#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 2.25 0.49 -1.84 0.05 -1.26 -4.65 118.68 113.71 2osq s LEU 8 Ca 0.00 0.62 0.06 0.00 0.05 0.00 0.00 54.13 54.85 2osq s LEU 8 Cb 0.00 -2.81 -0.00 0.00 -2.05 0.00 0.00 46.19 41.33 2osq s LEU 8 CO 0.00 -2.63 0.28 -0.44 -0.55 0.00 0.00 176.35 173.01 2osq s SER 9 N -4.48 4.55 -0.06 1.48 0.01 -1.25 -4.98 113.70 108.96 2osq s SER 9 Ca 0.68 -1.20 -0.04 0.00 1.31 0.00 0.00 55.95 56.70 2osq s SER 9 Cb -0.09 0.06 -0.27 0.00 0.21 0.00 0.00 66.02 65.92 2osq s SER 9 CO 0.52 -0.85 0.61 -0.55 0.41 0.00 0.00 173.24 173.38 2osq h ASN 10 N 1.06 0.40 -2.30 2.44 -1.07 -1.98 -3.44 115.58 110.70 2osq h ASN 10 Ca -0.40 -0.71 -0.48 0.00 0.07 0.00 0.00 56.30 54.77 2osq h ASN 10 Cb 1.29 -0.13 -0.35 0.00 -2.07 0.00 0.00 38.32 37.05 2osq h ASN 10 CO 0.63 1.62 -0.77 0.42 0.07 0.00 0.00 177.43 179.40 2osq s THR 11 N -2.58 -0.08 0.00 6.14 -4.23 -1.26 -4.11 115.64 109.51 2osq s THR 11 Ca -0.15 -1.36 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 2osq s THR 11 Cb 0.07 -0.91 0.00 0.00 1.34 0.00 0.00 72.50 73.00 2osq s THR 11 CO 0.82 -0.80 0.00 -1.14 -0.54 0.00 0.00 174.62 172.96 2osq n ARG 12 N 4.16 0.00 -4.47 3.99 0.63 -1.26 -4.42 116.66 115.29 2osq n ARG 12 Ca 0.11 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.73 2osq n ARG 12 Cb 0.41 0.00 -0.16 0.00 0.45 0.00 0.00 32.46 33.15 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 1.94 -0.24 6.15 1.43 0.68 -0.09 118.68 128.56 2osq s LEU 13 Ca 0.00 -0.54 -0.17 0.00 -1.03 0.00 0.00 54.13 52.39 2osq s LEU 13 Cb 0.00 -1.31 -0.03 0.00 0.03 0.00 0.00 46.19 44.88 2osq s LEU 13 CO 0.00 0.04 0.46 0.12 0.23 0.00 0.00 176.35 177.20 2osq s PHE 14 N 1.00 3.31 0.34 0.29 5.36 0.15 -0.63 117.98 127.80 2osq s PHE 14 Ca -0.04 0.62 0.07 0.00 -0.96 0.00 0.00 56.93 56.61 2osq s PHE 14 Cb -0.15 -2.64 -0.02 0.00 -0.34 0.00 0.00 43.02 39.87 2osq s PHE 14 CO -0.04 -0.18 0.39 0.08 -1.46 0.00 0.00 175.22 174.01 2osq s VAL 15 N 1.92 3.76 0.83 3.12 1.01 0.15 -1.45 120.40 129.75 2osq s VAL 15 Ca 0.20 -1.17 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 2osq s VAL 15 Cb -0.15 -3.29 0.09 0.00 0.00 0.00 0.00 36.38 33.03 2osq s VAL 15 CO 0.09 -0.15 1.11 -0.13 0.00 0.00 0.00 175.10 176.01 2osq s ARG 16 N -4.10 1.84 -0.03 2.72 1.81 -0.82 -2.26 118.95 118.11 2osq s ARG 16 Ca 0.44 0.55 -0.30 0.00 -1.72 0.00 0.00 55.73 54.70 2osq s ARG 16 Cb -0.08 -1.90 -0.05 0.00 -0.45 0.00 0.00 34.95 32.47 2osq s ARG 16 CO 0.29 -1.77 1.47 -1.25 -0.68 0.00 0.00 175.30 173.36 2osq s PRO 17 N -5.18 4.24 0.33 3.54 0.04 -1.26 -4.10 135.00 132.61 2osq s PRO 17 Ca 0.62 2.01 -0.02 0.00 0.04 0.00 0.00 61.00 63.65 2osq s PRO 17 Cb -0.15 -3.71 -0.04 0.00 0.04 0.00 0.00 34.50 30.65 2osq s PRO 17 CO 0.54 -0.68 0.56 -0.06 0.04 0.00 0.00 177.00 177.40 2osq s PHE 18 N 3.00 3.50 0.00 0.56 0.40 -1.26 -4.95 117.98 119.22 2osq s PHE 18 Ca 0.66 0.50 0.00 0.00 -0.60 0.00 0.00 56.93 57.49 2osq s PHE 18 Cb -0.31 -2.01 0.00 0.00 0.51 0.00 0.00 43.02 41.21 2osq s PHE 18 CO 0.26 0.12 0.00 -0.35 0.70 0.00 0.00 175.22 175.95 2osq n PRO 19 N -1.43 0.75 0.30 0.24 -0.04 -1.26 -4.54 135.00 129.02 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 0.78 0.00 -0.04 0.00 0.00 33.50 34.79 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 -2.17 1.53 -0.00 -2.03 0.38 115.31 113.02 2osq h LEU 20 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.88 57.83 2osq h LEU 20 Cb 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.63 2osq h LEU 20 CO 0.00 0.00 0.07 0.47 -0.00 0.00 0.00 178.44 178.98 2osq n ASP 21 N -2.98 2.90 -4.56 0.17 8.00 -1.26 -4.82 116.55 114.01 2osq n ASP 21 Ca -0.01 -2.41 -0.38 0.00 0.71 0.00 0.00 54.79 52.69 2osq n ASP 21 Cb 0.43 -0.59 -0.03 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.52 3.72 0.22 2.53 0.11 0.13 -4.81 120.40 120.77 2osq s VAL 22 Ca 0.20 -0.22 -0.09 0.00 -2.93 0.00 0.00 61.98 58.95 2osq s VAL 22 Cb 0.16 -4.72 -0.01 0.00 -1.53 0.00 0.00 36.38 30.27 2osq s VAL 22 CO 0.05 -1.64 0.34 0.00 -3.33 0.00 0.00 175.10 170.53 2osq s GLN 23 N 5.77 1.37 0.52 1.54 -2.07 -1.26 -4.90 119.66 120.63 2osq s GLN 23 Ca 0.49 -1.34 0.30 0.00 -1.82 0.00 0.00 55.36 52.99 2osq s GLN 23 Cb -0.05 0.40 1.34 0.00 -1.09 0.00 0.00 33.01 33.61 2osq s GLN 23 CO 0.03 -0.53 1.99 1.05 -1.32 0.00 0.00 175.29 176.51 2osq h GLU 24 N 2.41 0.00 -0.28 9.60 4.11 -1.94 -3.11 114.58 125.37 2osq h GLU 24 Ca -0.30 0.00 0.06 0.00 0.07 0.00 0.00 59.36 59.19 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 0.10 -0.12 1.03 0.07 0.00 0.00 179.01 180.52 2osq h SER 25 N 0.00 -0.42 -0.25 3.06 0.87 -1.96 0.33 113.55 115.18 2osq h SER 25 Ca -0.00 0.10 -0.15 0.00 -1.23 0.00 0.00 61.79 60.52 2osq h SER 25 Cb 0.50 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.68 2osq h SER 25 CO 0.01 -0.16 -0.37 1.05 -0.53 0.00 0.00 176.83 176.83 2osq h GLU 26 N -0.08 0.79 -0.65 2.24 4.11 -1.86 -1.63 114.58 117.50 2osq h GLU 26 Ca 0.15 -0.40 -0.03 0.00 0.07 0.00 0.00 59.36 59.14 2osq h GLU 26 Cb 0.30 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.52 2osq h GLU 26 CO -0.33 1.03 0.28 -0.07 0.07 0.00 0.00 179.01 179.99 2osq h LEU 27 N 0.65 0.86 -0.07 3.06 3.38 -1.36 0.20 115.31 122.04 2osq h LEU 27 Ca 0.06 -0.11 -0.20 0.00 0.09 0.00 0.00 57.88 57.72 2osq h LEU 27 Cb 0.93 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 41.47 2osq h LEU 27 CO 0.09 0.76 -0.74 0.78 0.09 0.00 0.00 178.44 179.42 2osq h ASN 28 N 0.94 0.77 1.19 -0.43 2.35 -0.26 0.36 115.58 120.49 2osq h ASN 28 Ca 0.22 -0.69 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 2osq h ASN 28 Cb 0.15 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.29 2osq h ASN 28 CO -0.02 1.34 0.00 -0.33 -1.65 0.00 0.00 177.43 176.77 2osq h GLU 29 N 0.26 0.00 0.00 0.81 5.08 -1.06 0.39 114.58 120.05 2osq h GLU 29 Ca -0.07 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.16 2osq h GLU 29 Cb 1.40 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.63 2osq h GLU 29 CO 0.15 0.00 -1.23 -0.89 -1.00 0.00 0.00 179.01 176.04 2osq n ILE 30 N -2.93 1.49 1.83 3.13 5.41 0.70 -4.41 119.36 124.58 2osq n ILE 30 Ca 0.02 0.03 0.15 0.00 1.00 0.00 0.00 62.75 63.95 2osq n ILE 30 Cb 0.34 -2.23 0.83 0.00 -0.71 0.00 0.00 39.64 37.88 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 -4.45 0.00 0.36 1.39 3.01 0.12 -4.13 117.46 113.76 2osq n PHE 31 Ca -0.23 0.00 -0.19 0.00 1.01 0.00 0.00 57.45 58.05 2osq n PHE 31 Cb 0.55 -0.03 -0.10 0.00 -0.01 0.00 0.00 39.48 39.89 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 4.97 -1.30 -5.52 1.37 0.00 -0.31 -3.21 103.07 99.07 2osq h GLY 32 Ca 0.00 0.57 -0.33 0.00 0.00 0.00 0.00 47.33 47.57 2osq h GLY 32 CO 0.00 -0.41 2.40 -1.55 0.00 0.00 0.00 176.54 176.98 2osq n PRO 33 N -5.50 1.81 0.00 4.80 -0.04 -1.26 -3.05 135.00 131.76 2osq n PRO 33 Ca -0.13 -1.33 0.00 0.00 -0.04 0.00 0.00 63.50 62.00 2osq n PRO 33 Cb 0.47 -2.39 0.00 0.00 -0.04 0.00 0.00 33.50 31.54 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 4.33 -0.37 0.00 0.54 3.72 -1.21 -5.09 117.46 119.38 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 0.11 0.15 0.00 0.00 -0.94 0.00 0.00 39.48 38.81 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 0.03 -0.36 3.56 1.37 0.00 -1.17 -4.74 105.19 103.88 2osq n GLY 35 Ca 0.00 -1.19 -0.40 0.00 0.00 0.00 0.00 46.02 44.43 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 2.84 -0.23 1.61 0.04 -1.26 -4.85 135.00 131.15 2osq s PRO 36 Ca 0.00 0.81 -0.29 0.00 0.04 0.00 0.00 61.00 61.57 2osq s PRO 36 Cb 0.00 -4.32 -0.03 0.00 0.04 0.00 0.00 34.50 30.19 2osq s PRO 36 CO 0.00 -2.46 1.76 -1.64 0.04 0.00 0.00 177.00 174.70 2osq s MET 37 N 6.60 3.62 0.37 4.56 -1.94 -1.26 -0.03 119.30 131.22 2osq s MET 37 Ca 0.70 1.71 0.10 0.00 -1.71 0.00 0.00 55.69 56.49 2osq s MET 37 Cb -0.15 -4.13 0.74 0.00 2.01 0.00 0.00 34.83 33.30 2osq s MET 37 CO 0.24 -1.52 1.86 -0.22 -0.01 0.00 0.00 175.02 175.38 2osq h LYS 38 N 11.80 0.14 -2.48 2.03 3.64 -0.55 -3.44 116.57 127.73 2osq h LYS 38 Ca -0.36 -0.04 0.09 0.00 -1.27 0.00 0.00 60.65 59.07 2osq h LYS 38 Cb 1.17 -0.01 -0.13 0.00 -0.41 0.00 0.00 32.23 32.85 2osq h LYS 38 CO 1.00 0.39 0.42 -2.00 -2.27 0.00 0.00 179.45 176.99 2osq s GLU 39 N -4.47 1.02 -0.03 1.90 2.56 0.72 -4.96 118.70 115.45 2osq s GLU 39 Ca -0.04 -0.42 -0.07 0.00 0.00 0.00 0.00 54.97 54.43 2osq s GLU 39 Cb 0.15 0.44 0.01 0.00 2.00 0.00 0.00 34.13 36.73 2osq s GLU 39 CO 0.73 -0.45 0.16 0.14 -0.56 0.00 0.00 175.26 175.28 2osq s VAL 40 N -3.32 0.05 -0.02 3.70 -7.23 -1.26 -1.01 120.40 111.31 2osq s VAL 40 Ca 0.06 -0.40 -0.00 0.00 -1.81 0.00 0.00 61.98 59.82 2osq s VAL 40 Cb -0.01 -0.37 0.03 0.00 0.56 0.00 0.00 36.38 36.59 2osq s VAL 40 CO -0.07 -0.22 0.04 -0.54 -0.31 0.00 0.00 175.10 174.00 2osq s LYS 41 N -0.78 -0.02 -0.21 4.82 3.01 0.17 -4.99 119.74 121.74 2osq s LYS 41 Ca -0.09 0.19 -0.03 0.00 -1.01 0.00 0.00 55.97 55.04 2osq s LYS 41 Cb -0.05 -0.22 0.07 0.00 -1.01 0.00 0.00 37.83 36.62 2osq s LYS 41 CO 0.01 -0.15 0.05 0.96 0.51 0.00 0.00 175.35 176.73 2osq s ILE 42 N 0.98 0.50 0.08 2.17 -0.00 -1.26 -0.61 121.20 123.07 2osq s ILE 42 Ca -0.08 -0.63 0.08 0.00 -0.00 0.00 0.00 60.65 60.02 2osq s ILE 42 Cb -0.12 -1.07 -0.03 0.00 -0.00 0.00 0.00 42.46 41.24 2osq s ILE 42 CO -0.03 -0.28 -0.22 -0.76 -0.00 0.00 0.00 174.94 173.65 2osq s LEU 43 N 1.86 2.25 -0.88 0.37 1.43 -0.66 -4.95 118.68 118.11 2osq s LEU 43 Ca 0.01 -0.64 -0.25 0.00 -1.03 0.00 0.00 54.13 52.22 2osq s LEU 43 Cb -0.17 -0.97 -0.11 0.00 0.03 0.00 0.00 46.19 44.97 2osq s LEU 43 CO -0.11 0.11 2.19 0.21 0.23 0.00 0.00 176.35 178.99 2osq s ASN 44 N -1.66 4.35 0.00 2.29 3.04 -1.26 -1.42 114.94 120.28 2osq s ASN 44 Ca 0.08 -0.39 0.00 0.00 0.04 0.00 0.00 52.86 52.59 2osq s ASN 44 Cb -0.10 -2.56 0.00 0.00 -1.54 0.00 0.00 41.25 37.05 2osq s ASN 44 CO 0.04 -3.52 0.00 0.61 -3.04 0.00 0.00 177.10 171.19 2osq n GLY 45 N 6.72 1.00 3.57 1.21 0.00 -1.26 -5.08 105.19 111.35 2osq n GLY 45 Ca 0.44 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.36 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 0.00 -0.36 0.10 1.61 -0.12 -0.51 -4.14 117.98 114.56 2osq s PHE 46 Ca 0.00 0.58 0.07 0.00 -0.05 0.00 0.00 56.93 57.53 2osq s PHE 46 Cb 0.00 0.46 -0.03 0.00 -0.63 0.00 0.00 43.02 42.81 2osq s PHE 46 CO 0.00 -0.35 -0.17 0.00 -0.05 0.00 0.00 175.22 174.65 2osq s ALA 47 N -1.27 1.55 -0.01 1.99 0.00 -0.96 -1.65 121.76 121.41 2osq s ALA 47 Ca -0.01 -1.18 -0.02 0.00 0.00 0.00 0.00 51.96 50.76 2osq s ALA 47 Cb -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 22.95 2osq s ALA 47 CO 0.01 0.25 0.04 -0.06 0.00 0.00 0.00 175.76 176.00 2osq s PHE 48 N -1.38 -0.01 -0.05 0.00 0.40 0.22 0.33 117.98 117.49 2osq s PHE 48 Ca 0.04 0.03 -0.02 0.00 -0.60 0.00 0.00 56.93 56.39 2osq s PHE 48 Cb -0.09 -0.01 0.03 0.00 0.51 0.00 0.00 43.02 43.46 2osq s PHE 48 CO 0.04 -0.06 0.05 0.54 0.70 0.00 0.00 175.22 176.49 2osq s VAL 49 N -0.22 -0.05 -0.36 -0.44 0.11 0.20 0.45 120.40 120.09 2osq s VAL 49 Ca -0.03 0.37 -0.09 0.00 -2.93 0.00 0.00 61.98 59.30 2osq s VAL 49 Cb -0.02 -0.21 0.03 0.00 -1.53 0.00 0.00 36.38 34.65 2osq s VAL 49 CO 0.00 0.17 0.16 -0.70 -3.33 0.00 0.00 175.10 171.40 2osq s GLU 50 N 2.15 2.77 0.47 1.54 2.12 -0.18 -0.23 118.70 127.33 2osq s GLU 50 Ca 0.05 -1.10 -0.19 0.00 0.36 0.00 0.00 54.97 54.09 2osq s GLU 50 Cb -0.12 -3.61 -0.09 0.00 0.26 0.00 0.00 34.13 30.57 2osq s GLU 50 CO -0.04 -0.67 0.96 -0.06 -0.54 0.00 0.00 175.26 174.92 2osq s PHE 51 N 1.49 3.38 -2.00 5.30 0.08 -1.26 0.08 117.98 125.06 2osq s PHE 51 Ca 0.01 1.53 0.30 0.00 0.12 0.00 0.00 56.93 58.88 2osq s PHE 51 Cb -0.19 -2.81 1.78 0.00 -0.57 0.00 0.00 43.02 41.23 2osq s PHE 51 CO 0.05 -0.23 2.12 -1.91 -0.10 0.00 0.00 175.22 175.15 2osq n GLU 52 N -1.09 0.95 -3.72 0.44 2.13 0.95 -4.34 120.64 115.96 2osq n GLU 52 Ca 0.07 0.00 -0.15 0.00 0.66 0.00 0.00 57.16 57.73 2osq n GLU 52 Cb 0.54 -1.49 -0.15 0.00 0.27 0.00 0.00 31.44 30.60 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 0.04 0.25 5.31 0.41 -1.26 -4.96 118.70 116.48 2osq s GLU 53 Ca 0.45 0.41 -0.04 0.00 -0.41 0.00 0.00 54.97 55.38 2osq s GLU 53 Cb 0.21 -0.25 0.46 0.00 -1.78 0.00 0.00 34.13 32.77 2osq s GLU 53 CO 0.35 -0.23 1.73 0.00 -0.49 0.00 0.00 175.26 176.62 2osq h ALA 54 N 7.73 1.06 -0.05 5.21 0.00 -1.83 -1.56 119.26 129.81 2osq h ALA 54 Ca -0.31 0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.75 2osq h ALA 54 Cb 1.13 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 2osq h ALA 54 CO 0.31 -0.22 -0.16 1.49 0.00 0.00 0.00 179.25 180.68 2osq h GLU 55 N 0.44 -0.23 -0.63 0.00 4.81 -1.96 0.17 114.58 117.18 2osq h GLU 55 Ca 0.42 0.02 0.08 0.00 -0.13 0.00 0.00 59.36 59.74 2osq h GLU 55 Cb 0.64 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.00 2osq h GLU 55 CO -0.41 -0.15 0.28 1.03 -0.73 0.00 0.00 179.01 179.03 2osq h SER 56 N -0.24 0.35 0.30 1.04 0.87 -1.61 -0.42 113.55 113.84 2osq h SER 56 Ca 0.07 0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 2osq h SER 56 Cb 0.33 0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.31 2osq h SER 56 CO -0.19 0.21 -0.14 0.00 -0.53 0.00 0.00 176.83 176.18 2osq h ALA 57 N 1.39 -0.40 -0.70 6.23 0.00 -0.80 0.43 119.26 125.40 2osq h ALA 57 Ca 0.30 -0.15 0.17 0.00 0.00 0.00 0.00 54.91 55.23 2osq h ALA 57 Cb 0.32 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 2osq h ALA 57 CO -0.26 -0.63 0.48 0.00 0.00 0.00 0.00 179.25 178.84 2osq h ALA 58 N 0.04 2.33 0.07 0.00 0.00 -0.33 -0.78 119.26 120.60 2osq h ALA 58 Ca -0.04 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2osq h ALA 58 Cb 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2osq h ALA 58 CO 0.07 -0.53 -0.03 0.87 0.00 0.00 0.00 179.25 179.62 2osq h LYS 59 N 0.22 -0.09 -0.86 0.00 1.79 -0.82 -3.21 116.57 113.60 2osq h LYS 59 Ca 0.34 0.01 0.21 0.00 -2.18 0.00 0.00 60.65 59.03 2osq h LYS 59 Cb 1.02 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 31.64 2osq h LYS 59 CO -0.07 0.42 0.59 0.00 -1.08 0.00 0.00 179.45 179.31 2osq h ALA 60 N -0.36 2.42 -0.66 3.86 0.00 -0.40 0.40 119.26 124.52 2osq h ALA 60 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2osq h ALA 60 Cb 0.55 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 2osq h ALA 60 CO 0.02 -0.68 0.13 0.82 0.00 0.00 0.00 179.25 179.54 2osq h ILE 61 N 0.25 1.26 0.00 0.00 2.04 -1.22 0.30 117.51 120.13 2osq h ILE 61 Ca 0.44 -0.99 0.00 0.00 1.00 0.00 0.00 64.86 65.31 2osq h ILE 61 Cb 1.31 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.99 2osq h ILE 61 CO -0.11 0.37 -0.62 -0.62 0.00 0.00 0.00 178.15 177.18 2osq n GLU 62 N -4.23 0.23 -0.03 2.37 1.02 0.35 -3.35 120.64 117.01 2osq n GLU 62 Ca 0.05 0.06 -0.02 0.00 -0.02 0.00 0.00 57.16 57.23 2osq n GLU 62 Cb 0.27 -1.64 -0.01 0.00 -0.02 0.00 0.00 31.44 30.05 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 -1.97 0.16 -0.35 3.49 -0.58 0.11 -4.46 120.64 117.04 2osq n GLU 63 Ca 0.04 0.31 0.10 0.00 -0.42 0.00 0.00 57.16 57.19 2osq n GLU 63 Cb 0.42 -1.05 0.28 0.00 -0.57 0.00 0.00 31.44 30.51 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 -0.35 0.79 -2.09 2.62 2.07 -0.63 -3.41 116.25 115.25 2osq h VAL 64 Ca 0.00 -0.29 -0.59 0.00 0.82 0.00 0.00 66.70 66.64 2osq h VAL 64 Cb 0.20 -0.12 0.02 0.00 -1.52 0.00 0.00 31.29 29.86 2osq h VAL 64 CO 0.00 0.15 1.17 1.57 0.02 0.00 0.00 177.57 180.49 2osq n HIS 65 N -4.72 2.35 -0.06 1.57 -0.00 -1.21 -0.97 115.22 112.17 2osq n HIS 65 Ca 0.21 -0.12 0.00 0.00 -0.00 0.00 0.00 57.72 57.81 2osq n HIS 65 Cb 0.47 -2.71 0.00 0.00 -0.00 0.00 0.00 29.99 27.75 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 4.59 0.84 2.59 1.57 0.00 -0.93 -4.92 105.19 108.93 2osq n GLY 66 Ca 0.23 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.40 -4.56 1.61 5.02 -0.14 -4.81 118.16 112.83 2osq n LYS 67 Ca 0.00 -1.58 -0.26 0.00 -2.02 0.00 0.00 58.31 54.45 2osq n LYS 67 Cb 0.00 -0.70 -0.14 0.00 -0.02 0.00 0.00 35.03 34.18 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 -4.00 2.65 -0.29 4.39 0.01 -1.26 -0.16 113.70 115.03 2osq s SER 68 Ca 0.48 -0.59 -0.19 0.00 1.31 0.00 0.00 55.95 56.95 2osq s SER 68 Cb -0.02 -0.20 0.16 0.00 0.21 0.00 0.00 66.02 66.17 2osq s SER 68 CO 0.33 0.15 1.10 0.12 0.41 0.00 0.00 173.24 175.34 2osq s PHE 69 N -0.92 -0.39 -1.50 2.43 2.19 -0.15 -4.85 117.98 114.81 2osq s PHE 69 Ca 0.08 0.82 -0.06 0.00 0.33 0.00 0.00 56.93 58.10 2osq s PHE 69 Cb -0.09 0.31 0.01 0.00 -1.31 0.00 0.00 43.02 41.93 2osq s PHE 69 CO 0.03 -0.19 0.80 0.00 1.83 0.00 0.00 175.22 177.69 2osq n ALA 70 N 3.00 -1.08 -3.01 11.12 0.00 -1.26 -1.65 120.51 127.63 2osq n ALA 70 Ca -0.16 0.33 -0.22 0.00 0.00 0.00 0.00 53.44 53.39 2osq n ALA 70 Cb 0.57 -4.46 0.03 0.00 0.00 0.00 0.00 19.45 15.59 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 -2.68 -6.03 -3.70 0.00 3.02 -1.26 -4.98 115.26 99.63 2osq n ASN 71 Ca -0.07 -0.28 -0.14 0.00 -0.03 0.00 0.00 54.58 54.05 2osq n ASN 71 Cb 0.60 -4.88 -0.08 0.00 -0.61 0.00 0.00 39.78 34.81 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 -5.69 0.76 0.02 3.52 -0.21 -0.66 -5.14 119.66 112.25 2osq s GLN 72 Ca 0.30 -0.02 -0.30 0.00 0.02 0.00 0.00 55.36 55.35 2osq s GLN 72 Cb -0.13 0.35 -0.06 0.00 1.00 0.00 0.00 33.01 34.16 2osq s GLN 72 CO 0.37 -0.21 1.44 -1.25 -2.12 0.00 0.00 175.29 173.51 2osq s PRO 73 N -1.18 4.27 0.42 2.91 0.04 -1.26 -0.97 135.00 139.23 2osq s PRO 73 Ca -0.12 2.03 -0.15 0.00 0.04 0.00 0.00 61.00 62.80 2osq s PRO 73 Cb -0.04 -3.56 -0.08 0.00 0.04 0.00 0.00 34.50 30.87 2osq s PRO 73 CO 0.05 -0.59 0.86 -0.51 0.04 0.00 0.00 177.00 176.85 2osq s LEU 74 N 2.35 3.83 -0.09 -3.56 1.43 0.78 -4.92 118.68 118.50 2osq s LEU 74 Ca 0.65 1.38 -0.04 0.00 -1.03 0.00 0.00 54.13 55.09 2osq s LEU 74 Cb -0.33 -4.26 0.05 0.00 0.03 0.00 0.00 46.19 41.68 2osq s LEU 74 CO 0.28 -0.41 0.20 -1.61 0.23 0.00 0.00 176.35 175.03 2osq s GLU 75 N -3.63 0.13 -0.01 1.70 2.02 -1.26 -2.20 118.70 115.45 2osq s GLU 75 Ca 0.56 0.49 0.02 0.00 0.02 0.00 0.00 54.97 56.06 2osq s GLU 75 Cb -0.10 -0.16 -0.00 0.00 0.10 0.00 0.00 34.13 33.97 2osq s GLU 75 CO 0.26 -0.20 -0.07 0.08 0.02 0.00 0.00 175.26 175.35 2osq s VAL 76 N 1.49 0.57 0.22 2.63 1.01 -1.26 -1.95 120.40 123.12 2osq s VAL 76 Ca -0.06 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 2osq s VAL 76 Cb -0.11 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.74 2osq s VAL 76 CO -0.07 0.17 0.17 0.68 0.00 0.00 0.00 175.10 176.05 2osq s VAL 77 N -0.05 0.00 -0.60 2.92 -7.23 -0.53 -4.62 120.40 110.30 2osq s VAL 77 Ca 0.01 -1.96 -0.27 0.00 -1.81 0.00 0.00 61.98 57.95 2osq s VAL 77 Cb -0.04 -2.49 -0.02 0.00 0.56 0.00 0.00 36.38 34.39 2osq s VAL 77 CO -0.00 0.00 1.81 -0.31 -0.31 0.00 0.00 175.10 176.29 2osq s TYR 78 N -4.04 1.72 0.14 2.82 2.02 -1.26 0.33 117.35 119.08 2osq s TYR 78 Ca 0.38 0.73 -0.31 0.00 -0.37 0.00 0.00 57.07 57.50 2osq s TYR 78 Cb 0.06 -4.13 -0.11 0.00 -0.40 0.00 0.00 41.96 37.38 2osq s TYR 78 CO 0.14 -2.32 1.82 0.45 -1.57 0.00 0.00 175.55 174.07 2osq n SER 79 N 12.34 4.03 0.00 2.29 2.88 0.87 -4.63 113.62 131.40 2osq n SER 79 Ca 0.19 1.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.74 2osq n SER 79 Cb 0.52 -1.55 0.00 0.00 -0.75 0.00 0.00 64.21 62.42 2osq n SER 79 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10