#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 2.24 0.49 -1.84 0.05 -1.26 -4.72 118.68 113.64 2osq s LEU 8 Ca 0.00 0.77 0.07 0.00 0.05 0.00 0.00 54.13 55.02 2osq s LEU 8 Cb 0.00 -3.08 0.02 0.00 -2.05 0.00 0.00 46.19 41.08 2osq s LEU 8 CO 0.00 -2.42 0.46 -0.44 -0.55 0.00 0.00 176.35 173.40 2osq s SER 9 N -4.37 4.90 -0.06 1.48 0.01 -1.26 -5.00 113.70 109.41 2osq s SER 9 Ca 0.65 -0.96 -0.02 0.00 1.31 0.00 0.00 55.95 56.93 2osq s SER 9 Cb -0.11 -0.03 -0.26 0.00 0.21 0.00 0.00 66.02 65.82 2osq s SER 9 CO 0.52 -0.95 0.60 -0.55 0.41 0.00 0.00 173.24 173.26 2osq h ASN 10 N 0.77 0.35 -2.23 2.44 -1.07 -1.97 -3.44 115.58 110.42 2osq h ASN 10 Ca -0.38 -0.64 -0.47 0.00 0.07 0.00 0.00 56.30 54.88 2osq h ASN 10 Cb 1.28 -0.11 -0.35 0.00 -2.07 0.00 0.00 38.32 37.08 2osq h ASN 10 CO 0.54 1.56 -0.76 0.42 0.07 0.00 0.00 177.43 179.26 2osq s THR 11 N -2.59 -0.12 0.00 6.14 -4.23 -1.26 -4.11 115.64 109.48 2osq s THR 11 Ca -0.14 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 2osq s THR 11 Cb 0.07 -0.87 0.00 0.00 1.34 0.00 0.00 72.50 73.04 2osq s THR 11 CO 0.81 -0.78 0.00 -1.14 -0.54 0.00 0.00 174.62 172.98 2osq n ARG 12 N 4.12 0.00 -4.53 3.99 0.63 -1.26 -4.43 116.66 115.18 2osq n ARG 12 Ca 0.12 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.74 2osq n ARG 12 Cb 0.41 0.00 -0.17 0.00 0.45 0.00 0.00 32.46 33.16 2osq n ARG 12 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 2osq s LEU 13 N 0.00 1.91 -0.22 6.15 1.43 0.99 -0.06 118.68 128.87 2osq s LEU 13 Ca 0.00 -0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 52.42 2osq s LEU 13 Cb 0.00 -1.27 -0.04 0.00 0.03 0.00 0.00 46.19 44.92 2osq s LEU 13 CO 0.00 0.04 0.44 0.12 0.23 0.00 0.00 176.35 177.18 2osq s PHE 14 N 0.93 3.34 0.34 0.29 5.36 0.15 -0.41 117.98 127.98 2osq s PHE 14 Ca -0.06 0.63 0.07 0.00 -0.96 0.00 0.00 56.93 56.61 2osq s PHE 14 Cb -0.15 -2.60 -0.02 0.00 -0.34 0.00 0.00 43.02 39.91 2osq s PHE 14 CO -0.02 -0.11 0.38 0.08 -1.46 0.00 0.00 175.22 174.09 2osq s VAL 15 N 1.65 3.66 0.86 3.12 1.01 0.13 -1.50 120.40 129.34 2osq s VAL 15 Ca 0.20 -1.21 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 2osq s VAL 15 Cb -0.15 -3.25 0.11 0.00 0.00 0.00 0.00 36.38 33.09 2osq s VAL 15 CO 0.09 -0.15 1.15 -0.13 0.00 0.00 0.00 175.10 176.06 2osq s ARG 16 N -4.09 1.53 -0.03 2.72 0.52 -0.79 -2.09 118.95 116.72 2osq s ARG 16 Ca 0.44 0.26 -0.30 0.00 -0.52 0.00 0.00 55.73 55.60 2osq s ARG 16 Cb -0.07 -1.89 -0.05 0.00 0.52 0.00 0.00 34.95 33.46 2osq s ARG 16 CO 0.29 -1.93 1.47 -1.25 0.02 0.00 0.00 175.30 173.90 2osq s PRO 17 N -5.37 4.24 0.31 3.54 0.04 -1.26 -3.96 135.00 132.54 2osq s PRO 17 Ca 0.63 2.02 -0.01 0.00 0.04 0.00 0.00 61.00 63.67 2osq s PRO 17 Cb -0.13 -3.71 -0.04 0.00 0.04 0.00 0.00 34.50 30.66 2osq s PRO 17 CO 0.52 -0.68 0.53 -0.06 0.04 0.00 0.00 177.00 177.35 2osq s PHE 18 N 3.00 3.49 0.00 0.56 0.40 -1.26 -4.96 117.98 119.22 2osq s PHE 18 Ca 0.66 0.44 0.00 0.00 -0.60 0.00 0.00 56.93 57.43 2osq s PHE 18 Cb -0.31 -1.95 0.00 0.00 0.51 0.00 0.00 43.02 41.26 2osq s PHE 18 CO 0.26 0.17 0.00 -0.35 0.70 0.00 0.00 175.22 176.00 2osq n PRO 19 N -1.38 0.70 0.33 0.24 -0.04 -1.26 -4.55 135.00 129.04 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 0.81 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 -2.41 1.53 8.10 -2.04 0.33 115.31 120.83 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 0.11 -0.67 -4.11 0.00 0.00 178.44 173.77 2osq n ASP 21 N -2.85 3.19 -4.56 0.17 2.03 -1.26 -4.81 116.55 108.46 2osq n ASP 21 Ca -0.02 -2.52 -0.38 0.00 0.52 0.00 0.00 54.79 52.39 2osq n ASP 21 Cb 0.37 -0.61 -0.03 0.00 -0.72 0.00 0.00 41.12 40.13 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 -1.66 3.81 0.21 5.18 0.11 0.12 -4.78 120.40 123.38 2osq s VAL 22 Ca 0.25 -0.68 -0.07 0.00 -2.93 0.00 0.00 61.98 58.55 2osq s VAL 22 Cb 0.19 -4.81 -0.02 0.00 -1.53 0.00 0.00 36.38 30.21 2osq s VAL 22 CO 0.06 -1.70 0.28 0.00 -3.33 0.00 0.00 175.10 170.40 2osq s GLN 23 N 5.46 1.30 0.51 1.54 -2.07 -1.26 -4.90 119.66 120.23 2osq s GLN 23 Ca 0.52 -1.40 0.27 0.00 -1.82 0.00 0.00 55.36 52.93 2osq s GLN 23 Cb -0.02 0.36 1.33 0.00 -1.09 0.00 0.00 33.01 33.60 2osq s GLN 23 CO -0.08 -0.48 2.01 1.05 -1.32 0.00 0.00 175.29 176.48 2osq h GLU 24 N 2.49 0.00 -0.23 9.60 4.11 -1.95 -3.08 114.58 125.53 2osq h GLU 24 Ca -0.32 0.00 0.06 0.00 0.07 0.00 0.00 59.36 59.17 2osq h GLU 24 Cb 1.24 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.43 2osq h GLU 24 CO 0.46 0.14 -0.21 1.03 0.07 0.00 0.00 179.01 180.50 2osq h SER 25 N 0.00 -0.68 -0.41 3.06 0.87 -1.96 0.25 113.55 114.69 2osq h SER 25 Ca -0.00 0.13 -0.14 0.00 -1.23 0.00 0.00 61.79 60.55 2osq h SER 25 Cb 0.44 0.32 -0.01 0.00 -0.44 0.00 0.00 62.40 62.72 2osq h SER 25 CO 0.02 -0.25 -0.28 1.05 -0.53 0.00 0.00 176.83 176.84 2osq h GLU 26 N -0.22 0.94 -0.96 2.24 4.11 -1.84 -1.50 114.58 117.35 2osq h GLU 26 Ca 0.13 -0.43 0.03 0.00 0.07 0.00 0.00 59.36 59.16 2osq h GLU 26 Cb 0.42 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 2osq h GLU 26 CO -0.36 1.09 0.63 -0.07 0.07 0.00 0.00 179.01 180.38 2osq h LEU 27 N 0.79 1.06 -0.05 3.06 3.38 -1.33 0.28 115.31 122.50 2osq h LEU 27 Ca 0.09 -0.02 -0.23 0.00 0.09 0.00 0.00 57.88 57.81 2osq h LEU 27 Cb 0.86 -0.25 0.02 0.00 0.09 0.00 0.00 40.66 41.37 2osq h LEU 27 CO 0.08 0.74 -0.87 0.78 0.09 0.00 0.00 178.44 179.26 2osq h ASN 28 N 1.24 0.85 1.05 -0.43 2.35 -0.41 0.41 115.58 120.63 2osq h ASN 28 Ca 0.37 -0.71 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 2osq h ASN 28 Cb -0.05 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.06 2osq h ASN 28 CO -0.10 1.44 0.00 -0.33 -1.65 0.00 0.00 177.43 176.79 2osq h GLU 29 N 0.34 0.00 0.00 0.81 4.39 -0.87 0.40 114.58 119.65 2osq h GLU 29 Ca -0.10 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.46 2osq h GLU 29 Cb 1.53 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.16 2osq h GLU 29 CO 0.17 0.00 -1.45 -0.89 -1.16 0.00 0.00 179.01 175.69 2osq n ILE 30 N -2.86 1.50 1.86 3.13 5.41 0.93 -4.45 119.36 124.89 2osq n ILE 30 Ca 0.01 -0.02 0.16 0.00 1.00 0.00 0.00 62.75 63.90 2osq n ILE 30 Cb 0.31 -2.20 0.88 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 -4.41 0.00 0.26 1.39 3.01 0.14 -4.12 117.46 113.75 2osq n PHE 31 Ca -0.26 0.00 -0.16 0.00 1.01 0.00 0.00 57.45 58.04 2osq n PHE 31 Cb 0.62 -0.04 -0.09 0.00 -0.01 0.00 0.00 39.48 39.96 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 4.99 -1.20 -5.55 1.37 0.00 -0.29 -3.19 103.07 99.20 2osq h GLY 32 Ca 0.00 0.55 -0.34 0.00 0.00 0.00 0.00 47.33 47.54 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 -5.11 1.79 0.00 4.80 -0.04 -1.26 -3.06 135.00 132.13 2osq n PRO 33 Ca -0.11 -1.34 0.00 0.00 -0.04 0.00 0.00 63.50 62.01 2osq n PRO 33 Cb 0.41 -2.41 0.00 0.00 -0.04 0.00 0.00 33.50 31.46 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 4.43 -0.17 0.00 0.54 3.72 -1.20 -5.08 117.46 119.69 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 0.08 0.00 0.00 -0.94 0.00 0.00 39.48 38.74 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 0.17 -0.20 3.56 1.37 0.00 -1.17 -4.65 105.19 104.26 2osq n GLY 35 Ca 0.00 -1.17 -0.28 0.00 0.00 0.00 0.00 46.02 44.56 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 2.57 -0.23 1.61 0.04 -1.26 -4.86 135.00 130.86 2osq s PRO 36 Ca 0.00 -0.16 -0.28 0.00 0.04 0.00 0.00 61.00 60.60 2osq s PRO 36 Cb 0.00 -4.96 -0.05 0.00 0.04 0.00 0.00 34.50 29.53 2osq s PRO 36 CO 0.00 -3.28 2.23 0.00 0.04 0.00 0.00 177.00 175.99 2osq s MET 37 N 7.01 3.07 0.33 4.56 0.23 -1.26 -0.41 119.30 132.82 2osq s MET 37 Ca 0.70 1.99 0.01 0.00 -1.03 0.00 0.00 55.69 57.36 2osq s MET 37 Cb -0.08 -4.39 0.59 0.00 -1.53 0.00 0.00 34.83 29.43 2osq s MET 37 CO 0.02 -2.18 1.98 -0.22 -2.03 0.00 0.00 175.02 172.60 2osq h LYS 38 N 15.32 0.91 -2.47 3.16 1.63 -0.71 -3.44 116.57 130.97 2osq h LYS 38 Ca -0.40 -0.05 0.13 0.00 -0.85 0.00 0.00 60.65 59.47 2osq h LYS 38 Cb 1.24 -0.20 -0.10 0.00 -0.60 0.00 0.00 32.23 32.57 2osq h LYS 38 CO 0.97 0.60 0.43 -2.00 -3.45 0.00 0.00 179.45 176.00 2osq s GLU 39 N -5.80 1.18 -0.02 1.90 2.12 0.26 -4.96 118.70 113.38 2osq s GLU 39 Ca -0.11 -0.59 -0.10 0.00 0.36 0.00 0.00 54.97 54.54 2osq s GLU 39 Cb 0.18 0.44 0.01 0.00 0.26 0.00 0.00 34.13 35.03 2osq s GLU 39 CO 0.78 -0.54 0.21 0.14 -0.54 0.00 0.00 175.26 175.31 2osq s VAL 40 N -3.37 0.06 -0.02 3.70 -7.23 -1.26 -1.06 120.40 111.22 2osq s VAL 40 Ca 0.09 -0.49 0.01 0.00 -1.81 0.00 0.00 61.98 59.78 2osq s VAL 40 Cb -0.02 -0.46 0.02 0.00 0.56 0.00 0.00 36.38 36.48 2osq s VAL 40 CO -0.02 -0.27 -0.01 -0.54 -0.31 0.00 0.00 175.10 173.95 2osq s LYS 41 N -1.07 0.30 -0.20 4.82 3.01 0.11 -4.98 119.74 121.72 2osq s LYS 41 Ca -0.11 0.01 -0.02 0.00 -1.01 0.00 0.00 55.97 54.84 2osq s LYS 41 Cb -0.06 -0.41 0.06 0.00 -1.01 0.00 0.00 37.83 36.41 2osq s LYS 41 CO 0.02 -0.07 0.03 0.96 0.51 0.00 0.00 175.35 176.80 2osq s ILE 42 N 0.68 0.65 0.05 2.17 -0.00 -1.26 -0.41 121.20 123.07 2osq s ILE 42 Ca -0.07 -0.66 0.08 0.00 -0.00 0.00 0.00 60.65 60.00 2osq s ILE 42 Cb -0.10 -1.14 -0.03 0.00 -0.00 0.00 0.00 42.46 41.20 2osq s ILE 42 CO -0.01 -0.21 -0.21 -0.76 -0.00 0.00 0.00 174.94 173.75 2osq s LEU 43 N 1.80 2.18 -0.69 0.37 1.43 -0.57 -4.97 118.68 118.24 2osq s LEU 43 Ca -0.01 -0.55 -0.26 0.00 -1.03 0.00 0.00 54.13 52.28 2osq s LEU 43 Cb -0.17 -1.00 -0.11 0.00 0.03 0.00 0.00 46.19 44.94 2osq s LEU 43 CO -0.08 0.16 2.37 0.20 0.23 0.00 0.00 176.35 179.23 2osq s ASN 44 N -1.26 4.17 0.00 2.29 -0.87 -1.26 -1.09 114.94 116.93 2osq s ASN 44 Ca 0.08 0.37 0.00 0.00 -1.57 0.00 0.00 52.86 51.74 2osq s ASN 44 Cb -0.09 -2.53 0.00 0.00 -0.02 0.00 0.00 41.25 38.61 2osq s ASN 44 CO 0.02 -3.44 0.00 0.61 -2.57 0.00 0.00 177.10 171.72 2osq n GLY 45 N 6.51 1.29 3.55 0.66 0.00 -1.26 -5.10 105.19 110.84 2osq n GLY 45 Ca 0.42 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.33 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 -0.45 -0.39 0.15 1.61 -0.12 -0.25 -4.04 117.98 114.50 2osq s PHE 46 Ca 0.00 0.57 0.06 0.00 -0.05 0.00 0.00 56.93 57.51 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 -0.42 -0.14 0.00 -0.05 0.00 0.00 175.22 174.61 2osq s ALA 47 N -1.66 1.67 -0.01 1.99 0.00 -0.89 -1.51 121.76 121.36 2osq s ALA 47 Ca -0.01 -1.44 -0.08 0.00 0.00 0.00 0.00 51.96 50.44 2osq s ALA 47 Cb -0.01 -0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.05 2osq s ALA 47 CO -0.00 0.08 0.15 -0.06 0.00 0.00 0.00 175.76 175.93 2osq s PHE 48 N -2.52 -0.01 -0.12 0.00 0.40 0.45 0.21 117.98 116.39 2osq s PHE 48 Ca 0.14 -0.01 -0.04 0.00 -0.60 0.00 0.00 56.93 56.42 2osq s PHE 48 Cb -0.03 -0.02 0.06 0.00 0.51 0.00 0.00 43.02 43.54 2osq s PHE 48 CO 0.04 -0.26 0.23 0.54 0.70 0.00 0.00 175.22 176.47 2osq s VAL 49 N -1.14 -0.35 -0.33 -0.44 0.11 0.45 0.09 120.40 118.80 2osq s VAL 49 Ca -0.12 0.29 -0.07 0.00 -2.93 0.00 0.00 61.98 59.14 2osq s VAL 49 Cb -0.06 -0.40 0.02 0.00 -1.53 0.00 0.00 36.38 34.41 2osq s VAL 49 CO 0.02 0.12 0.11 -0.70 -3.33 0.00 0.00 175.10 171.32 2osq s GLU 50 N 2.29 2.85 0.41 1.54 2.12 -0.22 -0.01 118.70 127.67 2osq s GLU 50 Ca 0.01 -1.03 -0.16 0.00 0.36 0.00 0.00 54.97 54.14 2osq s GLU 50 Cb -0.12 -3.47 -0.09 0.00 0.26 0.00 0.00 34.13 30.71 2osq s GLU 50 CO -0.08 -0.58 0.86 -0.06 -0.54 0.00 0.00 175.26 174.86 2osq s PHE 51 N 1.47 3.39 -2.00 5.30 0.08 -1.26 -0.10 117.98 124.86 2osq s PHE 51 Ca 0.01 1.36 0.30 0.00 0.12 0.00 0.00 56.93 58.72 2osq s PHE 51 Cb -0.18 -2.67 1.80 0.00 -0.57 0.00 0.00 43.02 41.39 2osq s PHE 51 CO 0.03 -0.11 2.13 -1.91 -0.10 0.00 0.00 175.22 175.27 2osq n GLU 52 N -0.89 0.94 -3.71 0.44 2.13 0.45 -4.40 120.64 115.60 2osq n GLU 52 Ca 0.05 0.00 -0.17 0.00 0.66 0.00 0.00 57.16 57.70 2osq n GLU 52 Cb 0.54 -1.50 -0.16 0.00 0.27 0.00 0.00 31.44 30.59 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 -2.00 -0.02 0.27 5.31 2.02 -1.26 -4.97 118.70 118.05 2osq s GLU 53 Ca 0.45 0.36 0.01 0.00 0.02 0.00 0.00 54.97 55.80 2osq s GLU 53 Cb 0.21 -0.33 0.60 0.00 0.10 0.00 0.00 34.13 34.70 2osq s GLU 53 CO 0.35 -0.25 1.75 0.00 0.02 0.00 0.00 175.26 177.13 2osq h ALA 54 N 7.88 1.35 0.14 5.21 0.00 -1.83 -1.52 119.26 130.49 2osq h ALA 54 Ca -0.28 0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.74 2osq h ALA 54 Cb 1.12 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.91 2osq h ALA 54 CO 0.29 -0.14 -0.15 1.49 0.00 0.00 0.00 179.25 180.75 2osq h GLU 55 N 0.59 -0.31 -0.99 0.00 4.81 -1.96 0.19 114.58 116.92 2osq h GLU 55 Ca 0.50 0.02 0.12 0.00 -0.13 0.00 0.00 59.36 59.87 2osq h GLU 55 Cb 0.76 0.07 -0.08 0.00 0.63 0.00 0.00 28.75 30.13 2osq h GLU 55 CO -0.40 -0.20 0.63 0.77 -0.73 0.00 0.00 179.01 179.08 2osq h SER 56 N -0.32 0.91 0.12 1.04 0.02 -1.57 -0.49 113.55 113.26 2osq h SER 56 Ca 0.01 0.05 -0.01 0.00 -0.84 0.00 0.00 61.79 61.00 2osq h SER 56 Cb 0.31 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.71 2osq h SER 56 CO -0.05 0.49 -0.06 0.00 -1.14 0.00 0.00 176.83 176.07 2osq h ALA 57 N 1.54 -0.17 -0.74 3.77 0.00 -0.84 -1.11 119.26 121.71 2osq h ALA 57 Ca 0.49 -0.22 0.16 0.00 0.00 0.00 0.00 54.91 55.34 2osq h ALA 57 Cb 0.49 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 2osq h ALA 57 CO -0.25 -0.35 0.50 0.00 0.00 0.00 0.00 179.25 179.14 2osq h ALA 58 N 0.11 2.23 0.08 0.00 0.00 -0.19 -0.61 119.26 120.88 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 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2osq h ALA 58 CO 0.03 -0.43 -0.04 0.87 0.00 0.00 0.00 179.25 179.68 2osq h LYS 59 N 0.32 -0.10 -0.79 0.00 1.79 -1.05 -3.20 116.57 113.54 2osq h LYS 59 Ca 0.36 0.01 0.20 0.00 -2.18 0.00 0.00 60.65 59.04 2osq h LYS 59 Cb 0.95 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 31.58 2osq h LYS 59 CO -0.10 0.42 0.55 0.00 -1.08 0.00 0.00 179.45 179.24 2osq h ALA 60 N -0.29 2.43 -0.43 3.86 0.00 -0.69 0.39 119.26 124.53 2osq h ALA 60 Ca -0.01 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2osq h ALA 60 Cb 0.57 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 2osq h ALA 60 CO 0.02 -0.66 -0.07 0.82 0.00 0.00 0.00 179.25 179.35 2osq h ILE 61 N 0.21 1.25 0.00 0.00 2.04 -1.18 0.31 117.51 120.13 2osq h ILE 61 Ca 0.39 -1.09 0.00 0.00 1.00 0.00 0.00 64.86 65.16 2osq h ILE 61 Cb 1.22 1.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 2osq h ILE 61 CO -0.08 0.38 -0.65 -0.62 0.00 0.00 0.00 178.15 177.17 2osq n GLU 62 N -4.19 0.03 -0.07 2.37 -0.58 0.43 -3.41 120.64 115.23 2osq n GLU 62 Ca 0.02 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.70 2osq n GLU 62 Cb 0.34 -1.51 -0.02 0.00 -0.57 0.00 0.00 31.44 29.68 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 -1.56 0.40 -0.33 3.49 -0.58 0.11 -4.53 120.64 117.65 2osq n GLU 63 Ca 0.05 0.33 -0.01 0.00 -0.42 0.00 0.00 57.16 57.11 2osq n GLU 63 Cb 0.35 -1.40 0.12 0.00 -0.57 0.00 0.00 31.44 29.94 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 -0.82 1.13 -2.13 2.62 2.07 -0.62 -3.41 116.25 115.09 2osq h VAL 64 Ca 0.00 -0.38 -0.59 0.00 0.82 0.00 0.00 66.70 66.55 2osq h VAL 64 Cb 0.61 -0.07 0.02 0.00 -1.52 0.00 0.00 31.29 30.33 2osq h VAL 64 CO 0.00 0.20 1.13 1.57 0.02 0.00 0.00 177.57 180.49 2osq n HIS 65 N -4.54 2.38 -0.18 1.57 -0.00 -1.22 -0.92 115.22 112.32 2osq n HIS 65 Ca 0.12 -0.10 0.00 0.00 -0.00 0.00 0.00 57.72 57.74 2osq n HIS 65 Cb 0.11 -2.70 0.00 0.00 -0.00 0.00 0.00 29.99 27.40 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 4.41 0.82 2.25 1.57 0.00 -1.11 -4.91 105.19 108.22 2osq n GLY 66 Ca 0.22 0.00 -0.16 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 -2.12 -0.43 -4.53 1.61 5.02 -0.10 -4.80 118.16 112.81 2osq n LYS 67 Ca 0.00 -1.33 -0.25 0.00 -2.02 0.00 0.00 58.31 54.71 2osq n LYS 67 Cb 0.00 -0.66 -0.14 0.00 -0.02 0.00 0.00 35.03 34.22 2osq n LYS 67 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2osq s SER 68 N -3.67 2.56 -0.29 4.39 0.01 -1.26 -0.05 113.70 115.39 2osq s SER 68 Ca 0.42 -0.59 -0.18 0.00 1.31 0.00 0.00 55.95 56.91 2osq s SER 68 Cb -0.01 -0.19 0.16 0.00 0.21 0.00 0.00 66.02 66.19 2osq s SER 68 CO 0.29 0.13 1.09 0.12 0.41 0.00 0.00 173.24 175.28 2osq s PHE 69 N -0.93 -0.40 -1.38 2.43 2.19 -0.06 -4.84 117.98 114.99 2osq s PHE 69 Ca 0.08 0.84 -0.06 0.00 0.33 0.00 0.00 56.93 58.11 2osq s PHE 69 Cb -0.09 0.29 0.01 0.00 -1.31 0.00 0.00 43.02 41.92 2osq s PHE 69 CO 0.03 -0.20 0.83 0.00 1.83 0.00 0.00 175.22 177.71 2osq n ALA 70 N 3.14 -1.06 -2.78 11.12 0.00 -1.26 -1.76 120.51 127.91 2osq n ALA 70 Ca -0.17 0.33 -0.22 0.00 0.00 0.00 0.00 53.44 53.38 2osq n ALA 70 Cb 0.57 -4.42 0.02 0.00 0.00 0.00 0.00 19.45 15.62 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 -2.48 -5.92 -3.74 0.00 3.02 -1.26 -4.97 115.26 99.91 2osq n ASN 71 Ca -0.05 -0.18 -0.14 0.00 -0.03 0.00 0.00 54.58 54.18 2osq n ASN 71 Cb 0.59 -4.84 -0.09 0.00 -0.61 0.00 0.00 39.78 34.83 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 -5.45 0.66 -0.01 3.52 -0.21 -0.72 -5.14 119.66 112.30 2osq s GLN 72 Ca 0.19 0.00 -0.30 0.00 0.02 0.00 0.00 55.36 55.26 2osq s GLN 72 Cb -0.08 0.30 -0.06 0.00 1.00 0.00 0.00 33.01 34.17 2osq s GLN 72 CO 0.23 -0.17 1.46 -1.25 -2.12 0.00 0.00 175.29 173.44 2osq s PRO 73 N -0.99 4.25 0.66 2.91 0.04 -1.26 -0.88 135.00 139.73 2osq s PRO 73 Ca -0.10 2.02 -0.11 0.00 0.04 0.00 0.00 61.00 62.85 2osq s PRO 73 Cb -0.04 -3.65 -0.01 0.00 0.04 0.00 0.00 34.50 30.84 2osq s PRO 73 CO 0.04 -0.64 1.06 -0.51 0.04 0.00 0.00 177.00 176.98 2osq s LEU 74 N 2.73 3.06 -0.18 -3.56 1.43 0.93 -4.92 118.68 118.17 2osq s LEU 74 Ca 0.66 1.22 -0.09 0.00 -1.03 0.00 0.00 54.13 54.89 2osq s LEU 74 Cb -0.32 -4.12 0.06 0.00 0.03 0.00 0.00 46.19 41.85 2osq s LEU 74 CO 0.27 -1.13 0.41 -0.70 0.23 0.00 0.00 176.35 175.43 2osq s GLU 75 N -5.26 0.38 -0.00 1.70 2.12 -1.26 -2.75 118.70 113.62 2osq s GLU 75 Ca 0.57 0.84 0.01 0.00 0.36 0.00 0.00 54.97 56.75 2osq s GLU 75 Cb -0.11 0.04 -0.00 0.00 0.26 0.00 0.00 34.13 34.32 2osq s GLU 75 CO 0.52 -0.18 -0.04 0.08 -0.54 0.00 0.00 175.26 175.11 2osq s VAL 76 N 1.64 0.31 0.24 3.70 1.01 -1.26 -1.89 120.40 124.15 2osq s VAL 76 Ca -0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 61.98 61.70 2osq s VAL 76 Cb -0.09 -0.27 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 2osq s VAL 76 CO -0.13 0.09 0.27 0.68 0.00 0.00 0.00 175.10 176.01 2osq s VAL 77 N -0.09 0.00 -0.59 2.92 -7.23 -0.56 -4.56 120.40 110.29 2osq s VAL 77 Ca 0.01 -1.81 -0.27 0.00 -1.81 0.00 0.00 61.98 58.11 2osq s VAL 77 Cb -0.02 -2.43 -0.02 0.00 0.56 0.00 0.00 36.38 34.47 2osq s VAL 77 CO -0.00 0.00 1.84 -0.31 -0.31 0.00 0.00 175.10 176.31 2osq s TYR 78 N -3.96 1.70 0.09 2.82 2.02 -1.26 0.32 117.35 119.08 2osq s TYR 78 Ca 0.34 0.76 -0.32 0.00 -0.37 0.00 0.00 57.07 57.48 2osq s TYR 78 Cb 0.04 -4.11 -0.11 0.00 -0.40 0.00 0.00 41.96 37.38 2osq s TYR 78 CO 0.13 -2.34 1.82 0.45 -1.57 0.00 0.00 175.55 174.04 2osq n SER 79 N 12.43 3.83 0.00 2.29 2.88 0.91 -4.63 113.62 131.33 2osq n SER 79 Ca 0.20 0.99 0.00 0.00 -1.33 0.00 0.00 58.87 58.73 2osq n SER 79 Cb 0.52 -1.50 0.00 0.00 -0.75 0.00 0.00 64.21 62.47 2osq n SER 79 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10