca 0.07 0.78 -0.04 0.00 0.33 0.00 0.00 56.93 58.07 2osq s PHE 69 Cb -0.09 0.29 0.00 0.00 -1.31 0.00 0.00 43.02 41.91 2osq s PHE 69 CO -0.01 -0.18 0.55 0.00 1.83 0.00 0.00 175.22 177.41 2osq n ALA 70 N 3.08 -0.88 -2.97 11.12 0.00 -1.26 -1.85 120.51 127.75 2osq n ALA 70 Ca -0.16 0.27 -0.22 0.00 0.00 0.00 0.00 53.44 53.32 2osq n ALA 70 Cb 0.57 -3.61 0.03 0.00 0.00 0.00 0.00 19.45 16.45 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 -2.14 -6.16 -3.59 0.00 3.02 -1.26 -4.97 115.26 100.15 2osq n ASN 71 Ca -0.11 -0.27 -0.16 0.00 -0.03 0.00 0.00 54.58 54.02 2osq n ASN 71 Cb 0.61 -4.99 -0.06 0.00 -0.61 0.00 0.00 39.78 34.73 2osq n ASN 71 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2osq s GLN 72 N -5.65 0.97 -0.03 3.52 -2.07 -0.77 -5.14 119.66 110.49 2osq s GLN 72 Ca 0.28 -0.01 -0.30 0.00 -1.82 0.00 0.00 55.36 53.51 2osq s GLN 72 Cb -0.12 0.45 -0.05 0.00 -1.09 0.00 0.00 33.01 32.19 2osq s GLN 72 CO 0.35 -0.31 1.48 -1.25 -1.32 0.00 0.00 175.29 174.23 2osq s PRO 73 N -1.66 4.24 0.83 9.60 0.04 -1.26 -1.14 135.00 145.65 2osq s PRO 73 Ca -0.10 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 62.86 2osq s PRO 73 Cb -0.01 -3.71 0.09 0.00 0.04 0.00 0.00 34.50 30.91 2osq s PRO 73 CO 0.05 -0.68 1.09 -0.51 0.04 0.00 0.00 177.00 176.99 2osq s LEU 74 N 3.01 2.66 -0.10 -3.56 1.43 -0.32 -4.93 118.68 116.88 2osq s LEU 74 Ca 0.66 1.67 -0.05 0.00 -1.03 0.00 0.00 54.13 55.38 2osq s LEU 74 Cb -0.31 -4.23 0.04 0.00 0.03 0.00 0.00 46.19 41.72 2osq s LEU 74 CO 0.26 -2.33 0.23 -1.61 0.23 0.00 0.00 176.35 173.13 2osq s GLU 75 N -4.92 0.19 0.03 1.70 2.02 -1.26 -2.98 118.70 113.49 2osq s GLU 75 Ca 0.62 0.51 0.04 0.00 0.02 0.00 0.00 54.97 56.16 2osq s GLU 75 Cb -0.18 -0.12 -0.02 0.00 0.10 0.00 0.00 34.13 33.91 2osq s GLU 75 CO 0.56 -0.16 -0.13 0.08 0.02 0.00 0.00 175.26 175.63 2osq s VAL 76 N 1.23 1.03 0.15 2.63 1.01 -1.26 -2.18 120.40 123.01 2osq s VAL 76 Ca -0.09 -0.89 -0.03 0.00 0.00 0.00 0.00 61.98 60.97 2osq s VAL 76 Cb -0.10 -0.93 -0.03 0.00 0.00 0.00 0.00 36.38 35.32 2osq s VAL 76 CO -0.08 0.04 0.13 -0.69 0.00 0.00 0.00 175.10 174.50 2osq s VAL 77 N -0.75 0.07 -0.77 2.92 1.01 -0.05 -4.84 120.40 118.00 2osq s VAL 77 Ca 0.02 -1.80 -0.26 0.00 0.00 0.00 0.00 61.98 59.94 2osq s VAL 77 Cb -0.07 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 2osq s VAL 77 CO 0.01 -0.33 1.77 -0.31 0.00 0.00 0.00 175.10 176.24 2osq s TYR 78 N -4.05 1.88 -0.02 5.22 2.02 -1.26 0.25 117.35 121.39 2osq s TYR 78 Ca 0.25 0.46 -0.34 0.00 -0.37 0.00 0.00 57.07 57.07 2osq s TYR 78 Cb 0.06 -4.21 -0.13 0.00 -0.40 0.00 0.00 41.96 37.29 2osq s TYR 78 CO 0.04 -2.05 1.77 0.45 -1.57 0.00 0.00 175.55 174.18 2osq n SER 79 N 12.34 3.23 0.00 2.29 2.88 -0.28 -4.53 113.62 129.56 2osq n SER 79 Ca 0.26 1.02 0.00 0.00 -1.33 0.00 0.00 58.87 58.82 2osq n SER 79 Cb 0.50 -1.37 0.03 0.00 -0.75 0.00 0.00 64.21 62.61 2osq n SER 79 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10