#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oyj n GLU 4 N 0.00 0.00 0.00 5.31 1.02 -1.26 -5.00 120.64 120.71 1oyj n GLU 4 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1oyj n GLU 4 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1oyj n GLU 4 CO 0.00 0.00 0.00 1.17 1.18 0.00 0.00 177.13 179.48 1oyj n LYS 5 N 0.00 0.00 -3.56 3.49 4.81 -1.26 -4.87 118.16 116.77 1oyj n LYS 5 Ca 0.00 0.00 -0.21 0.00 -0.87 0.00 0.00 58.31 57.23 1oyj n LYS 5 Cb 0.00 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.07 1oyj n LYS 5 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1oyj n GLU 6 N 0.00 -1.32 -5.15 1.64 4.07 -1.26 -4.54 120.64 114.08 1oyj n GLU 6 Ca 0.00 0.83 -0.32 0.00 -0.06 0.00 0.00 57.16 57.61 1oyj n GLU 6 Cb 0.00 -3.88 -0.16 0.00 -0.06 0.00 0.00 31.44 27.34 1oyj n GLU 6 CO 0.00 0.00 0.00 -0.51 -0.06 0.00 0.00 177.13 176.56 1oyj s LEU 7 N -5.30 2.21 -0.04 4.31 1.43 -1.26 -0.62 118.68 119.41 1oyj s LEU 7 Ca 0.18 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 1oyj s LEU 7 Cb -0.07 -1.44 0.01 0.00 0.03 0.00 0.00 46.19 44.72 1oyj s LEU 7 CO 0.85 0.18 -0.11 -0.69 0.23 0.00 0.00 176.35 176.81 1oyj s VAL 8 N 0.21 0.99 -0.18 -1.59 1.01 0.30 -1.22 120.40 119.92 1oyj s VAL 8 Ca -0.14 -0.45 -0.00 0.00 0.00 0.00 0.00 61.98 61.39 1oyj s VAL 8 Cb -0.17 -0.88 0.01 0.00 0.00 0.00 0.00 36.38 35.34 1oyj s VAL 8 CO 0.07 0.31 -0.15 -0.22 0.00 0.00 0.00 175.10 175.11 1oyj s LEU 9 N 0.33 2.41 -0.23 3.92 2.96 0.18 -0.13 118.68 128.12 1oyj s LEU 9 Ca -0.07 -0.54 -0.17 0.00 -0.22 0.00 0.00 54.13 53.13 1oyj s LEU 9 Cb -0.11 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 44.98 1oyj s LEU 9 CO 0.02 0.02 0.47 -0.76 -1.32 0.00 0.00 176.35 174.78 1oyj s LEU 10 N 1.20 4.10 0.35 -0.68 1.43 0.26 -0.00 118.68 125.34 1oyj s LEU 10 Ca 0.02 0.54 -0.11 0.00 -1.03 0.00 0.00 54.13 53.56 1oyj s LEU 10 Cb -0.14 -2.62 0.03 0.00 0.03 0.00 0.00 46.19 43.49 1oyj s LEU 10 CO -0.07 -0.19 0.63 -0.62 0.23 0.00 0.00 176.35 176.33 1oyj s ASP 11 N 1.31 0.34 -0.03 2.29 -1.08 -0.53 -2.17 116.67 116.79 1oyj s ASP 11 Ca 0.21 -1.22 0.01 0.00 -0.52 0.00 0.00 52.55 51.03 1oyj s ASP 11 Cb -0.15 0.74 0.02 0.00 -1.46 0.00 0.00 42.92 42.07 1oyj s ASP 11 CO 0.09 -1.46 -0.04 0.12 0.52 0.00 0.00 175.17 174.41 1oyj s PHE 12 N -2.88 0.60 0.25 -5.34 5.36 -1.26 -0.10 117.98 114.60 1oyj s PHE 12 Ca 0.22 -0.13 -0.04 0.00 -0.96 0.00 0.00 56.93 56.02 1oyj s PHE 12 Cb -0.03 -0.54 0.46 0.00 -0.34 0.00 0.00 43.02 42.56 1oyj s PHE 12 CO 0.14 -0.14 1.75 0.11 -1.46 0.00 0.00 175.22 175.62 1oyj h TRP 13 N 7.00 0.63 -0.01 10.12 5.08 -1.96 -2.04 115.95 134.78 1oyj h TRP 13 Ca -0.38 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.62 1oyj h TRP 13 Cb 1.15 -0.16 0.00 0.00 -3.00 0.00 0.00 29.16 27.15 1oyj h TRP 13 CO 0.49 0.14 -0.13 1.55 -1.28 0.00 0.00 178.44 179.21 1oyj n VAL 14 N -4.92 0.00 -1.99 0.12 3.14 -1.26 -4.91 118.33 108.50 1oyj n VAL 14 Ca 0.14 -0.09 -0.42 0.00 -2.96 0.00 0.00 64.34 61.01 1oyj n VAL 14 Cb 0.39 0.06 -0.03 0.00 -1.06 0.00 0.00 33.84 33.20 1oyj n VAL 14 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 1oyj s SER 15 N -2.42 6.66 0.41 6.55 0.15 -0.77 -4.86 113.70 119.42 1oyj s SER 15 Ca 0.29 2.34 0.20 0.00 0.70 0.00 0.00 55.95 59.48 1oyj s SER 15 Cb 0.20 -2.55 0.86 0.00 -1.71 0.00 0.00 66.02 62.82 1oyj s SER 15 CO 0.47 -0.89 1.83 1.55 1.20 0.00 0.00 173.24 177.40 1oyj h PRO 16 N 8.85 0.00 -0.22 5.44 0.13 -1.91 -2.11 132.00 142.19 1oyj h PRO 16 Ca -0.41 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.64 1oyj h PRO 16 Cb 1.19 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.32 1oyj h PRO 16 CO 0.94 0.31 -0.16 0.74 -0.23 0.00 0.00 178.00 179.60 1oyj h PHE 17 N 0.00 0.59 -0.65 1.56 -1.00 -1.95 -2.75 116.94 112.74 1oyj h PHE 17 Ca -0.00 -0.16 -0.04 0.00 2.81 0.00 0.00 57.97 60.58 1oyj h PHE 17 Cb 0.72 -0.13 -0.03 0.00 3.61 0.00 0.00 35.95 40.13 1oyj h PHE 17 CO 0.00 0.81 0.25 0.78 -1.61 0.00 0.00 178.31 178.55 1oyj h GLY 18 N 0.19 1.03 0.99 -1.45 0.00 -1.86 -2.53 103.07 99.44 1oyj h GLY 18 Ca 0.04 -0.54 0.04 0.00 0.00 0.00 0.00 47.33 46.87 1oyj h GLY 18 CO 0.04 0.51 0.57 1.46 0.00 0.00 0.00 176.54 179.13 1oyj h GLN 19 N 0.94 1.03 -0.61 4.80 4.20 -1.28 -0.27 115.11 123.93 1oyj h GLN 19 Ca 0.22 -0.06 0.12 0.00 0.06 0.00 0.00 58.65 58.99 1oyj h GLN 19 Cb 0.19 -0.23 -0.12 0.00 0.30 0.00 0.00 27.48 27.62 1oyj h GLN 19 CO -0.02 0.68 -0.16 0.00 -0.67 0.00 0.00 178.83 178.66 1oyj h ARG 20 N 1.06 -0.01 -0.52 1.46 3.08 -1.14 -1.51 114.38 116.80 1oyj h ARG 20 Ca 0.35 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 60.28 1oyj h ARG 20 Cb 0.07 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1oyj h ARG 20 CO -0.11 -0.01 -0.15 0.00 -1.07 0.00 0.00 179.97 178.63 1oyj h ARG 22 N 0.89 0.89 -0.16 0.00 3.08 -0.87 -1.27 114.38 116.95 1oyj h ARG 22 Ca 0.13 -0.08 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 1oyj h ARG 22 Cb 0.73 -0.19 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 1oyj h ARG 22 CO 0.06 0.64 0.05 0.82 -1.07 0.00 0.00 179.97 180.46 1oyj h ILE 23 N 0.89 1.18 -0.71 2.04 2.04 -1.17 -1.10 117.51 120.68 1oyj h ILE 23 Ca 0.24 -0.54 0.03 0.00 1.00 0.00 0.00 64.86 65.59 1oyj h ILE 23 Cb -0.03 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 37.25 1oyj h ILE 23 CO -0.04 0.17 0.45 0.00 0.00 0.00 0.00 178.15 178.72 1oyj h ALA 24 N 0.87 0.94 -0.43 1.87 0.00 -0.99 0.26 119.26 121.78 1oyj h ALA 24 Ca 0.05 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1oyj h ALA 24 Cb 0.21 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1oyj h ALA 24 CO -0.00 0.22 0.09 0.52 0.00 0.00 0.00 179.25 180.08 1oyj h MET 25 N 0.87 0.70 -0.34 0.00 2.86 -1.15 -1.72 114.93 116.15 1oyj h MET 25 Ca 0.29 -0.18 0.04 0.00 -2.06 0.00 0.00 59.70 57.80 1oyj h MET 25 Cb 0.03 -0.09 -0.04 0.00 0.06 0.00 0.00 31.60 31.56 1oyj h MET 25 CO -0.11 0.72 0.10 0.00 1.06 0.00 0.00 176.91 178.68 1oyj h ALA 26 N 0.95 0.39 -0.82 6.32 0.00 -0.71 0.88 119.26 126.26 1oyj h ALA 26 Ca 0.13 0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.20 1oyj h ALA 26 Cb 0.34 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 1oyj h ALA 26 CO 0.00 -0.30 0.54 0.93 0.00 0.00 0.00 179.25 180.42 1oyj h GLU 27 N 0.24 0.73 -0.01 0.00 4.39 -0.26 -2.48 114.58 117.18 1oyj h GLU 27 Ca 0.16 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.81 1oyj h GLU 27 Cb 0.15 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 28.63 1oyj h GLU 27 CO -0.18 0.48 -0.13 1.63 -1.16 0.00 0.00 179.01 179.66 1oyj n LYS 28 N -4.52 1.20 -1.55 2.33 5.02 -0.67 -4.75 118.16 115.23 1oyj n LYS 28 Ca 0.14 -0.68 -0.05 0.00 -2.02 0.00 0.00 58.31 55.70 1oyj n LYS 28 Cb 0.34 -1.49 -0.01 0.00 -0.02 0.00 0.00 35.03 33.85 1oyj n LYS 28 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1oyj n GLY 29 N 1.26 0.51 3.55 0.72 0.00 -0.53 -4.74 105.19 105.96 1oyj n GLY 29 Ca 0.16 -0.77 -0.39 0.00 0.00 0.00 0.00 46.02 45.02 1oyj n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1oyj s LEU 30 N -1.29 4.23 0.46 0.99 1.43 0.19 -4.91 118.68 119.79 1oyj s LEU 30 Ca 0.00 -0.23 -0.17 0.00 -1.03 0.00 0.00 54.13 52.69 1oyj s LEU 30 Cb 0.00 -2.12 -0.09 0.00 0.03 0.00 0.00 46.19 44.02 1oyj s LEU 30 CO 0.00 -0.14 0.94 -1.61 0.23 0.00 0.00 176.35 175.76 1oyj s GLU 31 N 1.73 4.03 -0.02 1.70 0.41 -1.26 -4.34 118.70 120.95 1oyj s GLU 31 Ca 0.06 0.95 -0.22 0.00 -0.41 0.00 0.00 54.97 55.35 1oyj s GLU 31 Cb -0.17 -2.19 0.04 0.00 -1.78 0.00 0.00 34.13 30.03 1oyj s GLU 31 CO 0.10 -0.14 0.48 -0.59 -0.49 0.00 0.00 175.26 174.62 1oyj s PHE 32 N -2.41 -0.39 -0.19 1.61 -0.12 -1.26 -4.55 117.98 110.66 1oyj s PHE 32 Ca 0.59 0.61 -0.25 0.00 -0.05 0.00 0.00 56.93 57.84 1oyj s PHE 32 Cb -0.10 0.25 -0.01 0.00 -0.63 0.00 0.00 43.02 42.53 1oyj s PHE 32 CO 0.24 -0.51 0.81 -2.00 -0.05 0.00 0.00 175.22 173.71 1oyj s GLU 33 N -1.47 4.26 -0.12 1.99 2.12 -0.36 -4.92 118.70 120.19 1oyj s GLU 33 Ca -0.11 0.95 -0.19 0.00 0.36 0.00 0.00 54.97 55.98 1oyj s GLU 33 Cb -0.02 -3.59 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 1oyj s GLU 33 CO 0.05 -0.37 0.52 -0.47 -0.54 0.00 0.00 175.26 174.46 1oyj s TYR 34 N 2.31 3.50 -0.16 5.30 5.04 -1.26 -0.65 117.35 131.43 1oyj s TYR 34 Ca 0.36 0.93 0.02 0.00 -2.44 0.00 0.00 57.07 55.94 1oyj s TYR 34 Cb -0.16 -2.61 0.01 0.00 0.35 0.00 0.00 41.96 39.55 1oyj s TYR 34 CO 0.11 0.11 -0.20 1.03 -1.34 0.00 0.00 175.55 175.26 1oyj s ARG 35 N 0.82 3.04 -0.24 4.97 0.52 1.00 -4.94 118.95 124.12 1oyj s ARG 35 Ca 0.28 -0.83 -0.25 0.00 -0.52 0.00 0.00 55.73 54.41 1oyj s ARG 35 Cb -0.16 -2.52 -0.00 0.00 0.52 0.00 0.00 34.95 32.79 1oyj s ARG 35 CO 0.11 -0.08 0.84 -2.00 0.02 0.00 0.00 175.30 174.19 1oyj s GLU 36 N 0.99 4.18 0.01 3.54 2.56 -1.26 -1.46 118.70 127.27 1oyj s GLU 36 Ca -0.02 0.96 -0.12 0.00 0.00 0.00 0.00 54.97 55.78 1oyj s GLU 36 Cb -0.15 -3.65 -0.05 0.00 2.00 0.00 0.00 34.13 32.28 1oyj s GLU 36 CO -0.05 -0.53 0.37 -1.21 -0.56 0.00 0.00 175.26 173.28 1oyj s GLU 37 N 2.87 3.80 -0.46 4.30 0.41 0.86 -4.91 118.70 125.57 1oyj s GLU 37 Ca 0.35 0.26 -0.20 0.00 -0.41 0.00 0.00 54.97 54.97 1oyj s GLU 37 Cb -0.15 -3.14 0.03 0.00 -1.78 0.00 0.00 34.13 29.09 1oyj s GLU 37 CO 0.07 0.66 0.65 0.34 -0.49 0.00 0.00 175.26 176.49 1oyj s ASP 38 N -1.31 6.30 0.46 -0.19 2.15 -1.26 -4.72 116.67 118.09 1oyj s ASP 38 Ca 0.26 -0.46 0.31 0.00 0.43 0.00 0.00 52.55 53.09 1oyj s ASP 38 Cb -0.15 -2.32 1.50 0.00 -0.30 0.00 0.00 42.92 41.65 1oyj s ASP 38 CO 0.14 -0.82 1.95 -0.07 -0.17 0.00 0.00 175.17 176.20 1oyj h LEU 39 N 9.75 0.00 -0.30 -1.34 3.38 -1.97 0.25 115.31 125.09 1oyj h LEU 39 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1oyj h LEU 39 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1oyj h LEU 39 CO 0.91 0.00 -0.28 0.61 0.09 0.00 0.00 178.44 179.77 1oyj n GLY 40 N -0.52 -0.87 2.34 0.83 0.00 -1.26 -4.40 105.19 101.31 1oyj n GLY 40 Ca -0.00 -0.35 -0.20 0.00 0.00 0.00 0.00 46.02 45.47 1oyj n GLY 40 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1oyj n ASN 41 N -0.96 -0.67 -4.77 1.61 2.85 0.88 -5.14 115.26 109.06 1oyj n ASN 41 Ca 0.11 -2.85 -0.40 0.00 -0.11 0.00 0.00 54.58 51.32 1oyj n ASN 41 Cb 0.33 0.03 -0.02 0.00 1.24 0.00 0.00 39.78 41.36 1oyj n ASN 41 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1oyj s LYS 42 N -0.66 4.28 0.70 1.20 1.02 -1.10 -4.46 119.74 120.72 1oyj s LYS 42 Ca 0.34 2.21 -0.15 0.00 0.02 0.00 0.00 55.97 58.40 1oyj s LYS 42 Cb 0.18 -3.01 0.02 0.00 -0.52 0.00 0.00 37.83 34.50 1oyj s LYS 42 CO -0.15 -0.25 1.15 -1.54 -0.92 0.00 0.00 175.35 173.64 1oyj s SER 43 N -0.53 4.67 0.23 2.83 1.04 -1.26 -4.86 113.70 115.82 1oyj s SER 43 Ca 0.50 2.14 -0.07 0.00 0.48 0.00 0.00 55.95 59.00 1oyj s SER 43 Cb -0.40 -2.57 0.31 0.00 0.10 0.00 0.00 66.02 63.47 1oyj s SER 43 CO 0.52 -1.93 1.82 0.44 0.98 0.00 0.00 173.24 175.07 1oyj h ASP 44 N -0.19 0.66 -0.73 7.02 3.45 -1.99 -1.46 116.42 123.17 1oyj h ASP 44 Ca -0.47 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.02 1oyj h ASP 44 Cb 1.27 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 39.90 1oyj h ASP 44 CO 0.52 0.41 0.46 0.25 -1.57 0.00 0.00 179.24 179.31 1oyj h LEU 45 N 0.79 0.86 -0.37 1.55 5.85 -1.98 -0.99 115.31 121.01 1oyj h LEU 45 Ca 0.35 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.02 1oyj h LEU 45 Cb 0.23 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 1oyj h LEU 45 CO -0.20 0.65 0.24 0.25 -0.34 0.00 0.00 178.44 179.04 1oyj h LEU 46 N 0.99 0.43 -0.92 2.25 5.85 -1.66 -0.46 115.31 121.80 1oyj h LEU 46 Ca 0.26 -0.02 -0.09 0.00 0.84 0.00 0.00 57.88 58.87 1oyj h LEU 46 Cb -0.07 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.84 1oyj h LEU 46 CO -0.05 0.32 -0.19 -0.07 -0.34 0.00 0.00 178.44 178.11 1oyj h LEU 47 N 0.50 0.57 -0.06 2.25 3.38 -0.95 -0.91 115.31 120.08 1oyj h LEU 47 Ca 0.13 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1oyj h LEU 47 Cb -0.04 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1oyj h LEU 47 CO -0.03 0.77 -0.18 0.03 0.09 0.00 0.00 178.44 179.13 1oyj h ARG 48 N 0.52 0.00 0.05 1.13 3.08 -1.06 -3.04 114.38 115.05 1oyj h ARG 48 Ca 0.08 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.81 1oyj h ARG 48 Cb 0.62 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.63 1oyj h ARG 48 CO 0.04 0.18 -1.82 0.43 -1.07 0.00 0.00 179.97 177.73 1oyj n SER 49 N -3.15 1.33 -3.19 7.04 7.64 -0.19 -4.42 113.62 118.69 1oyj n SER 49 Ca 0.03 0.34 -0.24 0.00 1.01 0.00 0.00 58.87 60.01 1oyj n SER 49 Cb 0.59 -0.35 -0.05 0.00 -1.01 0.00 0.00 64.21 63.39 1oyj n SER 49 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 1oyj n ASN 50 N -3.20 2.03 0.25 6.43 5.15 -0.40 -4.83 115.26 120.68 1oyj n ASN 50 Ca -0.23 -3.15 0.11 0.00 -0.60 0.00 0.00 54.58 50.71 1oyj n ASN 50 Cb 1.05 -0.62 0.63 0.00 -0.53 0.00 0.00 39.78 40.30 1oyj n ASN 50 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 1oyj h PRO 51 N 3.54 0.00 -0.01 1.20 0.13 -1.74 0.45 132.00 135.57 1oyj h PRO 51 Ca 0.12 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.24 1oyj h PRO 51 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 1oyj h PRO 51 CO 0.63 0.17 -0.03 0.28 -0.23 0.00 0.00 178.00 178.81 1oyj h VAL 52 N 0.00 1.54 0.00 1.56 2.07 -1.92 -3.38 116.25 116.12 1oyj h VAL 52 Ca -0.00 -1.65 -0.20 0.00 0.82 0.00 0.00 66.70 65.67 1oyj h VAL 52 Cb 0.46 2.64 -0.04 0.00 -1.52 0.00 0.00 31.29 32.83 1oyj h VAL 52 CO 0.02 0.43 -2.08 1.41 0.02 0.00 0.00 177.57 177.38 1oyj n HIS 53 N -4.72 0.00 -3.59 1.57 8.25 -1.21 -5.01 115.22 110.51 1oyj n HIS 53 Ca -0.09 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.11 1oyj n HIS 53 Cb 0.36 -0.71 0.05 0.00 1.12 0.00 0.00 29.99 30.82 1oyj n HIS 53 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1oyj n ARG 54 N -2.47 -6.51 -4.44 -0.41 1.74 0.16 -5.00 116.66 99.72 1oyj n ARG 54 Ca -0.19 0.76 -0.25 0.00 -0.77 0.00 0.00 57.85 57.39 1oyj n ARG 54 Cb 0.86 -5.72 -0.11 0.00 -1.02 0.00 0.00 32.46 26.48 1oyj n ARG 54 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1oyj s LYS 55 N -6.29 1.66 0.26 5.56 1.02 -1.26 -5.04 119.74 115.65 1oyj s LYS 55 Ca 0.56 -1.64 0.06 0.00 0.02 0.00 0.00 55.97 54.97 1oyj s LYS 55 Cb -0.26 -1.83 -0.03 0.00 -0.52 0.00 0.00 37.83 35.19 1oyj s LYS 55 CO 0.69 0.36 0.31 0.96 -0.92 0.00 0.00 175.35 176.75 1oyj s ILE 56 N -2.15 4.67 0.52 2.17 -5.25 -1.26 -4.46 121.20 115.44 1oyj s ILE 56 Ca 0.26 -1.17 -0.15 0.00 -0.99 0.00 0.00 60.65 58.60 1oyj s ILE 56 Cb -0.06 -3.58 -0.07 0.00 2.95 0.00 0.00 42.46 41.69 1oyj s ILE 56 CO 0.13 -0.30 0.97 -2.16 -1.79 0.00 0.00 174.94 171.79 1oyj s PRO 57 N -3.96 3.88 -0.09 0.37 0.04 -1.26 -4.82 135.00 129.16 1oyj s PRO 57 Ca 0.36 0.88 0.01 0.00 0.04 0.00 0.00 61.00 62.28 1oyj s PRO 57 Cb -0.08 -2.15 0.02 0.00 0.04 0.00 0.00 34.50 32.32 1oyj s PRO 57 CO 0.28 -0.29 -0.11 0.08 0.04 0.00 0.00 177.00 177.00 1oyj s VAL 58 N -2.68 1.13 -0.24 -0.36 1.01 -0.92 -4.03 120.40 114.30 1oyj s VAL 58 Ca 0.58 -0.43 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 1oyj s VAL 58 Cb -0.10 -1.07 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 1oyj s VAL 58 CO 0.35 0.37 0.21 -0.22 0.00 0.00 0.00 175.10 175.80 1oyj s LEU 59 N 1.06 4.10 -0.26 3.92 2.96 -0.03 -0.57 118.68 129.86 1oyj s LEU 59 Ca -0.07 0.16 -0.07 0.00 -0.22 0.00 0.00 54.13 53.93 1oyj s LEU 59 Cb -0.15 -2.18 -0.02 0.00 0.50 0.00 0.00 46.19 44.35 1oyj s LEU 59 CO -0.01 0.01 0.06 -0.76 -1.32 0.00 0.00 176.35 174.33 1oyj s LEU 60 N 1.26 3.46 -0.27 -0.68 1.02 0.81 -0.33 118.68 123.95 1oyj s LEU 60 Ca 0.09 -0.35 -0.04 0.00 0.02 0.00 0.00 54.13 53.85 1oyj s LEU 60 Cb -0.14 -1.89 0.02 0.00 0.02 0.00 0.00 46.19 44.20 1oyj s LEU 60 CO 0.06 -0.07 -0.00 -2.28 0.02 0.00 0.00 176.35 174.08 1oyj s HIS 61 N 1.57 3.10 -1.58 0.29 2.46 -0.49 -0.54 115.29 120.10 1oyj s HIS 61 Ca 0.05 -1.30 -0.09 0.00 0.47 0.00 0.00 55.06 54.19 1oyj s HIS 61 Cb -0.15 -2.14 0.08 0.00 -0.13 0.00 0.00 32.58 30.24 1oyj s HIS 61 CO 0.02 -0.66 0.52 0.00 -2.47 0.00 0.00 174.74 172.16 1oyj n ALA 62 N 4.75 -1.65 -0.22 1.58 0.00 0.21 -0.94 120.51 124.24 1oyj n ALA 62 Ca -0.16 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1oyj n ALA 62 Cb 0.47 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.64 1oyj n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oyj n GLY 63 N -1.77 2.54 3.69 0.00 0.00 -1.26 -5.03 105.19 103.36 1oyj n GLY 63 Ca -0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 1oyj n GLY 63 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1oyj s ARG 64 N -0.00 4.15 0.26 1.61 0.52 -0.12 -5.02 118.95 120.34 1oyj s ARG 64 Ca 0.00 -0.13 -0.17 0.00 -0.52 0.00 0.00 55.73 54.91 1oyj s ARG 64 Cb 0.00 -3.49 -0.08 0.00 0.52 0.00 0.00 34.95 31.89 1oyj s ARG 64 CO 0.00 0.13 0.71 -1.25 0.02 0.00 0.00 175.30 174.91 1oyj s PRO 65 N 0.83 4.12 -0.07 3.54 0.04 -1.26 -1.39 135.00 140.81 1oyj s PRO 65 Ca 0.11 0.74 0.01 0.00 0.04 0.00 0.00 61.00 61.90 1oyj s PRO 65 Cb -0.13 -2.70 0.02 0.00 0.04 0.00 0.00 34.50 31.73 1oyj s PRO 65 CO 0.03 0.30 -0.06 0.08 0.04 0.00 0.00 177.00 177.39 1oyj s VAL 66 N -1.71 0.75 0.26 -0.36 1.01 0.55 -4.99 120.40 115.91 1oyj s VAL 66 Ca 0.47 -0.20 0.10 0.00 0.00 0.00 0.00 61.98 62.36 1oyj s VAL 66 Cb -0.14 -0.77 -0.05 0.00 0.00 0.00 0.00 36.38 35.42 1oyj s VAL 66 CO 0.19 0.29 -0.17 -0.44 0.00 0.00 0.00 175.10 174.98 1oyj s SER 67 N 1.21 3.28 0.00 3.32 0.01 -1.26 -0.85 113.70 119.41 1oyj s SER 67 Ca -0.06 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.16 1oyj s SER 67 Cb -0.14 -0.25 0.00 0.00 0.21 0.00 0.00 66.02 65.84 1oyj s SER 67 CO -0.02 -0.05 0.00 -0.62 0.41 0.00 0.00 173.24 172.96 1oyj n GLU 68 N -0.56 -0.16 -0.27 12.44 -0.58 -1.26 -4.44 120.64 125.81 1oyj n GLU 68 Ca -0.06 0.60 -0.03 0.00 -0.42 0.00 0.00 57.16 57.25 1oyj n GLU 68 Cb 0.61 -0.37 0.09 0.00 -0.57 0.00 0.00 31.44 31.20 1oyj n GLU 68 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 1oyj h SER 69 N 0.13 0.79 0.31 1.62 4.64 -1.88 0.20 113.55 119.35 1oyj h SER 69 Ca 0.00 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.23 1oyj h SER 69 Cb 0.00 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 1oyj h SER 69 CO 0.00 0.55 -0.39 -0.07 -0.87 0.00 0.00 176.83 176.05 1oyj h LEU 70 N 0.93 0.11 -0.45 5.97 3.38 -1.93 0.14 115.31 123.47 1oyj h LEU 70 Ca 0.30 -0.04 -0.06 0.00 0.09 0.00 0.00 57.88 58.17 1oyj h LEU 70 Cb 0.01 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1oyj h LEU 70 CO -0.11 0.50 0.04 0.58 0.09 0.00 0.00 178.44 179.54 1oyj h VAL 71 N 0.10 1.25 -0.49 1.22 2.07 -1.21 -2.46 116.25 116.72 1oyj h VAL 71 Ca 0.01 -0.97 -0.01 0.00 0.82 0.00 0.00 66.70 66.55 1oyj h VAL 71 Cb 0.74 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 1oyj h VAL 71 CO 0.06 0.34 0.28 0.40 0.02 0.00 0.00 177.57 178.66 1oyj h ILE 72 N 0.62 1.17 -0.28 4.57 2.04 -0.11 -0.01 117.51 125.50 1oyj h ILE 72 Ca 0.13 -0.41 0.05 0.00 1.00 0.00 0.00 64.86 65.63 1oyj h ILE 72 Cb 0.43 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 1oyj h ILE 72 CO 0.02 0.17 -0.01 -0.07 0.00 0.00 0.00 178.15 178.26 1oyj h LEU 73 N 0.65 -0.13 -1.09 1.44 3.38 -0.93 0.83 115.31 119.46 1oyj h LEU 73 Ca 0.17 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 58.12 1oyj h LEU 73 Cb 0.04 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1oyj h LEU 73 CO -0.03 -0.03 -0.29 1.56 0.09 0.00 0.00 178.44 179.74 1oyj h GLN 74 N 0.07 0.28 -0.81 1.13 4.20 -1.11 -2.32 115.11 116.54 1oyj h GLN 74 Ca 0.14 -0.10 0.01 0.00 0.06 0.00 0.00 58.65 58.76 1oyj h GLN 74 Cb 0.18 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.90 1oyj h GLN 74 CO -0.24 0.55 0.54 -0.92 -0.67 0.00 0.00 178.83 178.09 1oyj h TYR 75 N 0.25 1.01 0.00 2.96 3.20 -0.08 -0.59 116.97 123.71 1oyj h TYR 75 Ca 0.04 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1oyj h TYR 75 Cb 0.65 -0.34 -0.00 0.00 1.54 0.00 0.00 36.73 38.57 1oyj h TYR 75 CO 0.01 0.63 -0.07 -0.07 -1.64 0.00 0.00 178.16 177.02 1oyj h LEU 76 N 1.08 0.00 0.02 2.82 3.38 -0.32 0.22 115.31 122.51 1oyj h LEU 76 Ca 0.30 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.27 1oyj h LEU 76 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 1oyj h LEU 76 CO -0.08 0.07 -0.01 0.44 0.09 0.00 0.00 178.44 178.96 1oyj h ASP 77 N 0.00 -0.02 -0.35 -0.43 5.19 -1.10 -3.29 116.42 116.42 1oyj h ASP 77 Ca -0.00 -0.74 -0.12 0.00 -0.62 0.00 0.00 57.03 55.55 1oyj h ASP 77 Cb 0.16 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.66 1oyj h ASP 77 CO 0.01 0.76 -0.22 0.44 -3.12 0.00 0.00 179.24 177.11 1oyj h ASP 78 N -0.82 0.87 1.03 6.45 3.45 -0.48 -2.94 116.42 123.97 1oyj h ASP 78 Ca -0.00 -0.32 0.00 0.00 0.43 0.00 0.00 57.03 57.14 1oyj h ASP 78 Cb 0.76 -0.24 0.00 0.00 -0.56 0.00 0.00 39.33 39.29 1oyj h ASP 78 CO 0.00 1.06 -0.33 0.00 -1.57 0.00 0.00 179.24 178.40 1oyj n ALA 79 N -2.51 2.72 -3.21 3.45 0.00 0.72 -4.39 120.51 117.29 1oyj n ALA 79 Ca 0.00 -0.17 -0.24 0.00 0.00 0.00 0.00 53.44 53.04 1oyj n ALA 79 Cb 0.44 -1.30 -0.06 0.00 0.00 0.00 0.00 19.45 18.54 1oyj n ALA 79 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1oyj n PHE 80 N -2.01 1.13 0.28 0.00 3.01 -1.11 -4.97 117.46 113.78 1oyj n PHE 80 Ca 0.05 -3.80 0.14 0.00 1.01 0.00 0.00 57.45 54.85 1oyj n PHE 80 Cb 0.41 -0.43 0.79 0.00 -0.01 0.00 0.00 39.48 40.25 1oyj n PHE 80 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1oyj h PRO 81 N 3.67 0.00 0.00 -1.08 0.13 -1.75 -2.36 132.00 130.61 1oyj h PRO 81 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1oyj h PRO 81 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1oyj h PRO 81 CO 0.59 0.08 0.00 0.41 -0.23 0.00 0.00 178.00 178.85 1oyj n GLY 82 N -0.81 -1.29 3.93 1.56 0.00 -1.26 -4.88 105.19 102.43 1oyj n GLY 82 Ca -0.02 -0.14 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 1oyj n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1oyj s THR 83 N -2.60 4.83 0.03 2.61 -4.23 -0.89 -4.93 115.64 110.47 1oyj s THR 83 Ca 0.28 -0.13 -0.35 0.00 -1.18 0.00 0.00 61.69 60.30 1oyj s THR 83 Cb 0.20 -3.81 -0.14 0.00 1.34 0.00 0.00 72.50 70.10 1oyj s THR 83 CO 0.46 -0.67 1.66 -2.65 -0.54 0.00 0.00 174.62 172.88 1oyj n PRO 84 N -2.08 1.92 -3.01 3.99 -0.02 -1.26 -4.94 135.00 129.60 1oyj n PRO 84 Ca -0.01 0.70 -0.37 0.00 -2.02 0.00 0.00 63.50 61.80 1oyj n PRO 84 Cb 0.56 -2.47 -0.06 0.00 -0.02 0.00 0.00 33.50 31.51 1oyj n PRO 84 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1oyj s HIS 85 N 2.10 3.71 0.06 6.00 -3.43 -1.26 -4.79 115.29 117.68 1oyj s HIS 85 Ca 0.86 1.52 0.07 0.00 -0.80 0.00 0.00 55.06 56.70 1oyj s HIS 85 Cb -0.76 -2.71 -0.23 0.00 -1.43 0.00 0.00 32.58 27.45 1oyj s HIS 85 CO 0.46 0.35 1.04 -0.07 -2.00 0.00 0.00 174.74 174.52 1oyj h LEU 86 N 3.57 0.07 -8.75 5.38 3.38 -1.92 -3.45 115.31 113.59 1oyj h LEU 86 Ca -0.47 -0.09 -0.70 0.00 0.09 0.00 0.00 57.88 56.71 1oyj h LEU 86 Cb 1.20 -0.02 -0.27 0.00 0.09 0.00 0.00 40.66 41.66 1oyj h LEU 86 CO 0.65 1.08 -0.87 -0.76 0.09 0.00 0.00 178.44 178.63 1oyj s LEU 87 N -6.59 2.21 0.43 1.67 1.43 -1.26 -1.04 118.68 115.53 1oyj s LEU 87 Ca -0.02 -0.55 -0.25 0.00 -1.03 0.00 0.00 54.13 52.28 1oyj s LEU 87 Cb 0.09 -1.33 -0.08 0.00 0.03 0.00 0.00 46.19 44.90 1oyj s LEU 87 CO 0.83 0.27 1.25 -2.16 0.23 0.00 0.00 176.35 176.77 1oyj s PRO 88 N -1.15 3.87 0.18 1.29 0.04 -1.26 -4.92 135.00 133.05 1oyj s PRO 88 Ca 0.12 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.88 1oyj s PRO 88 Cb -0.10 -2.63 -0.08 0.00 0.04 0.00 0.00 34.50 31.74 1oyj s PRO 88 CO 0.02 -0.53 1.05 -1.25 0.04 0.00 0.00 177.00 176.33 1oyj s PRO 89 N -2.40 4.65 0.00 0.56 0.05 -1.26 -4.87 135.00 131.73 1oyj s PRO 89 Ca 0.59 1.64 0.26 0.00 0.05 0.00 0.00 61.00 63.55 1oyj s PRO 89 Cb -0.35 -3.29 0.67 0.00 0.05 0.00 0.00 34.50 31.58 1oyj s PRO 89 CO 0.44 0.17 1.52 0.00 0.05 0.00 0.00 177.00 179.17 1oyj n ALA 90 N 2.27 3.29 -0.19 8.56 0.00 -1.26 -4.29 120.51 128.88 1oyj n ALA 90 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.10 1oyj n ALA 90 Cb 0.47 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.77 1oyj n ALA 90 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1oyj n ASN 91 N -1.15 3.34 0.00 0.00 6.94 -1.26 -4.78 115.26 118.34 1oyj n ASN 91 Ca 0.09 -1.85 0.00 0.00 -0.02 0.00 0.00 54.58 52.79 1oyj n ASN 91 Cb 0.34 -0.69 0.00 0.00 -2.36 0.00 0.00 39.78 37.06 1oyj n ASN 91 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1oyj n SER 92 N 1.53 0.00 0.00 0.53 7.64 -1.26 -5.16 113.62 116.90 1oyj n SER 92 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1oyj n SER 92 Cb 0.33 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.53 1oyj n SER 92 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1oyj n GLY 93 N -1.77 -1.81 0.12 0.23 0.00 -1.26 -4.77 105.19 95.92 1oyj n GLY 93 Ca 0.00 -1.71 -0.01 0.00 0.00 0.00 0.00 46.02 44.30 1oyj n GLY 93 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oyj n ASP 94 N 0.29 0.76 0.00 1.61 10.43 -1.26 -5.11 116.55 123.27 1oyj n ASP 94 Ca 0.00 -1.08 0.00 0.00 2.57 0.00 0.00 54.79 56.28 1oyj n ASP 94 Cb 0.00 0.04 0.00 0.00 1.84 0.00 0.00 41.12 43.00 1oyj n ASP 94 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1oyj n ALA 95 N -2.93 0.00 1.51 2.24 0.00 -1.26 -3.96 120.51 116.11 1oyj n ALA 95 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1oyj n ALA 95 Cb 0.02 0.00 0.01 0.00 0.00 0.00 0.00 19.45 19.48 1oyj n ALA 95 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1oyj n ASP 96 N 5.19 0.52 -0.00 0.00 2.03 -1.26 -4.43 116.55 118.60 1oyj n ASP 96 Ca 0.00 -2.01 -0.11 0.00 0.52 0.00 0.00 54.79 53.19 1oyj n ASP 96 Cb 0.00 -0.23 -0.06 0.00 -0.72 0.00 0.00 41.12 40.11 1oyj n ASP 96 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1oyj h ALA 97 N 2.57 0.10 -0.46 -1.67 0.00 -1.93 0.41 119.26 118.29 1oyj h ALA 97 Ca 0.00 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1oyj h ALA 97 Cb 0.25 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 1oyj h ALA 97 CO 0.00 -0.36 0.26 0.00 0.00 0.00 0.00 179.25 179.15 1oyj h ALA 98 N 0.94 0.58 -0.43 0.00 0.00 -1.92 -0.82 119.26 117.61 1oyj h ALA 98 Ca 0.03 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1oyj h ALA 98 Cb 0.08 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1oyj h ALA 98 CO -0.00 -0.06 -0.18 -0.92 0.00 0.00 0.00 179.25 178.08 1oyj h TYR 99 N 0.52 0.94 -0.50 0.00 3.20 -1.76 -1.73 116.97 117.64 1oyj h TYR 99 Ca 0.19 -0.20 -0.07 0.00 3.14 0.00 0.00 58.73 61.79 1oyj h TYR 99 Cb 0.03 -0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.05 1oyj h TYR 99 CO -0.08 0.95 0.04 0.00 -1.64 0.00 0.00 178.16 177.44 1oyj h ALA 100 N 1.05 1.14 -0.60 1.82 0.00 0.22 -0.06 119.26 122.84 1oyj h ALA 100 Ca 0.11 -0.24 -0.05 0.00 0.00 0.00 0.00 54.91 54.72 1oyj h ALA 100 Cb 0.70 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1oyj h ALA 100 CO 0.05 0.56 0.18 0.00 0.00 0.00 0.00 179.25 180.04 1oyj h ARG 101 N 0.76 0.94 -0.40 0.00 3.08 -0.82 -0.76 114.38 117.18 1oyj h ARG 101 Ca 0.15 -0.21 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 1oyj h ARG 101 Cb 0.40 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 1oyj h ARG 101 CO 0.01 0.84 -0.02 0.00 -1.07 0.00 0.00 179.97 179.73 1oyj h ALA 102 N 1.05 0.54 -0.51 0.04 0.00 -0.60 -0.74 119.26 119.04 1oyj h ALA 102 Ca 0.19 -0.27 0.07 0.00 0.00 0.00 0.00 54.91 54.90 1oyj h ALA 102 Cb 0.30 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.89 1oyj h ALA 102 CO -0.00 0.34 0.18 1.15 0.00 0.00 0.00 179.25 180.92 1oyj h THR 103 N 0.55 0.82 -0.64 0.00 2.02 -0.88 -0.80 112.91 113.98 1oyj h THR 103 Ca 0.11 -0.12 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 1oyj h THR 103 Cb 0.51 0.43 -0.03 0.00 -1.74 0.00 0.00 68.15 67.32 1oyj h THR 103 CO 0.02 0.06 0.24 0.00 0.37 0.00 0.00 175.52 176.22 1oyj h ALA 104 N 1.34 0.83 -0.44 6.16 0.00 -0.93 -2.01 119.26 124.20 1oyj h ALA 104 Ca 0.25 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1oyj h ALA 104 Cb 0.27 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1oyj h ALA 104 CO -0.25 0.46 -0.10 0.00 0.00 0.00 0.00 179.25 179.35 1oyj h ARG 105 N 0.90 0.80 0.08 0.00 3.08 -0.78 -0.37 114.38 118.09 1oyj h ARG 105 Ca 0.21 -0.26 0.02 0.00 0.07 0.00 0.00 59.98 60.02 1oyj h ARG 105 Cb 0.23 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 1oyj h ARG 105 CO -0.01 0.87 -0.26 0.35 -1.07 0.00 0.00 179.97 179.85 1oyj h PHE 106 N 0.72 -0.68 -0.20 3.04 3.57 -0.83 -0.83 116.94 121.72 1oyj h PHE 106 Ca 0.12 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.50 1oyj h PHE 106 Cb 0.59 0.29 -0.01 0.00 2.79 0.00 0.00 35.95 39.61 1oyj h PHE 106 CO 0.03 -0.35 -0.44 -1.49 -2.23 0.00 0.00 178.31 173.82 1oyj h TRP 107 N -0.44 0.60 -0.20 0.41 4.06 -1.17 -0.79 115.95 118.43 1oyj h TRP 107 Ca 0.04 -0.18 -0.01 0.00 2.06 0.00 0.00 58.89 60.80 1oyj h TRP 107 Cb 0.48 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.51 1oyj h TRP 107 CO -0.25 0.86 0.10 0.00 -3.56 0.00 0.00 178.44 175.59 1oyj h ALA 108 N 1.11 0.26 -0.90 1.49 0.00 -1.00 -0.97 119.26 119.26 1oyj h ALA 108 Ca 0.03 -0.07 0.10 0.00 0.00 0.00 0.00 54.91 54.97 1oyj h ALA 108 Cb 0.94 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.57 1oyj h ALA 108 CO 0.08 -0.19 0.54 0.22 0.00 0.00 0.00 179.25 179.90 1oyj h ASP 109 N 0.21 0.78 -0.58 0.00 3.58 -0.86 -1.91 116.42 117.64 1oyj h ASP 109 Ca 0.07 0.05 -0.01 0.00 0.42 0.00 0.00 57.03 57.56 1oyj h ASP 109 Cb 0.09 -0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.01 1oyj h ASP 109 CO -0.01 0.44 0.32 0.22 -2.88 0.00 0.00 179.24 177.33 1oyj h TYR 110 N 0.88 0.80 -0.68 0.28 3.20 -0.66 0.30 116.97 121.09 1oyj h TYR 110 Ca 0.43 -0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.29 1oyj h TYR 110 Cb 0.39 -0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 1oyj h TYR 110 CO -0.04 0.58 0.45 0.28 -1.64 0.00 0.00 178.16 177.78 1oyj h VAL 111 N 0.79 1.18 -0.47 1.81 2.07 -0.78 -1.11 116.25 119.75 1oyj h VAL 111 Ca 0.21 -0.34 -0.05 0.00 0.82 0.00 0.00 66.70 67.34 1oyj h VAL 111 Cb 0.04 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 29.97 1oyj h VAL 111 CO -0.03 0.17 0.08 0.44 0.02 0.00 0.00 177.57 178.25 1oyj h ASP 112 N 0.92 0.68 0.78 0.57 3.45 -0.57 -1.89 116.42 120.36 1oyj h ASP 112 Ca 0.25 -0.13 -0.14 0.00 0.43 0.00 0.00 57.03 57.45 1oyj h ASP 112 Cb -0.09 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 38.48 1oyj h ASP 112 CO -0.05 0.70 -0.65 0.03 -1.57 0.00 0.00 179.24 177.69 1oyj h ARG 113 N 0.70 0.00 0.00 3.56 3.08 -0.37 -3.42 114.38 117.92 1oyj h ARG 113 Ca 0.15 0.00 -0.25 0.00 0.07 0.00 0.00 59.98 59.95 1oyj h ARG 113 Cb 0.32 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.33 1oyj h ARG 113 CO 0.00 0.65 -1.86 1.63 -1.07 0.00 0.00 179.97 179.33 1oyj n LYS 114 N -3.63 0.33 0.32 0.04 4.76 -0.47 -4.79 118.16 114.71 1oyj n LYS 114 Ca -0.01 0.14 -0.15 0.00 -2.87 0.00 0.00 58.31 55.42 1oyj n LYS 114 Cb 0.67 -1.08 -0.08 0.00 -1.84 0.00 0.00 35.03 32.71 1oyj n LYS 114 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 1oyj h LEU 115 N -0.49 -0.70 0.65 -0.35 -0.00 -1.58 0.19 115.31 113.04 1oyj h LEU 115 Ca -0.38 -0.02 -0.03 0.00 -0.00 0.00 0.00 57.88 57.44 1oyj h LEU 115 Cb 1.36 0.18 0.01 0.00 -0.00 0.00 0.00 40.66 42.21 1oyj h LEU 115 CO -0.21 -0.34 -0.31 0.22 -0.00 0.00 0.00 178.44 177.79 1oyj h TYR 116 N -1.09 -0.81 -0.42 1.13 3.20 -1.84 0.16 116.97 117.31 1oyj h TYR 116 Ca -0.08 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.75 1oyj h TYR 116 Cb 0.68 0.27 -0.02 0.00 1.54 0.00 0.00 36.73 39.20 1oyj h TYR 116 CO 0.00 -0.49 0.19 -0.44 -1.64 0.00 0.00 178.16 175.78 1oyj h ASP 117 N -0.92 0.56 0.99 -2.11 3.32 -1.87 -0.35 116.42 116.04 1oyj h ASP 117 Ca -0.09 -0.14 -0.12 0.00 0.02 0.00 0.00 57.03 56.69 1oyj h ASP 117 Cb 0.68 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.07 1oyj h ASP 117 CO 0.15 0.55 -0.59 0.00 -1.72 0.00 0.00 179.24 177.62 1oyj h GLY 119 N 2.56 0.99 1.74 0.00 0.00 -0.86 -3.15 103.07 104.35 1oyj h GLY 119 Ca -0.01 -0.97 -0.01 0.00 0.00 0.00 0.00 47.33 46.34 1oyj h GLY 119 CO 0.08 0.88 0.10 0.23 0.00 0.00 0.00 176.54 177.83 1oyj h SER 120 N 0.76 0.31 -0.05 0.19 0.87 -0.73 0.15 113.55 115.06 1oyj h SER 120 Ca 0.07 -0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.62 1oyj h SER 120 Cb 0.92 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.80 1oyj h SER 120 CO 0.09 0.28 0.04 0.03 -0.53 0.00 0.00 176.83 176.74 1oyj h ARG 121 N 0.35 0.00 0.00 2.24 3.08 -1.47 -2.17 114.38 116.42 1oyj h ARG 121 Ca 0.09 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.08 1oyj h ARG 121 Cb 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1oyj h ARG 121 CO -0.01 0.00 -0.27 -0.07 -1.07 0.00 0.00 179.97 178.55 1oyj h LEU 122 N 0.00 0.00 -0.02 3.04 3.38 -0.78 -1.85 115.31 119.08 1oyj h LEU 122 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1oyj h LEU 122 Cb 0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1oyj h LEU 122 CO -0.00 0.27 -0.57 -2.67 0.09 0.00 0.00 178.44 175.56 1oyj n TRP 123 N -3.78 0.00 0.05 1.13 2.14 -0.99 -4.43 117.44 111.55 1oyj n TRP 123 Ca -0.01 0.00 -0.08 0.00 2.07 0.00 0.00 57.50 59.48 1oyj n TRP 123 Cb 0.37 0.00 -0.13 0.00 -0.81 0.00 0.00 31.31 30.74 1oyj n TRP 123 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1oyj h ARG 124 N 0.04 0.02 -6.73 -2.67 3.08 -1.27 -3.43 114.38 103.42 1oyj h ARG 124 Ca 0.00 -0.04 -0.44 0.00 0.07 0.00 0.00 59.98 59.58 1oyj h ARG 124 Cb 0.29 0.01 0.04 0.00 0.08 0.00 0.00 29.97 30.39 1oyj h ARG 124 CO 0.00 0.93 -0.09 -0.51 -1.07 0.00 0.00 179.97 179.22 1oyj s LEU 125 N -6.63 3.41 0.00 3.04 1.43 -0.71 -4.83 118.68 114.39 1oyj s LEU 125 Ca -0.01 -0.06 0.05 0.00 -1.03 0.00 0.00 54.13 53.08 1oyj s LEU 125 Cb 0.09 -2.86 -0.02 0.00 0.03 0.00 0.00 46.19 43.44 1oyj s LEU 125 CO 0.83 -1.00 0.16 2.29 0.23 0.00 0.00 176.35 178.86 1oyj n LYS 126 N -2.20 0.42 0.00 1.70 -0.00 -1.26 -4.73 118.16 112.09 1oyj n LYS 126 Ca 0.07 -2.33 0.00 0.00 -0.00 0.00 0.00 58.31 56.05 1oyj n LYS 126 Cb 0.59 1.69 0.00 0.00 -0.00 0.00 0.00 35.03 37.31 1oyj n LYS 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1oyj n GLY 127 N -0.24 2.46 0.23 2.58 0.00 -1.26 -2.02 105.19 106.94 1oyj n GLY 127 Ca 0.02 -0.39 -0.08 0.00 0.00 0.00 0.00 46.02 45.58 1oyj n GLY 127 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1oyj h GLU 128 N 0.00 0.74 -0.72 1.61 4.57 -1.99 -1.84 114.58 116.94 1oyj h GLU 128 Ca 0.00 -0.12 0.07 0.00 -1.18 0.00 0.00 59.36 58.13 1oyj h GLU 128 Cb 0.00 -0.13 -0.05 0.00 -0.16 0.00 0.00 28.75 28.42 1oyj h GLU 128 CO 0.00 0.63 0.48 -1.35 -1.18 0.00 0.00 179.01 177.59 1oyj h PRO 129 N 0.67 0.72 -0.13 0.92 0.11 -1.97 0.13 132.00 132.46 1oyj h PRO 129 Ca 0.17 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 1oyj h PRO 129 Cb 0.15 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1oyj h PRO 129 CO -0.02 0.47 0.04 0.37 -0.21 0.00 0.00 178.00 178.66 1oyj h GLN 130 N 0.74 0.20 -0.75 1.05 4.15 -0.95 -0.05 115.11 119.51 1oyj h GLN 130 Ca 0.31 -0.04 0.01 0.00 0.77 0.00 0.00 58.65 59.70 1oyj h GLN 130 Cb 0.28 -0.03 -0.04 0.00 0.21 0.00 0.00 27.48 27.91 1oyj h GLN 130 CO -0.11 0.34 0.49 0.00 -1.93 0.00 0.00 178.83 177.62 1oyj h ALA 131 N 0.85 1.48 -0.35 3.38 0.00 -0.48 0.10 119.26 124.25 1oyj h ALA 131 Ca 0.04 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1oyj h ALA 131 Cb 0.22 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1oyj h ALA 131 CO -0.00 0.48 -0.16 0.00 0.00 0.00 0.00 179.25 179.57 1oyj h ALA 132 N 1.54 0.49 -0.80 0.00 0.00 -0.46 -1.57 119.26 118.46 1oyj h ALA 132 Ca 0.28 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1oyj h ALA 132 Cb -0.10 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.54 1oyj h ALA 132 CO -0.06 0.40 0.46 0.00 0.00 0.00 0.00 179.25 180.05 1oyj h ALA 133 N 0.79 1.31 -0.75 0.00 0.00 -0.58 -1.19 119.26 118.84 1oyj h ALA 133 Ca 0.08 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.89 1oyj h ALA 133 Cb 0.70 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1oyj h ALA 133 CO 0.05 0.58 0.49 0.78 0.00 0.00 0.00 179.25 181.15 1oyj h GLY 134 N 1.13 1.06 1.67 0.00 0.00 -0.33 -1.39 103.07 105.21 1oyj h GLY 134 Ca 0.28 -0.40 -0.10 0.00 0.00 0.00 0.00 47.33 47.12 1oyj h GLY 134 CO -0.05 0.39 -0.29 3.21 0.00 0.00 0.00 176.54 179.80 1oyj h ARG 135 N 1.02 0.38 -0.33 4.80 3.08 -0.44 -0.83 114.38 122.05 1oyj h ARG 135 Ca 0.27 -0.15 -0.16 0.00 0.07 0.00 0.00 59.98 60.02 1oyj h ARG 135 Cb -0.11 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 1oyj h ARG 135 CO -0.06 0.65 -0.41 0.93 -1.07 0.00 0.00 179.97 180.00 1oyj h GLU 136 N 0.34 0.83 -0.34 0.04 5.08 -0.73 -2.06 114.58 117.75 1oyj h GLU 136 Ca 0.05 -0.44 -0.01 0.00 -1.00 0.00 0.00 59.36 57.95 1oyj h GLU 136 Cb 0.69 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 1oyj h GLU 136 CO 0.05 1.08 0.15 1.98 -1.00 0.00 0.00 179.01 181.28 1oyj h MET 137 N 0.67 0.49 -0.95 2.33 4.05 -0.99 -0.18 114.93 120.35 1oyj h MET 137 Ca 0.05 -0.08 0.10 0.00 -0.28 0.00 0.00 59.70 59.49 1oyj h MET 137 Cb 0.99 -0.09 -0.08 0.00 -0.80 0.00 0.00 31.60 31.62 1oyj h MET 137 CO 0.09 0.46 0.58 0.00 0.23 0.00 0.00 176.91 178.28 1oyj h ALA 138 N 1.00 1.38 -0.23 0.39 0.00 -1.09 0.81 119.26 121.53 1oyj h ALA 138 Ca 0.11 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 1oyj h ALA 138 Cb 0.14 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1oyj h ALA 138 CO -0.01 0.23 -0.61 1.49 0.00 0.00 0.00 179.25 180.35 1oyj h GLU 139 N 0.96 0.77 -0.99 0.00 4.57 -0.72 -0.21 114.58 118.97 1oyj h GLU 139 Ca 0.45 -0.52 0.08 0.00 -1.18 0.00 0.00 59.36 58.19 1oyj h GLU 139 Cb 0.39 0.08 -0.07 0.00 -0.16 0.00 0.00 28.75 28.98 1oyj h GLU 139 CO -0.24 1.15 0.63 0.82 -1.18 0.00 0.00 179.01 180.19 1oyj h ILE 140 N 0.57 1.05 -0.57 2.32 2.04 -0.36 0.30 117.51 122.85 1oyj h ILE 140 Ca -0.00 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.39 1oyj h ILE 140 Cb 1.21 -0.17 -0.02 0.00 -0.74 0.00 0.00 36.82 37.10 1oyj h ILE 140 CO 0.13 0.20 0.02 -0.07 0.00 0.00 0.00 178.15 178.44 1oyj h LEU 141 N 1.12 0.97 -0.98 1.44 3.38 -0.41 -1.33 115.31 119.50 1oyj h LEU 141 Ca 0.44 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 1oyj h LEU 141 Cb 0.24 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 1oyj h LEU 141 CO -0.19 1.03 -0.14 0.03 0.09 0.00 0.00 178.44 179.25 1oyj h ARG 142 N 0.88 0.58 -0.04 1.13 3.08 -0.59 -1.04 114.38 118.38 1oyj h ARG 142 Ca 0.17 -0.18 -0.00 0.00 0.07 0.00 0.00 59.98 60.03 1oyj h ARG 142 Cb 0.51 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1oyj h ARG 142 CO 0.02 0.70 0.02 1.15 -1.07 0.00 0.00 179.97 180.80 1oyj h THR 143 N 0.53 1.07 -1.00 2.04 2.02 -0.55 0.38 112.91 117.40 1oyj h THR 143 Ca 0.09 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.09 1oyj h THR 143 Cb 0.55 1.12 -0.05 0.00 -1.74 0.00 0.00 68.15 68.03 1oyj h THR 143 CO 0.04 0.06 0.66 -0.07 0.37 0.00 0.00 175.52 176.57 1oyj h LEU 144 N -0.01 1.14 -0.29 2.58 3.38 -1.02 -2.32 115.31 118.78 1oyj h LEU 144 Ca 0.02 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1oyj h LEU 144 Cb 0.07 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1oyj h LEU 144 CO -0.00 0.83 0.17 -0.08 0.09 0.00 0.00 178.44 179.44 1oyj h GLU 145 N 1.35 0.40 -0.49 1.13 4.81 -0.96 -0.43 114.58 120.38 1oyj h GLU 145 Ca 0.37 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.53 1oyj h GLU 145 Cb -0.15 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.12 1oyj h GLU 145 CO -0.08 0.33 0.20 0.00 -0.73 0.00 0.00 179.01 178.73 1oyj h ALA 146 N 1.05 1.44 -0.20 2.92 0.00 -0.60 -1.71 119.26 122.16 1oyj h ALA 146 Ca 0.10 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.75 1oyj h ALA 146 Cb 0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1oyj h ALA 146 CO -0.02 0.43 -0.46 1.49 0.00 0.00 0.00 179.25 180.70 1oyj h GLU 147 N 0.70 0.52 -0.33 0.00 4.57 -0.89 -2.95 114.58 116.20 1oyj h GLU 147 Ca 0.17 -0.29 -0.09 0.00 -1.18 0.00 0.00 59.36 57.97 1oyj h GLU 147 Cb 0.13 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.72 1oyj h GLU 147 CO -0.02 0.87 -0.18 1.25 -1.18 0.00 0.00 179.01 179.75 1oyj h LEU 148 N 0.42 0.60 0.00 1.64 5.85 -0.31 -3.48 115.31 120.02 1oyj h LEU 148 Ca 0.03 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.56 1oyj h LEU 148 Cb 0.97 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.83 1oyj h LEU 148 CO 0.09 0.79 0.00 0.61 -0.34 0.00 0.00 178.44 179.59 1oyj n GLY 149 N -0.43 2.90 0.90 3.75 0.00 -0.72 -1.95 105.19 109.64 1oyj n GLY 149 Ca 0.00 -0.32 0.09 0.00 0.00 0.00 0.00 46.02 45.79 1oyj n GLY 149 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1oyj n ASP 150 N 1.12 2.62 -4.80 1.61 8.00 -1.26 -4.94 116.55 118.90 1oyj n ASP 150 Ca 0.00 -1.96 -0.31 0.00 0.71 0.00 0.00 54.79 53.23 1oyj n ASP 150 Cb 0.00 -0.30 0.06 0.00 -0.02 0.00 0.00 41.12 40.87 1oyj n ASP 150 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1oyj s ARG 151 N -1.41 2.72 0.05 -1.24 0.52 -0.82 -4.97 118.95 113.79 1oyj s ARG 151 Ca 0.34 1.03 -0.12 0.00 -0.52 0.00 0.00 55.73 56.46 1oyj s ARG 151 Cb 0.18 -1.96 -0.32 0.00 0.52 0.00 0.00 34.95 33.37 1oyj s ARG 151 CO 0.24 -1.28 1.06 0.93 0.02 0.00 0.00 175.30 176.28 1oyj h GLU 152 N -0.84 0.46 -4.94 3.54 5.08 -1.92 -3.46 114.58 112.50 1oyj h GLU 152 Ca -0.44 -0.77 -0.30 0.00 -1.00 0.00 0.00 59.36 56.85 1oyj h GLU 152 Cb 1.22 0.28 -0.15 0.00 0.50 0.00 0.00 28.75 30.60 1oyj h GLU 152 CO 0.55 1.36 -0.70 -0.06 -1.00 0.00 0.00 179.01 179.16 1oyj s PHE 153 N -2.66 1.19 0.29 4.33 0.08 -1.26 -4.88 117.98 115.07 1oyj s PHE 153 Ca -0.07 -0.84 0.04 0.00 0.12 0.00 0.00 56.93 56.18 1oyj s PHE 153 Cb 0.05 -0.64 0.45 0.00 -0.57 0.00 0.00 43.02 42.31 1oyj s PHE 153 CO 0.93 -0.02 1.73 0.74 -0.10 0.00 0.00 175.22 178.49 1oyj h PHE 154 N 2.79 0.42 -3.32 0.36 0.04 -1.91 -3.42 116.94 111.90 1oyj h PHE 154 Ca -0.36 -0.10 -0.53 0.00 2.80 0.00 0.00 57.97 59.78 1oyj h PHE 154 Cb 1.19 -0.10 -0.00 0.00 2.20 0.00 0.00 35.95 39.23 1oyj h PHE 154 CO 0.61 0.64 0.50 0.20 -0.60 0.00 0.00 178.31 179.67 1oyj s GLY 155 N -4.09 2.62 0.00 -1.45 0.00 -1.26 -4.94 107.32 98.19 1oyj s GLY 155 Ca -0.06 0.77 0.28 0.00 0.00 0.00 0.00 44.72 45.71 1oyj s GLY 155 CO 0.78 1.88 1.96 0.61 0.00 0.00 0.00 173.10 178.32 1oyj n GLY 156 N 2.91 -1.32 0.22 0.20 0.00 -1.26 -4.35 105.19 101.59 1oyj n GLY 156 Ca 0.07 -0.12 0.08 0.00 0.00 0.00 0.00 46.02 46.05 1oyj n GLY 156 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyj n GLY 157 N 1.23 -0.89 2.16 -0.02 0.00 -1.26 -4.68 105.19 101.73 1oyj n GLY 157 Ca 0.11 0.63 -0.06 0.00 0.00 0.00 0.00 46.02 46.69 1oyj n GLY 157 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyj n GLY 158 N -1.33 0.61 0.01 -0.02 0.00 -1.26 -4.91 105.19 98.29 1oyj n GLY 158 Ca 0.14 -0.73 0.12 0.00 0.00 0.00 0.00 46.02 45.55 1oyj n GLY 158 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyj n GLY 159 N -1.83 -1.24 2.16 -0.02 0.00 -1.26 -4.94 105.19 98.06 1oyj n GLY 159 Ca -0.07 -0.36 -0.07 0.00 0.00 0.00 0.00 46.02 45.52 1oyj n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyj n GLY 160 N 1.48 0.44 3.21 -0.02 0.00 -1.26 -5.02 105.19 104.02 1oyj n GLY 160 Ca 0.05 -0.66 -0.12 0.00 0.00 0.00 0.00 46.02 45.29 1oyj n GLY 160 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1oyj s ARG 161 N -3.57 1.15 0.07 1.61 1.70 -1.26 -5.10 118.95 113.54 1oyj s ARG 161 Ca 0.00 -1.59 -0.33 0.00 -0.47 0.00 0.00 55.73 53.34 1oyj s ARG 161 Cb 0.00 0.15 -0.12 0.00 -0.57 0.00 0.00 34.95 34.40 1oyj s ARG 161 CO 0.00 -0.32 1.74 1.28 -1.08 0.00 0.00 175.30 176.91 1oyj n LEU 162 N -0.25 3.42 0.00 -1.89 4.77 -1.26 -4.83 117.00 116.96 1oyj n LEU 162 Ca -0.01 1.03 -0.13 0.00 -0.03 0.00 0.00 56.01 56.86 1oyj n LEU 162 Cb 0.65 -1.43 0.05 0.00 -2.33 0.00 0.00 43.42 40.36 1oyj n LEU 162 CO 0.33 -0.11 0.26 0.61 -1.33 0.00 0.00 177.39 177.15 1oyj n GLY 163 N 3.92 1.88 0.24 -0.72 0.00 -1.26 -4.80 105.19 104.46 1oyj n GLY 163 Ca 0.19 -2.19 0.02 0.00 0.00 0.00 0.00 46.02 44.04 1oyj n GLY 163 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1oyj h PHE 164 N 0.03 -0.04 -0.25 1.61 3.57 -1.43 -0.80 116.94 119.63 1oyj h PHE 164 Ca -0.19 0.05 -0.19 0.00 3.53 0.00 0.00 57.97 61.17 1oyj h PHE 164 Cb 0.85 0.12 0.00 0.00 2.79 0.00 0.00 35.95 39.71 1oyj h PHE 164 CO 0.00 -0.18 -0.58 0.28 -2.23 0.00 0.00 178.31 175.60 1oyj h VAL 165 N 0.12 1.28 -0.76 1.41 2.07 -1.86 -0.73 116.25 117.78 1oyj h VAL 165 Ca 0.34 -1.77 0.04 0.00 0.82 0.00 0.00 66.70 66.13 1oyj h VAL 165 Cb 0.56 1.74 -0.05 0.00 -1.52 0.00 0.00 31.29 32.02 1oyj h VAL 165 CO -0.55 0.57 0.47 0.44 0.02 0.00 0.00 177.57 178.52 1oyj h ASP 166 N 0.60 0.77 -0.15 0.57 3.32 -1.75 -0.72 116.42 119.05 1oyj h ASP 166 Ca -0.00 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 56.83 1oyj h ASP 166 Cb 1.20 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 40.60 1oyj h ASP 166 CO 0.13 0.52 -0.76 0.58 -1.72 0.00 0.00 179.24 177.99 1oyj h VAL 167 N 0.91 1.28 -0.62 -1.35 2.07 -1.02 1.00 116.25 118.52 1oyj h VAL 167 Ca 0.31 -1.96 0.06 0.00 0.82 0.00 0.00 66.70 65.93 1oyj h VAL 167 Cb 0.06 2.01 -0.04 0.00 -1.52 0.00 0.00 31.29 31.80 1oyj h VAL 167 CO -0.13 0.62 0.41 0.00 0.02 0.00 0.00 177.57 178.50 1oyj h ALA 168 N 0.54 1.81 0.03 1.67 0.00 -0.85 -3.30 119.26 119.15 1oyj h ALA 168 Ca -0.05 -0.02 -0.35 0.00 0.00 0.00 0.00 54.91 54.49 1oyj h ALA 168 Cb 1.40 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.98 1oyj h ALA 168 CO 0.16 0.09 -2.10 -0.11 0.00 0.00 0.00 179.25 177.29 1oyj n LEU 169 N -4.48 1.36 -0.30 0.00 7.94 -0.30 -4.57 117.00 116.66 1oyj n LEU 169 Ca 0.09 0.16 0.24 0.00 -1.11 0.00 0.00 56.01 55.38 1oyj n LEU 169 Cb 0.24 -0.20 0.54 0.00 0.53 0.00 0.00 43.42 44.54 1oyj n LEU 169 CO 0.34 0.61 1.23 1.62 -1.11 0.00 0.00 177.39 180.09 1oyj h VAL 170 N 0.02 0.55 -0.19 1.96 3.04 -0.88 -0.71 116.25 120.04 1oyj h VAL 170 Ca -0.44 -0.12 -0.03 0.00 -1.01 0.00 0.00 66.70 65.10 1oyj h VAL 170 Cb 2.07 0.18 -0.01 0.00 -2.01 0.00 0.00 31.29 31.51 1oyj h VAL 170 CO 0.04 0.06 -0.01 -0.65 -1.01 0.00 0.00 177.57 176.00 1oyj h PRO 171 N 0.34 0.27 0.00 4.17 0.11 -1.81 -1.39 132.00 133.69 1oyj h PRO 171 Ca 0.56 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.63 1oyj h PRO 171 Cb 1.53 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.59 1oyj h PRO 171 CO -0.23 0.31 0.00 0.74 -0.21 0.00 0.00 178.00 178.61 1oyj h PHE 172 N 0.27 0.00 -0.03 0.65 -1.00 -1.43 -2.17 116.94 113.22 1oyj h PHE 172 Ca 0.06 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.85 1oyj h PHE 172 Cb 0.20 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.76 1oyj h PHE 172 CO 0.00 0.00 0.04 1.79 -1.61 0.00 0.00 178.31 178.53 1oyj h THR 173 N 0.00 0.44 0.00 -1.55 1.35 -1.32 0.37 112.91 112.20 1oyj h THR 173 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1oyj h THR 173 Cb 0.27 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 1oyj h THR 173 CO 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.27 1oyj h ALA 174 N 1.95 1.00 -0.01 6.62 0.00 -1.55 -2.76 119.26 124.51 1oyj h ALA 174 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1oyj h ALA 174 Cb 0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1oyj h ALA 174 CO -0.00 0.00 -0.55 0.91 0.00 0.00 0.00 179.25 179.61 1oyj n TRP 175 N -2.39 0.00 -0.25 0.00 7.02 0.09 -4.24 117.44 117.67 1oyj n TRP 175 Ca 0.03 0.00 -0.01 0.00 -1.02 0.00 0.00 57.50 56.50 1oyj n TRP 175 Cb 0.33 -0.01 0.11 0.00 -2.42 0.00 0.00 31.31 29.32 1oyj n TRP 175 CO 0.00 0.00 0.00 0.74 -2.02 0.00 0.00 177.69 176.41 1oyj h PHE 176 N 1.92 0.74 -0.56 -5.99 -1.00 -1.17 -0.78 116.94 110.10 1oyj h PHE 176 Ca 0.00 0.03 0.01 0.00 2.81 0.00 0.00 57.97 60.82 1oyj h PHE 176 Cb 0.69 -0.23 -0.03 0.00 3.61 0.00 0.00 35.95 39.99 1oyj h PHE 176 CO 0.00 0.36 0.36 -0.92 -1.61 0.00 0.00 178.31 176.50 1oyj h TYR 177 N 0.74 0.67 -0.99 -0.55 3.20 -1.80 0.66 116.97 118.90 1oyj h TYR 177 Ca 0.31 0.02 0.01 0.00 3.14 0.00 0.00 58.73 62.21 1oyj h TYR 177 Cb 0.18 -0.22 -0.05 0.00 1.54 0.00 0.00 36.73 38.18 1oyj h TYR 177 CO -0.07 0.41 0.64 0.77 -1.64 0.00 0.00 178.16 178.27 1oyj h SER 178 N 0.72 1.16 -0.43 -2.11 0.02 -1.63 -0.92 113.55 110.35 1oyj h SER 178 Ca 0.21 -0.04 -0.11 0.00 -0.84 0.00 0.00 61.79 61.01 1oyj h SER 178 Cb -0.04 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.19 1oyj h SER 178 CO -0.06 0.85 -0.13 1.88 -1.14 0.00 0.00 176.83 178.22 1oyj h TYR 179 N 1.35 1.00 -0.48 3.45 0.05 0.08 -0.33 116.97 122.10 1oyj h TYR 179 Ca 0.36 -0.21 -0.01 0.00 0.05 0.00 0.00 58.73 58.93 1oyj h TYR 179 Cb -0.13 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 37.34 1oyj h TYR 179 CO 0.00 0.97 0.26 0.93 -1.05 0.00 0.00 178.16 179.27 1oyj h GLU 180 N 0.80 0.67 -0.07 4.88 5.08 -0.44 0.45 114.58 125.95 1oyj h GLU 180 Ca 0.12 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.34 1oyj h GLU 180 Cb 0.67 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1oyj h GLU 180 CO 0.05 0.52 -0.23 0.00 -1.00 0.00 0.00 179.01 178.36 1oyj h ARG 181 N 0.63 0.27 0.01 2.33 2.47 -0.93 -1.74 114.38 117.42 1oyj h ARG 181 Ca 0.17 -0.20 -0.19 0.00 -1.26 0.00 0.00 59.98 58.49 1oyj h ARG 181 Cb 0.05 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.38 1oyj h ARG 181 CO -0.03 0.83 -0.90 0.00 0.56 0.00 0.00 179.97 180.43 1oyj n GLY 183 N 1.02 -0.82 2.23 0.00 0.00 0.16 -4.80 105.19 102.97 1oyj n GLY 183 Ca -0.01 -0.43 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 1oyj n GLY 183 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oyj n GLY 184 N 1.42 0.07 3.30 -0.02 0.00 -0.67 -4.47 105.19 104.82 1oyj n GLY 184 Ca 0.09 -0.44 -0.16 0.00 0.00 0.00 0.00 46.02 45.50 1oyj n GLY 184 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1oyj s PHE 185 N -2.63 1.45 -0.09 1.61 -0.12 -1.11 -5.06 117.98 112.02 1oyj s PHE 185 Ca 0.07 -1.50 0.02 0.00 -0.05 0.00 0.00 56.93 55.46 1oyj s PHE 185 Cb -0.03 -0.56 0.01 0.00 -0.63 0.00 0.00 43.02 41.82 1oyj s PHE 185 CO 0.08 -0.84 -0.14 0.45 -0.05 0.00 0.00 175.22 174.72 1oyj s SER 186 N -3.28 2.20 0.36 1.98 0.15 -1.26 -4.41 113.70 109.44 1oyj s SER 186 Ca 0.38 -0.37 0.04 0.00 0.70 0.00 0.00 55.95 56.70 1oyj s SER 186 Cb 0.03 -0.99 0.68 0.00 -1.71 0.00 0.00 66.02 64.04 1oyj s SER 186 CO 0.21 0.02 1.96 0.58 1.20 0.00 0.00 173.24 177.22 1oyj h VAL 187 N 5.97 1.16 -0.59 4.45 2.07 -1.94 -0.63 116.25 126.74 1oyj h VAL 187 Ca -0.30 -0.48 -0.05 0.00 0.82 0.00 0.00 66.70 66.69 1oyj h VAL 187 Cb 1.18 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 1oyj h VAL 187 CO 0.47 0.19 0.16 -0.08 0.02 0.00 0.00 177.57 178.33 1oyj h GLU 188 N 0.62 0.91 0.01 1.57 4.57 -1.93 0.28 114.58 120.60 1oyj h GLU 188 Ca 0.15 -0.19 -0.20 0.00 -1.18 0.00 0.00 59.36 57.95 1oyj h GLU 188 Cb 0.10 -0.14 0.02 0.00 -0.16 0.00 0.00 28.75 28.57 1oyj h GLU 188 CO -0.02 0.80 -0.79 1.49 -1.18 0.00 0.00 179.01 179.31 1oyj h GLU 189 N 0.87 0.53 0.00 1.92 4.57 -1.82 -3.21 114.58 117.43 1oyj h GLU 189 Ca 0.19 -0.57 -0.04 0.00 -1.18 0.00 0.00 59.36 57.76 1oyj h GLU 189 Cb 0.29 0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.04 1oyj h GLU 189 CO -0.00 1.20 -1.00 -0.39 -1.18 0.00 0.00 179.01 177.63 1oyj h VAL 190 N 0.09 0.13 -0.84 0.32 -1.51 -0.88 -3.41 116.25 110.14 1oyj h VAL 190 Ca -0.10 -1.25 -0.35 0.00 -1.23 0.00 0.00 66.70 63.77 1oyj h VAL 190 Cb 1.48 1.68 -0.25 0.00 -2.13 0.00 0.00 31.29 32.07 1oyj h VAL 190 CO 0.16 0.08 -0.76 0.00 -1.23 0.00 0.00 177.57 175.81 1oyj n ALA 191 N -2.22 0.34 -0.31 5.19 0.00 0.95 -4.64 120.51 119.81 1oyj n ALA 191 Ca -0.02 -2.27 0.16 0.00 0.00 0.00 0.00 53.44 51.31 1oyj n ALA 191 Cb 0.62 -1.08 0.40 0.00 0.00 0.00 0.00 19.45 19.39 1oyj n ALA 191 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1oyj h PRO 192 N 3.21 0.60 -0.02 0.00 0.13 -1.55 -1.33 132.00 133.04 1oyj h PRO 192 Ca -0.03 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 64.95 1oyj h PRO 192 Cb 1.03 -0.14 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 1oyj h PRO 192 CO 0.31 0.40 -0.53 0.00 -0.23 0.00 0.00 178.00 177.95 1oyj h ARG 193 N 0.62 0.07 -0.21 0.86 3.08 -1.90 -1.02 114.38 115.87 1oyj h ARG 193 Ca 0.53 -0.04 -0.18 0.00 0.07 0.00 0.00 59.98 60.37 1oyj h ARG 193 Cb 1.02 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.07 1oyj h ARG 193 CO -0.29 0.58 -0.58 1.25 -1.07 0.00 0.00 179.97 179.86 1oyj h LEU 194 N 0.05 0.77 -0.80 3.04 5.85 -1.62 -0.89 115.31 121.71 1oyj h LEU 194 Ca -0.00 -0.43 0.02 0.00 0.84 0.00 0.00 57.88 58.31 1oyj h LEU 194 Cb 0.95 -0.22 -0.04 0.00 0.37 0.00 0.00 40.66 41.71 1oyj h LEU 194 CO 0.07 1.18 0.52 0.00 -0.34 0.00 0.00 178.44 179.87 1oyj h ALA 195 N 0.83 1.04 -0.51 1.25 0.00 -0.96 0.66 119.26 121.56 1oyj h ALA 195 Ca 0.00 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1oyj h ALA 195 Cb 1.16 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.64 1oyj h ALA 195 CO 0.12 0.37 -0.03 0.00 0.00 0.00 0.00 179.25 179.71 1oyj h ALA 196 N 1.32 0.97 -0.64 0.00 0.00 -0.95 -1.21 119.26 118.76 1oyj h ALA 196 Ca 0.31 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.85 1oyj h ALA 196 Cb -0.05 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1oyj h ALA 196 CO -0.09 0.62 0.12 2.35 0.00 0.00 0.00 179.25 182.24 1oyj h TRP 197 N 0.82 1.11 -1.00 0.00 7.01 -0.67 -1.01 115.95 122.21 1oyj h TRP 197 Ca 0.15 -0.15 0.02 0.00 2.11 0.00 0.00 58.89 61.02 1oyj h TRP 197 Cb 0.53 -0.31 -0.05 0.00 -2.10 0.00 0.00 29.16 27.23 1oyj h TRP 197 CO 0.03 0.94 0.66 0.00 -2.79 0.00 0.00 178.44 177.28 1oyj h ALA 198 N 1.04 1.31 -0.24 2.65 0.00 0.02 -0.60 119.26 123.44 1oyj h ALA 198 Ca 0.20 -0.06 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 1oyj h ALA 198 Cb 0.41 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1oyj h ALA 198 CO 0.01 0.63 -0.49 0.00 0.00 0.00 0.00 179.25 179.40 1oyj h ARG 199 N 1.33 0.76 0.14 0.00 3.08 -0.78 -1.68 114.38 117.23 1oyj h ARG 199 Ca 0.38 -0.49 0.01 0.00 0.07 0.00 0.00 59.98 59.94 1oyj h ARG 199 Cb -0.11 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 29.99 1oyj h ARG 199 CO -0.09 1.12 -0.15 -0.09 -1.07 0.00 0.00 179.97 179.68 1oyj h ARG 200 N 0.49 -0.32 -0.63 0.04 2.43 -0.85 -2.85 114.38 112.69 1oyj h ARG 200 Ca 0.01 0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.25 1oyj h ARG 200 Cb 1.10 0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.69 1oyj h ARG 200 CO 0.11 -0.21 0.41 0.00 -1.51 0.00 0.00 179.97 178.77 1oyj n GLY 202 N -1.46 -0.57 0.40 0.00 0.00 -0.64 -0.84 105.19 102.09 1oyj n GLY 202 Ca 0.08 -0.01 0.11 0.00 0.00 0.00 0.00 46.02 46.20 1oyj n GLY 202 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oyj n ARG 203 N -1.44 1.03 -3.03 1.61 1.74 -0.62 -4.54 116.66 111.41 1oyj n ARG 203 Ca 0.01 -0.80 -0.40 0.00 -0.77 0.00 0.00 57.85 55.89 1oyj n ARG 203 Cb 0.04 -1.48 -0.05 0.00 -1.02 0.00 0.00 32.46 29.94 1oyj n ARG 203 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1oyj s ILE 204 N -2.52 4.71 0.21 0.55 1.01 -0.02 -4.92 121.20 120.22 1oyj s ILE 204 Ca 0.19 1.56 -0.10 0.00 0.00 0.00 0.00 60.65 62.30 1oyj s ILE 204 Cb 0.18 -4.08 0.14 0.00 0.01 0.00 0.00 42.46 38.71 1oyj s ILE 204 CO 0.58 0.40 1.85 0.44 0.00 0.00 0.00 174.94 178.21 1oyj h ASP 205 N 5.45 0.73 -0.07 3.58 3.45 -1.91 0.12 116.42 127.76 1oyj h ASP 205 Ca -0.45 -0.00 -0.02 0.00 0.43 0.00 0.00 57.03 56.99 1oyj h ASP 205 Cb 1.20 -0.16 -0.01 0.00 -0.56 0.00 0.00 39.33 39.80 1oyj h ASP 205 CO 0.70 0.51 0.00 0.77 -1.57 0.00 0.00 179.24 179.65 1oyj h SER 206 N 0.87 0.19 0.22 6.45 4.64 -1.92 0.11 113.55 124.10 1oyj h SER 206 Ca 0.28 -0.02 -0.34 0.00 -0.47 0.00 0.00 61.79 61.24 1oyj h SER 206 Cb -0.00 -0.05 0.02 0.00 -0.31 0.00 0.00 62.40 62.06 1oyj h SER 206 CO -0.10 0.22 -1.59 0.58 -0.87 0.00 0.00 176.83 175.08 1oyj h VAL 207 N 0.21 1.11 -0.74 0.95 2.07 -1.30 -2.50 116.25 116.05 1oyj h VAL 207 Ca 0.05 -2.59 -0.00 0.00 0.82 0.00 0.00 66.70 64.98 1oyj h VAL 207 Cb 0.14 2.91 -0.04 0.00 -1.52 0.00 0.00 31.29 32.78 1oyj h VAL 207 CO 0.00 0.83 0.45 0.58 0.02 0.00 0.00 177.57 179.45 1oyj h VAL 208 N 0.09 1.21 -0.58 2.57 2.07 -0.50 -1.65 116.25 119.46 1oyj h VAL 208 Ca -0.30 -0.44 -0.04 0.00 0.82 0.00 0.00 66.70 66.73 1oyj h VAL 208 Cb 2.11 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1oyj h VAL 208 CO 0.22 0.21 0.19 0.50 0.02 0.00 0.00 177.57 178.71 1oyj h LYS 209 N 1.01 0.90 -0.01 1.57 3.64 -0.79 -3.35 116.57 119.54 1oyj h LYS 209 Ca 0.27 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1oyj h LYS 209 Cb -0.05 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 1oyj h LYS 209 CO -0.05 0.80 -0.35 0.72 -2.27 0.00 0.00 179.45 178.30 1oyj n HIS 210 N -4.43 0.00 -3.80 1.91 8.25 -0.94 -4.92 115.22 111.29 1oyj n HIS 210 Ca 0.03 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.13 1oyj n HIS 210 Cb 0.20 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.24 1oyj n HIS 210 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1oyj s LEU 211 N -2.03 4.34 0.83 2.41 1.43 -0.64 -4.94 118.68 120.08 1oyj s LEU 211 Ca 0.11 0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 53.54 1oyj s LEU 211 Cb 0.12 -2.12 0.09 0.00 0.03 0.00 0.00 46.19 44.31 1oyj s LEU 211 CO 0.40 0.33 1.10 -2.16 0.23 0.00 0.00 176.35 176.25 1oyj s PRO 212 N -0.60 1.79 0.76 1.29 0.04 -1.26 -4.90 135.00 132.11 1oyj s PRO 212 Ca 0.14 0.65 -0.11 0.00 0.04 0.00 0.00 61.00 61.72 1oyj s PRO 212 Cb -0.12 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 32.58 1oyj s PRO 212 CO 0.03 -1.83 1.08 -1.54 0.04 0.00 0.00 177.00 174.78 1oyj s SER 213 N -3.80 4.76 0.33 6.66 1.04 -1.26 -4.84 113.70 116.59 1oyj s SER 213 Ca 0.62 1.61 0.01 0.00 0.48 0.00 0.00 55.95 58.67 1oyj s SER 213 Cb -0.15 -2.39 0.56 0.00 0.10 0.00 0.00 66.02 64.13 1oyj s SER 213 CO 0.55 -1.84 1.96 -0.65 0.98 0.00 0.00 173.24 174.24 1oyj h PRO 214 N -0.99 0.85 -0.42 4.02 0.11 -1.93 -1.68 132.00 131.97 1oyj h PRO 214 Ca -0.45 -0.08 -0.13 0.00 0.11 0.00 0.00 66.00 65.45 1oyj h PRO 214 Cb 1.23 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 1oyj h PRO 214 CO 0.55 0.62 -0.25 0.93 -0.21 0.00 0.00 178.00 179.64 1oyj h GLU 215 N 0.86 0.87 -0.68 1.05 3.07 -1.92 -0.73 114.58 117.11 1oyj h GLU 215 Ca 0.22 -0.38 -0.06 0.00 -0.50 0.00 0.00 59.36 58.64 1oyj h GLU 215 Cb 0.00 -0.03 -0.03 0.00 -0.84 0.00 0.00 28.75 27.86 1oyj h GLU 215 CO -0.04 1.03 0.19 -0.22 -1.40 0.00 0.00 179.01 178.57 1oyj h LYS 216 N 0.75 1.06 -0.52 2.33 3.64 -1.75 -1.95 116.57 120.14 1oyj h LYS 216 Ca 0.09 -0.24 -0.12 0.00 -1.27 0.00 0.00 60.65 59.11 1oyj h LYS 216 Cb 0.80 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 32.46 1oyj h LYS 216 CO 0.07 0.93 -0.15 0.28 -2.27 0.00 0.00 179.45 178.32 1oyj h VAL 217 N 1.00 1.27 -0.84 2.00 2.07 -1.05 -2.18 116.25 118.51 1oyj h VAL 217 Ca 0.22 -1.30 0.03 0.00 0.82 0.00 0.00 66.70 66.47 1oyj h VAL 217 Cb 0.33 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 1oyj h VAL 217 CO -0.00 0.46 0.54 0.22 0.02 0.00 0.00 177.57 178.81 1oyj h TYR 218 N 0.88 1.02 -0.55 1.57 3.20 -0.88 0.63 116.97 122.84 1oyj h TYR 218 Ca 0.13 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 61.98 1oyj h TYR 218 Cb 0.71 -0.34 -0.03 0.00 1.54 0.00 0.00 36.73 38.62 1oyj h TYR 218 CO 0.05 0.59 0.17 -0.44 -1.64 0.00 0.00 178.16 176.88 1oyj h ASP 219 N 1.06 0.76 -0.57 -2.11 3.32 -1.06 -1.49 116.42 116.32 1oyj h ASP 219 Ca 0.34 -0.12 -0.10 0.00 0.02 0.00 0.00 57.03 57.17 1oyj h ASP 219 Cb -0.00 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1oyj h ASP 219 CO -0.11 0.72 -0.04 0.15 -1.72 0.00 0.00 179.24 178.24 1oyj h PHE 220 N 0.80 1.14 -0.78 4.55 3.57 -0.52 -2.51 116.94 123.19 1oyj h PHE 220 Ca 0.18 -0.21 0.03 0.00 3.53 0.00 0.00 57.97 61.50 1oyj h PHE 220 Cb 0.24 -0.29 -0.05 0.00 2.79 0.00 0.00 35.95 38.64 1oyj h PHE 220 CO 0.01 1.02 0.50 0.28 -2.23 0.00 0.00 178.31 177.90 1oyj h VAL 221 N 0.94 1.12 -0.64 1.41 2.07 -0.54 0.11 116.25 120.72 1oyj h VAL 221 Ca 0.16 -0.33 0.07 0.00 0.82 0.00 0.00 66.70 67.41 1oyj h VAL 221 Cb 0.59 0.07 -0.06 0.00 -1.52 0.00 0.00 31.29 30.37 1oyj h VAL 221 CO 0.04 0.18 0.34 1.23 0.02 0.00 0.00 177.57 179.37 1oyj h GLY 222 N 0.97 0.94 1.31 2.17 0.00 -0.95 1.01 103.07 108.53 1oyj h GLY 222 Ca 0.31 -0.23 -0.16 0.00 0.00 0.00 0.00 47.33 47.25 1oyj h GLY 222 CO -0.11 0.12 -0.47 -0.39 0.00 0.00 0.00 176.54 175.69 1oyj h VAL 223 N 0.61 1.29 -0.28 4.60 -1.51 -0.85 -2.31 116.25 117.81 1oyj h VAL 223 Ca 0.30 -1.66 0.04 0.00 -1.23 0.00 0.00 66.70 64.14 1oyj h VAL 223 Cb 0.22 1.57 -0.04 0.00 -2.13 0.00 0.00 31.29 30.92 1oyj h VAL 223 CO -0.20 0.53 0.05 -0.07 -1.23 0.00 0.00 177.57 176.65 1oyj h LEU 224 N 0.59 0.00 -0.45 4.19 3.38 0.22 -2.56 115.31 120.67 1oyj h LEU 224 Ca 0.03 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 1oyj h LEU 224 Cb 1.03 0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.82 1oyj h LEU 224 CO 0.10 0.04 0.25 0.50 0.09 0.00 0.00 178.44 179.42 1oyj h LYS 225 N 0.15 0.63 0.00 1.13 3.64 0.14 0.47 116.57 122.73 1oyj h LYS 225 Ca 0.13 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.40 1oyj h LYS 225 Cb 0.14 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 1oyj h LYS 225 CO -0.17 0.50 -0.18 0.87 -2.27 0.00 0.00 179.45 178.19 1oyj h LYS 226 N 0.59 0.00 0.02 1.90 1.57 -1.31 0.11 116.57 119.45 1oyj h LYS 226 Ca 0.16 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.90 1oyj h LYS 226 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1oyj h LYS 226 CO -0.03 0.18 -0.17 -0.22 -0.57 0.00 0.00 179.45 178.64 1oyj h LYS 227 N 0.00 0.04 -0.17 3.15 3.64 -0.91 -3.28 116.57 119.04 1oyj h LYS 227 Ca -0.00 -0.07 -0.04 0.00 -1.27 0.00 0.00 60.65 59.27 1oyj h LYS 227 Cb 0.32 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 1oyj h LYS 227 CO 0.02 1.03 -0.07 1.88 -2.27 0.00 0.00 179.45 180.05 1oyj h TYR 228 N -0.91 0.26 0.00 1.91 0.99 -0.87 -3.52 116.97 114.84 1oyj h TYR 228 Ca -0.03 -0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.67 1oyj h TYR 228 Cb 1.10 -0.08 0.00 0.00 1.00 0.00 0.00 36.73 38.76 1oyj h TYR 228 CO 0.26 0.33 0.00 0.41 -0.00 0.00 0.00 178.16 179.16