#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y9j h SER 9 N 0.00 0.78 0.70 0.00 0.02 -2.06 -2.05 113.55 110.94 1y9j h SER 9 Ca 0.00 -0.05 -0.03 0.00 -0.84 0.00 0.00 61.79 60.86 1y9j h SER 9 Cb 0.00 -0.20 0.01 0.00 0.14 0.00 0.00 62.40 62.35 1y9j h SER 9 CO 0.00 0.62 -0.34 0.40 -1.14 0.00 0.00 176.83 176.38 1y9j h ILE 10 N 0.90 0.10 -0.87 3.27 5.03 -2.00 -2.65 117.51 121.29 1y9j h ILE 10 Ca 0.23 -0.28 0.23 0.00 -0.12 0.00 0.00 64.86 64.93 1y9j h ILE 10 Cb 0.00 0.14 -0.04 0.00 -3.03 0.00 0.00 36.82 33.89 1y9j h ILE 10 CO -0.04 0.01 0.61 -0.09 -0.68 0.00 0.00 178.15 177.96 1y9j h ARG 11 N -1.19 0.12 0.36 2.37 9.65 -1.95 -0.67 114.38 123.07 1y9j h ARG 11 Ca -0.10 -0.01 -0.02 0.00 -1.10 0.00 0.00 59.98 58.76 1y9j h ARG 11 Cb 0.74 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.30 1y9j h ARG 11 CO 0.16 0.08 -0.17 0.93 2.80 0.00 0.00 179.97 183.76 1y9j h GLU 12 N 0.12 -0.46 -1.08 0.20 5.08 -1.20 -2.60 114.58 114.65 1y9j h GLU 12 Ca 0.43 0.03 0.29 0.00 -1.00 0.00 0.00 59.36 59.11 1y9j h GLU 12 Cb 1.49 0.11 -0.10 0.00 0.50 0.00 0.00 28.75 30.75 1y9j h GLU 12 CO -0.06 -0.23 0.70 0.00 -1.00 0.00 0.00 179.01 178.41 1y9j h ARG 13 N -0.60 0.33 -0.03 2.33 -0.00 -0.76 0.19 114.38 115.83 1y9j h ARG 13 Ca -0.05 -0.02 0.02 0.00 -0.50 0.00 0.00 59.98 59.43 1y9j h ARG 13 Cb 0.44 -0.07 -0.02 0.00 0.00 0.00 0.00 29.97 30.31 1y9j h ARG 13 CO 0.08 0.22 -0.09 1.96 0.00 0.00 0.00 179.97 182.13 1y9j h GLN 14 N 0.34 -0.14 0.00 0.04 4.20 -1.27 -1.91 115.11 116.37 1y9j h GLN 14 Ca 0.63 0.01 -0.06 0.00 0.06 0.00 0.00 58.65 59.29 1y9j h GLN 14 Cb 1.68 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.48 1y9j h GLN 14 CO -0.31 -0.10 -0.29 1.79 -0.67 0.00 0.00 178.83 179.26 1y9j h THR 15 N -0.15 0.81 0.27 -0.54 1.35 -0.61 -3.03 112.91 111.01 1y9j h THR 15 Ca 0.05 -1.18 -0.00 0.00 -0.55 0.00 0.00 66.41 64.72 1y9j h THR 15 Cb 0.21 1.72 -0.02 0.00 -1.73 0.00 0.00 68.15 68.33 1y9j h THR 15 CO -0.11 0.28 -0.36 0.58 -0.25 0.00 0.00 175.52 175.66 1y9j h VAL 16 N 0.00 0.00 -0.68 6.82 2.07 -0.25 1.12 116.25 125.33 1y9j h VAL 16 Ca -0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.54 1y9j h VAL 16 Cb 0.70 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 30.43 1y9j h VAL 16 CO 0.04 0.00 0.45 0.00 0.02 0.00 0.00 177.57 178.07 1y9j h ALA 17 N -1.07 1.59 0.23 1.67 0.00 -1.58 0.11 119.26 120.22 1y9j h ALA 17 Ca -0.03 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1y9j h ALA 17 Cb 0.59 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1y9j h ALA 17 CO -0.09 0.34 -0.11 -0.07 0.00 0.00 0.00 179.25 179.32 1y9j h LEU 18 N 0.84 -0.26 -1.44 0.00 3.38 -1.29 -1.30 115.31 115.24 1y9j h LEU 18 Ca 0.26 0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.42 1y9j h LEU 18 Cb 0.02 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 1y9j h LEU 18 CO -0.07 -0.14 0.57 0.11 0.09 0.00 0.00 178.44 179.00 1y9j h LYS 19 N -0.40 0.48 0.31 1.13 1.57 0.13 1.34 116.57 121.13 1y9j h LYS 19 Ca -0.03 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.70 1y9j h LYS 19 Cb 0.24 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 32.44 1y9j h LYS 19 CO 0.05 0.32 -0.15 -0.09 -0.57 0.00 0.00 179.45 179.01 1y9j h ARG 20 N 0.50 -0.40 0.00 3.15 2.43 -0.76 0.59 114.38 119.89 1y9j h ARG 20 Ca 0.45 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1y9j h ARG 20 Cb 0.98 0.09 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 1y9j h ARG 20 CO -0.18 -0.21 -0.08 0.00 -1.51 0.00 0.00 179.97 177.98 1y9j n MET 21 N -5.23 0.11 0.01 0.20 0.00 -0.49 -0.71 117.12 111.00 1y9j n MET 21 Ca -0.10 0.08 0.11 0.00 0.00 0.00 0.00 57.70 57.79 1y9j n MET 21 Cb 0.21 -1.62 -0.01 0.00 0.00 0.00 0.00 33.22 31.79 1y9j n MET 21 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 175.97 177.25 1y9j n LEU 22 N -1.81 0.72 0.00 3.17 4.77 0.45 -4.60 117.00 119.71 1y9j n LEU 22 Ca 0.06 -0.24 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 1y9j n LEU 22 Cb 0.38 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 1y9j n LEU 22 CO 0.29 0.15 -0.48 0.59 -1.33 0.00 0.00 177.39 176.61 1y9j n ASN 23 N -1.68 2.43 -4.54 -1.43 5.03 0.21 -4.90 115.26 110.38 1y9j n ASN 23 Ca 0.03 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.06 1y9j n ASN 23 Cb 0.38 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 39.11 1y9j n ASN 23 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 1y9j s PHE 24 N -1.98 2.43 0.20 3.10 5.36 0.11 -4.99 117.98 122.20 1y9j s PHE 24 Ca 0.00 -0.06 -0.30 0.00 -0.96 0.00 0.00 56.93 55.62 1y9j s PHE 24 Cb 0.00 -4.52 -0.08 0.00 -0.34 0.00 0.00 43.02 38.07 1y9j s PHE 24 CO 0.00 -1.89 1.17 0.54 -1.46 0.00 0.00 175.22 173.58 1y9j s ASN 25 N 3.55 7.14 0.44 6.13 4.22 -1.26 -4.70 114.94 130.47 1y9j s ASN 25 Ca 0.34 2.21 -0.23 0.00 -2.14 0.00 0.00 52.86 53.04 1y9j s ASN 25 Cb -0.10 -2.61 -0.08 0.00 1.28 0.00 0.00 41.25 39.74 1y9j s ASN 25 CO 0.16 -0.31 1.12 0.68 -2.04 0.00 0.00 177.10 176.71 1y9j s VAL 26 N -0.25 3.34 -0.25 3.54 -7.23 -1.26 -4.91 120.40 113.38 1y9j s VAL 26 Ca 0.51 1.00 -0.38 0.00 -1.81 0.00 0.00 61.98 61.30 1y9j s VAL 26 Cb -0.32 -3.51 -0.14 0.00 0.56 0.00 0.00 36.38 32.97 1y9j s VAL 26 CO 0.37 -0.01 1.83 -2.65 -0.31 0.00 0.00 175.10 174.33 1y9j n PRO 27 N -0.35 1.35 -4.44 4.82 -0.02 -1.26 -4.97 135.00 130.13 1y9j n PRO 27 Ca 0.07 0.49 -0.24 0.00 -2.02 0.00 0.00 63.50 61.79 1y9j n PRO 27 Cb 0.49 -2.25 -0.10 0.00 -0.02 0.00 0.00 33.50 31.61 1y9j n PRO 27 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1y9j s HIS 28 N 4.12 2.19 -0.63 6.00 2.46 -1.26 -5.08 115.29 123.09 1y9j s HIS 28 Ca 0.99 -0.37 -0.27 0.00 0.47 0.00 0.00 55.06 55.87 1y9j s HIS 28 Cb -0.97 -0.99 0.00 0.00 -0.13 0.00 0.00 32.58 30.49 1y9j s HIS 28 CO 0.61 0.61 1.61 0.08 -2.47 0.00 0.00 174.74 175.18 1y9j s VAL 29 N -2.38 3.54 -0.30 0.89 1.01 -1.26 -4.97 120.40 116.93 1y9j s VAL 29 Ca 0.26 0.35 -0.09 0.00 0.00 0.00 0.00 61.98 62.51 1y9j s VAL 29 Cb -0.05 -4.31 -0.00 0.00 0.00 0.00 0.00 36.38 32.01 1y9j s VAL 29 CO 0.12 -1.23 0.12 -1.59 0.00 0.00 0.00 175.10 172.53 1y9j s LYS 30 N 6.35 3.30 0.02 2.72 -2.85 -1.26 -4.95 119.74 123.07 1y9j s LYS 30 Ca 0.55 -0.73 0.08 0.00 -1.00 0.00 0.00 55.97 54.87 1y9j s LYS 30 Cb -0.11 -3.49 -0.23 0.00 -2.06 0.00 0.00 37.83 31.94 1y9j s LYS 30 CO 0.20 -0.40 0.90 -0.97 0.10 0.00 0.00 175.35 175.18 1y9j h ASN 31 N 8.31 0.05 -2.86 0.03 -1.24 -2.04 -3.43 115.58 114.40 1y9j h ASN 31 Ca -0.33 -0.08 -0.53 0.00 0.71 0.00 0.00 56.30 56.07 1y9j h ASN 31 Cb 1.14 -0.02 -0.40 0.00 0.73 0.00 0.00 38.32 39.78 1y9j h ASN 31 CO 0.61 1.07 -0.77 -0.44 -1.29 0.00 0.00 177.43 176.60 1y9j s SER 32 N -6.43 3.46 0.36 1.15 0.01 -1.26 -5.13 113.70 105.85 1y9j s SER 32 Ca -0.03 -1.25 -0.28 0.00 1.31 0.00 0.00 55.95 55.70 1y9j s SER 32 Cb 0.09 -0.39 -0.10 0.00 0.21 0.00 0.00 66.02 65.82 1y9j s SER 32 CO 0.83 -0.43 1.33 -2.16 0.41 0.00 0.00 173.24 173.22 1y9j s PRO 33 N 2.05 4.21 0.00 12.44 0.04 -1.26 -4.37 135.00 148.10 1y9j s PRO 33 Ca 0.08 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.36 1y9j s PRO 33 Cb -0.16 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.42 1y9j s PRO 33 CO -0.33 -0.32 0.00 0.41 0.04 0.00 0.00 177.00 176.80 1y9j n GLY 34 N 0.71 0.88 3.85 0.56 0.00 -1.26 -5.14 105.19 104.79 1y9j n GLY 34 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1y9j n GLY 34 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1y9j s GLU 35 N 0.00 3.31 1.21 1.61 2.02 -1.26 -5.10 118.70 120.49 1y9j s GLU 35 Ca 0.00 -0.29 -0.18 0.00 0.02 0.00 0.00 54.97 54.53 1y9j s GLU 35 Cb 0.00 -3.05 0.24 0.00 0.10 0.00 0.00 34.13 31.42 1y9j s GLU 35 CO 0.00 0.71 0.55 -2.30 0.02 0.00 0.00 175.26 174.24 1y9j n PRO 36 N 1.54 -2.84 -3.74 0.39 -0.02 -1.26 -4.98 135.00 124.08 1y9j n PRO 36 Ca -0.16 -0.83 -0.38 0.00 -2.02 0.00 0.00 63.50 60.12 1y9j n PRO 36 Cb 0.54 -1.83 -0.12 0.00 -0.02 0.00 0.00 33.50 32.07 1y9j n PRO 36 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1y9j s VAL 37 N -2.21 3.63 -0.10 -1.45 1.01 -1.26 -5.08 120.40 114.94 1y9j s VAL 37 Ca 0.59 -1.51 -0.23 0.00 0.00 0.00 0.00 61.98 60.82 1y9j s VAL 37 Cb -0.15 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.97 1y9j s VAL 37 CO 0.58 -0.40 0.70 0.26 0.00 0.00 0.00 175.10 176.23 1y9j s TRP 38 N 1.31 3.53 0.07 5.22 0.52 -1.26 -4.85 118.94 123.47 1y9j s TRP 38 Ca 0.02 1.20 0.04 0.00 0.02 0.00 0.00 56.10 57.37 1y9j s TRP 38 Cb -0.22 -2.83 -0.03 0.00 -1.15 0.00 0.00 33.47 29.25 1y9j s TRP 38 CO -0.00 0.01 -0.11 -1.59 0.02 0.00 0.00 176.95 175.27 1y9j s LYS 39 N 1.14 0.73 0.29 4.98 -2.85 -1.15 -4.23 119.74 118.66 1y9j s LYS 39 Ca 0.36 -0.94 0.03 0.00 -1.00 0.00 0.00 55.97 54.42 1y9j s LYS 39 Cb -0.17 -0.60 -0.03 0.00 -2.06 0.00 0.00 37.83 34.97 1y9j s LYS 39 CO 0.16 0.12 0.45 0.08 0.10 0.00 0.00 175.35 176.26 1y9j s VAL 40 N -1.54 5.15 -0.05 1.79 1.01 -0.61 -1.26 120.40 124.88 1y9j s VAL 40 Ca -0.03 -0.74 -0.03 0.00 0.00 0.00 0.00 61.98 61.18 1y9j s VAL 40 Cb -0.09 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.47 1y9j s VAL 40 CO 0.01 -0.43 0.11 -0.22 0.00 0.00 0.00 175.10 174.57 1y9j s LEU 41 N -4.14 1.19 -0.23 3.92 2.96 -0.61 0.20 118.68 121.97 1y9j s LEU 41 Ca 0.37 0.22 -0.01 0.00 -0.22 0.00 0.00 54.13 54.49 1y9j s LEU 41 Cb -0.09 0.29 0.07 0.00 0.50 0.00 0.00 46.19 46.96 1y9j s LEU 41 CO 0.32 -0.09 0.01 -0.63 -1.32 0.00 0.00 176.35 174.64 1y9j s ILE 42 N 0.63 0.98 0.37 6.68 1.09 0.60 -1.55 121.20 129.99 1y9j s ILE 42 Ca -0.05 -0.96 0.07 0.00 -1.10 0.00 0.00 60.65 58.61 1y9j s ILE 42 Cb -0.07 -1.44 -0.02 0.00 -1.06 0.00 0.00 42.46 39.87 1y9j s ILE 42 CO -0.03 -0.25 0.35 -0.72 -0.10 0.00 0.00 174.94 174.19 1y9j s TYR 43 N 1.63 2.85 0.01 3.97 -0.85 -1.01 -1.78 117.35 122.17 1y9j s TYR 43 Ca -0.01 -0.37 0.00 0.00 -0.52 0.00 0.00 57.07 56.18 1y9j s TYR 43 Cb -0.18 -1.98 0.00 0.00 0.38 0.00 0.00 41.96 40.19 1y9j s TYR 43 CO -0.10 0.03 0.00 -3.47 -1.52 0.00 0.00 175.55 170.49 1y9j n ASP 44 N -1.48 1.59 -0.34 -0.18 2.03 -1.24 -3.12 116.55 113.82 1y9j n ASP 44 Ca 0.01 -1.05 0.22 0.00 0.52 0.00 0.00 54.79 54.48 1y9j n ASP 44 Cb 0.60 0.00 0.48 0.00 -0.72 0.00 0.00 41.12 41.49 1y9j n ASP 44 CO 0.00 0.00 0.00 0.08 -1.92 0.00 0.00 177.20 175.36 1y9j h ARG 45 N 0.00 0.42 0.11 -0.67 -0.00 -1.99 0.11 114.38 112.36 1y9j h ARG 45 Ca -0.01 -0.03 -0.25 0.00 -0.00 0.00 0.00 59.98 59.69 1y9j h ARG 45 Cb 0.03 -0.09 -0.00 0.00 -0.00 0.00 0.00 29.97 29.91 1y9j h ARG 45 CO 0.02 0.28 -1.27 0.74 -0.00 0.00 0.00 179.97 179.73 1y9j h PHE 46 N 0.43 0.42 -0.99 4.08 -1.00 -1.94 -2.78 116.94 115.16 1y9j h PHE 46 Ca 0.62 -0.30 0.26 0.00 2.81 0.00 0.00 57.97 61.36 1y9j h PHE 46 Cb 1.48 -0.02 -0.13 0.00 3.61 0.00 0.00 35.95 40.89 1y9j h PHE 46 CO -0.00 1.50 0.57 0.78 -1.61 0.00 0.00 178.31 179.54 1y9j h GLY 47 N -0.09 1.91 1.90 -1.45 0.00 -1.27 0.84 103.07 104.91 1y9j h GLY 47 Ca -0.27 -0.28 -0.21 0.00 0.00 0.00 0.00 47.33 46.57 1y9j h GLY 47 CO 0.05 -0.30 -0.96 0.06 0.00 0.00 0.00 176.54 175.39 1y9j h GLN 48 N 0.50 0.09 0.00 4.80 3.07 -0.97 0.12 115.11 122.72 1y9j h GLN 48 Ca 0.66 -0.12 0.00 0.00 0.09 0.00 0.00 58.65 59.28 1y9j h GLN 48 Cb 1.31 0.04 0.00 0.00 0.08 0.00 0.00 27.48 28.91 1y9j h GLN 48 CO -0.51 0.98 0.00 -3.47 0.09 0.00 0.00 178.83 175.91 1y9j n ASP 49 N -3.50 0.18 0.00 0.06 2.03 0.28 -2.42 116.55 113.17 1y9j n ASP 49 Ca -0.02 0.56 0.00 0.00 0.52 0.00 0.00 54.79 55.85 1y9j n ASP 49 Cb 0.88 -0.59 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 1y9j n ASP 49 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1y9j n ILE 50 N -1.72 0.00 -0.15 5.18 5.41 -0.54 -4.60 119.36 122.93 1y9j n ILE 50 Ca 0.01 0.00 -0.07 0.00 1.00 0.00 0.00 62.75 63.69 1y9j n ILE 50 Cb 0.08 -0.58 0.02 0.00 -0.71 0.00 0.00 39.64 38.46 1y9j n ILE 50 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 176.55 176.26 1y9j h ILE 51 N 0.00 1.07 0.69 1.39 2.10 -0.97 -3.07 117.51 118.71 1y9j h ILE 51 Ca 0.00 -0.20 -0.03 0.00 1.08 0.00 0.00 64.86 65.71 1y9j h ILE 51 Cb 0.92 0.44 0.01 0.00 -1.09 0.00 0.00 36.82 37.10 1y9j h ILE 51 CO 0.00 0.11 -0.33 0.28 -1.08 0.00 0.00 178.15 177.13 1y9j h SER 52 N 0.58 -0.78 -0.53 2.19 0.02 -1.59 0.96 113.55 114.40 1y9j h SER 52 Ca 0.18 0.01 0.15 0.00 -0.84 0.00 0.00 61.79 61.29 1y9j h SER 52 Cb -0.01 0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 1y9j h SER 52 CO -0.07 -0.51 0.76 -0.65 -1.14 0.00 0.00 176.83 175.22 1y9j h PRO 53 N -1.00 0.00 0.00 3.45 0.11 -1.77 0.29 132.00 133.08 1y9j h PRO 53 Ca -0.09 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.02 1y9j h PRO 53 Cb 0.73 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.84 1y9j h PRO 53 CO 0.15 0.00 -0.01 1.28 -0.21 0.00 0.00 178.00 179.22 1y9j n LEU 54 N -3.30 1.51 -3.44 2.35 4.77 -1.08 -5.07 117.00 112.74 1y9j n LEU 54 Ca 0.11 -1.56 -0.13 0.00 -0.03 0.00 0.00 56.01 54.40 1y9j n LEU 54 Cb 0.95 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.99 1y9j n LEU 54 CO 0.21 0.39 0.39 -0.22 -1.33 0.00 0.00 177.39 176.83 1y9j s LEU 55 N -0.84 -0.53 0.41 2.23 0.20 0.33 -5.04 118.68 115.45 1y9j s LEU 55 Ca 0.02 0.06 0.04 0.00 0.69 0.00 0.00 54.13 54.94 1y9j s LEU 55 Cb 0.01 2.55 -0.05 0.00 -0.43 0.00 0.00 46.19 48.28 1y9j s LEU 55 CO 0.00 -0.92 0.04 -0.44 -0.29 0.00 0.00 176.35 174.74 1y9j s SER 56 N -2.58 3.32 0.07 3.68 0.01 -1.26 -3.87 113.70 113.06 1y9j s SER 56 Ca -0.00 -1.50 -0.15 0.00 1.31 0.00 0.00 55.95 55.60 1y9j s SER 56 Cb -0.01 0.10 -0.16 0.00 0.21 0.00 0.00 66.02 66.16 1y9j s SER 56 CO -0.10 -0.69 1.28 0.58 0.41 0.00 0.00 173.24 174.71 1y9j h VAL 57 N 1.76 1.32 -0.07 3.43 2.07 -1.97 -2.23 116.25 120.55 1y9j h VAL 57 Ca -0.41 -1.86 -0.10 0.00 0.82 0.00 0.00 66.70 65.14 1y9j h VAL 57 Cb 1.27 2.04 -0.01 0.00 -1.52 0.00 0.00 31.29 33.07 1y9j h VAL 57 CO 0.71 0.58 -0.42 0.07 0.02 0.00 0.00 177.57 178.54 1y9j h LYS 58 N 0.34 0.15 -0.01 1.57 -0.00 -2.00 -2.64 116.57 113.99 1y9j h LYS 58 Ca -0.04 -0.07 -0.19 0.00 -0.00 0.00 0.00 60.65 60.35 1y9j h LYS 58 Cb 1.24 -0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 33.46 1y9j h LYS 58 CO 0.13 0.55 -0.84 0.93 -0.00 0.00 0.00 179.45 180.22 1y9j h GLU 59 N 0.13 0.19 -0.17 0.07 5.08 -1.96 -2.18 114.58 115.75 1y9j h GLU 59 Ca 0.01 -0.20 0.03 0.00 -1.00 0.00 0.00 59.36 58.21 1y9j h GLU 59 Cb 0.80 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.07 1y9j h GLU 59 CO 0.06 0.92 -0.05 -0.07 -1.00 0.00 0.00 179.01 178.87 1y9j h LEU 60 N 0.11 -0.17 -0.68 1.33 3.38 -1.05 0.88 115.31 119.11 1y9j h LEU 60 Ca -0.04 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 1y9j h LEU 60 Cb 1.45 0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.31 1y9j h LEU 60 CO 0.13 -0.06 -0.10 0.03 0.09 0.00 0.00 178.44 178.53 1y9j h ARG 61 N -0.01 0.00 0.00 1.13 2.47 -1.52 -2.33 114.38 114.12 1y9j h ARG 61 Ca 0.08 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 1y9j h ARG 61 Cb 0.14 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.46 1y9j h ARG 61 CO -0.18 0.10 -0.78 -0.25 0.56 0.00 0.00 179.97 179.42 1y9j n ASP 62 N -3.16 0.65 0.10 7.04 8.00 -0.57 -4.01 116.55 124.59 1y9j n ASP 62 Ca 0.02 -0.05 0.11 0.00 0.71 0.00 0.00 54.79 55.58 1y9j n ASP 62 Cb 0.46 0.42 -0.01 0.00 -0.02 0.00 0.00 41.12 41.98 1y9j n ASP 62 CO 0.00 0.00 0.00 1.15 -0.39 0.00 0.00 177.20 177.96 1y9j n MET 63 N -2.00 0.61 0.00 -1.24 0.00 0.29 -4.94 117.12 109.85 1y9j n MET 63 Ca 0.03 0.12 0.00 0.00 0.00 0.00 0.00 57.70 57.85 1y9j n MET 63 Cb 0.43 -1.82 0.00 0.00 0.00 0.00 0.00 33.22 31.83 1y9j n MET 63 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1y9j n GLY 64 N 1.20 1.08 3.85 3.17 0.00 -1.22 -5.01 105.19 108.26 1y9j n GLY 64 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1y9j n GLY 64 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1y9j s ILE 65 N -1.08 5.26 -0.44 -0.61 2.07 -0.88 -2.93 121.20 122.58 1y9j s ILE 65 Ca 0.00 0.54 0.22 0.00 -1.41 0.00 0.00 60.65 60.00 1y9j s ILE 65 Cb 0.00 -3.57 -0.19 0.00 0.13 0.00 0.00 42.46 38.83 1y9j s ILE 65 CO 0.00 0.58 0.83 1.07 -1.91 0.00 0.00 174.94 175.51 1y9j n THR 66 N 2.04 0.14 -3.65 4.00 5.66 -0.39 -4.63 114.28 117.44 1y9j n THR 66 Ca -0.16 -0.32 -0.02 0.00 -3.05 0.00 0.00 64.05 60.50 1y9j n THR 66 Cb 0.53 0.20 -0.07 0.00 -1.55 0.00 0.00 70.33 69.45 1y9j n THR 66 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 1y9j s LEU 67 N -4.13 -0.06 -0.28 1.09 1.98 -1.26 -5.00 118.68 111.02 1y9j s LEU 67 Ca 0.00 0.11 0.02 0.00 -2.89 0.00 0.00 54.13 51.38 1y9j s LEU 67 Cb 0.14 1.11 0.07 0.00 0.66 0.00 0.00 46.19 48.18 1y9j s LEU 67 CO 0.85 -0.02 -0.03 -1.38 -1.89 0.00 0.00 176.35 173.87 1y9j s HIS 68 N 0.27 3.05 0.32 5.38 -3.43 -1.26 -1.57 115.29 118.05 1y9j s HIS 68 Ca 0.04 -2.32 0.10 0.00 -0.80 0.00 0.00 55.06 52.08 1y9j s HIS 68 Cb -0.04 -2.10 -0.06 0.00 -1.43 0.00 0.00 32.58 28.95 1y9j s HIS 68 CO -0.14 -0.87 -0.13 -1.17 -2.00 0.00 0.00 174.74 170.43 1y9j s LEU 69 N 1.16 2.67 -0.18 5.38 0.20 -0.60 -5.02 118.68 122.30 1y9j s LEU 69 Ca -0.01 -1.14 -0.07 0.00 0.69 0.00 0.00 54.13 53.60 1y9j s LEU 69 Cb -0.19 -0.99 -0.04 0.00 -0.43 0.00 0.00 46.19 44.54 1y9j s LEU 69 CO -0.08 -0.14 0.05 -0.76 -0.29 0.00 0.00 176.35 175.13 1y9j s LEU 70 N -3.56 3.75 0.58 -0.68 1.43 -1.26 -2.40 118.68 116.54 1y9j s LEU 70 Ca 0.31 0.05 0.30 0.00 -1.03 0.00 0.00 54.13 53.77 1y9j s LEU 70 Cb 0.00 -1.94 1.39 0.00 0.03 0.00 0.00 46.19 45.67 1y9j s LEU 70 CO 0.15 0.17 1.77 -0.07 0.23 0.00 0.00 176.35 178.60 1y9j h LEU 71 N 6.71 0.00 -3.23 1.79 4.07 -1.86 0.86 115.31 123.65 1y9j h LEU 71 Ca -0.36 0.00 -0.32 0.00 0.08 0.00 0.00 57.88 57.28 1y9j h LEU 71 Cb 1.17 0.00 -0.18 0.00 1.08 0.00 0.00 40.66 42.73 1y9j h LEU 71 CO 0.69 0.00 0.40 1.57 -1.08 0.00 0.00 178.44 180.03 1y9j n HIS 72 N -3.71 1.79 -3.78 1.13 -0.00 -1.26 -4.86 115.22 104.53 1y9j n HIS 72 Ca 0.15 -1.45 -0.12 0.00 0.46 0.00 0.00 57.72 56.76 1y9j n HIS 72 Cb 0.95 -0.73 -0.08 0.00 -0.12 0.00 0.00 29.99 30.01 1y9j n HIS 72 CO 0.00 0.00 0.00 -1.12 0.46 0.00 0.00 176.34 175.68 1y9j s SER 73 N -0.30 -0.12 -0.48 0.26 0.01 0.30 -5.09 113.70 108.28 1y9j s SER 73 Ca 0.34 -0.12 -0.27 0.00 1.31 0.00 0.00 55.95 57.20 1y9j s SER 73 Cb 0.28 0.32 -0.08 0.00 0.21 0.00 0.00 66.02 66.75 1y9j s SER 73 CO 0.05 -0.53 2.40 -0.90 0.41 0.00 0.00 173.24 174.67 1y9j n ASP 74 N 0.88 2.31 -4.62 2.44 5.75 -1.26 -4.75 116.55 117.30 1y9j n ASP 74 Ca -0.20 -0.33 -0.31 0.00 -0.01 0.00 0.00 54.79 53.94 1y9j n ASP 74 Cb 0.58 -1.52 0.17 0.00 -1.03 0.00 0.00 41.12 39.32 1y9j n ASP 74 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 1y9j n ARG 75 N 8.91 -0.64 -3.64 0.11 0.63 -1.26 -4.99 116.66 115.76 1y9j n ARG 75 Ca 0.38 -0.13 -0.36 0.00 -0.92 0.00 0.00 57.85 56.83 1y9j n ARG 75 Cb 0.49 -2.29 -0.08 0.00 0.45 0.00 0.00 32.46 31.02 1y9j n ARG 75 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1y9j s ASP 76 N -2.54 6.27 -0.48 6.15 1.11 -1.26 -5.05 116.67 120.87 1y9j s ASP 76 Ca 0.66 0.31 -0.29 0.00 0.18 0.00 0.00 52.55 53.41 1y9j s ASP 76 Cb -0.23 -2.13 0.03 0.00 1.07 0.00 0.00 42.92 41.66 1y9j s ASP 76 CO 0.60 0.12 1.14 -2.16 1.18 0.00 0.00 175.17 176.05 1y9j s PRO 77 N 0.56 3.70 -0.15 8.23 0.04 -1.26 -4.73 135.00 141.39 1y9j s PRO 77 Ca 0.11 0.53 -0.02 0.00 0.04 0.00 0.00 61.00 61.66 1y9j s PRO 77 Cb -0.12 -3.92 0.05 0.00 0.04 0.00 0.00 34.50 30.55 1y9j s PRO 77 CO 0.01 -1.40 0.02 0.42 0.04 0.00 0.00 177.00 176.09 1y9j s ILE 78 N 4.47 0.47 -0.18 0.56 1.09 0.41 -5.01 121.20 123.01 1y9j s ILE 78 Ca 0.47 -0.30 0.19 0.00 -1.10 0.00 0.00 60.65 59.92 1y9j s ILE 78 Cb -0.07 -0.84 -0.05 0.00 -1.06 0.00 0.00 42.46 40.44 1y9j s ILE 78 CO 0.31 -0.02 0.99 0.08 -0.10 0.00 0.00 174.94 176.20 1y9j h ARG 79 N 8.28 0.00 -0.80 2.79 -0.00 -1.83 -3.11 114.38 119.71 1y9j h ARG 79 Ca -0.18 0.00 -0.43 0.00 -0.00 0.00 0.00 59.98 59.37 1y9j h ARG 79 Cb 1.12 0.00 -0.25 0.00 -0.00 0.00 0.00 29.97 30.84 1y9j h ARG 79 CO 0.31 0.17 0.42 -3.47 -0.00 0.00 0.00 179.97 177.40 1y9j n ASP 80 N -2.83 3.61 -3.78 0.08 2.03 -1.26 -4.49 116.55 109.91 1y9j n ASP 80 Ca -0.04 -3.68 -0.13 0.00 0.52 0.00 0.00 54.79 51.46 1y9j n ASP 80 Cb 0.70 -0.78 -0.12 0.00 -0.72 0.00 0.00 41.12 40.20 1y9j n ASP 80 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1y9j s VAL 81 N -3.40 -0.01 0.90 5.18 1.01 -1.26 -5.03 120.40 117.80 1y9j s VAL 81 Ca 0.54 0.03 -0.12 0.00 0.00 0.00 0.00 61.98 62.43 1y9j s VAL 81 Cb 0.46 -0.34 0.13 0.00 0.00 0.00 0.00 36.38 36.63 1y9j s VAL 81 CO 0.07 0.01 1.12 -2.84 0.00 0.00 0.00 175.10 173.46 1y9j s PRO 82 N 0.37 1.23 0.06 2.72 0.02 -1.26 -0.14 135.00 138.00 1y9j s PRO 82 Ca -0.02 0.41 -0.04 0.00 0.02 0.00 0.00 61.00 61.37 1y9j s PRO 82 Cb -0.04 -1.84 -0.02 0.00 0.02 0.00 0.00 34.50 32.62 1y9j s PRO 82 CO -0.02 -2.16 0.05 0.00 -0.33 0.00 0.00 177.00 174.55 1y9j s ALA 83 N -3.20 0.22 0.02 -1.55 0.00 -0.65 -1.58 121.76 115.01 1y9j s ALA 83 Ca 0.63 -0.95 0.03 0.00 0.00 0.00 0.00 51.96 51.67 1y9j s ALA 83 Cb -0.15 0.34 -0.02 0.00 0.00 0.00 0.00 23.12 23.29 1y9j s ALA 83 CO 0.54 -0.41 -0.09 0.08 0.00 0.00 0.00 175.76 175.88 1y9j s VAL 84 N -3.74 0.72 -0.36 0.00 1.01 0.53 0.13 120.40 118.69 1y9j s VAL 84 Ca 0.05 -0.76 -0.00 0.00 0.00 0.00 0.00 61.98 61.27 1y9j s VAL 84 Cb 0.06 -0.68 0.13 0.00 0.00 0.00 0.00 36.38 35.89 1y9j s VAL 84 CO -0.10 -0.06 0.19 -0.31 0.00 0.00 0.00 175.10 174.82 1y9j s TYR 85 N -0.75 1.11 -0.94 5.22 1.51 0.38 0.22 117.35 124.10 1y9j s TYR 85 Ca -0.02 -1.72 -0.15 0.00 -1.01 0.00 0.00 57.07 54.17 1y9j s TYR 85 Cb -0.07 -1.27 0.20 0.00 -0.11 0.00 0.00 41.96 40.71 1y9j s TYR 85 CO 0.00 -0.82 0.99 0.12 -1.11 0.00 0.00 175.55 174.73 1y9j s PHE 86 N 1.13 3.62 0.29 2.71 5.36 -0.73 -0.75 117.98 129.60 1y9j s PHE 86 Ca 0.15 -1.94 0.04 0.00 -0.96 0.00 0.00 56.93 54.23 1y9j s PHE 86 Cb -0.22 -4.01 -0.03 0.00 -0.34 0.00 0.00 43.02 38.42 1y9j s PHE 86 CO -0.09 -1.17 0.23 0.14 -1.46 0.00 0.00 175.22 172.87 1y9j s VAL 87 N 0.84 0.00 0.37 3.12 -7.23 -0.48 -3.60 120.40 113.42 1y9j s VAL 87 Ca 0.27 -1.99 -0.19 0.00 -1.81 0.00 0.00 61.98 58.26 1y9j s VAL 87 Cb -0.08 -2.50 -0.10 0.00 0.56 0.00 0.00 36.38 34.26 1y9j s VAL 87 CO -0.08 0.00 0.85 -0.32 -0.31 0.00 0.00 175.10 175.24 1y9j s MET 88 N -3.67 4.16 -0.21 4.82 1.75 -1.26 -2.74 119.30 122.15 1y9j s MET 88 Ca 0.40 0.94 -0.03 0.00 -1.25 0.00 0.00 55.69 55.75 1y9j s MET 88 Cb 0.04 -2.36 0.02 0.00 2.84 0.00 0.00 34.83 35.36 1y9j s MET 88 CO 0.23 0.09 2.58 -0.35 -0.65 0.00 0.00 175.02 176.92 1y9j n PRO 89 N -0.37 1.83 -2.39 4.11 -0.04 -1.26 -4.57 135.00 132.31 1y9j n PRO 89 Ca 0.05 -1.30 -0.32 0.00 -0.04 0.00 0.00 63.50 61.88 1y9j n PRO 89 Cb 0.53 -1.71 -0.03 0.00 -0.04 0.00 0.00 33.50 32.25 1y9j n PRO 89 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1y9j s THR 90 N -1.03 4.51 0.31 0.52 -4.23 -1.26 -4.74 115.64 109.72 1y9j s THR 90 Ca 0.40 1.21 0.05 0.00 -1.18 0.00 0.00 61.69 62.17 1y9j s THR 90 Cb 0.25 -3.71 0.35 0.00 1.34 0.00 0.00 72.50 70.73 1y9j s THR 90 CO -0.06 -0.68 1.61 -0.33 -0.54 0.00 0.00 174.62 174.62 1y9j h GLU 91 N 0.91 0.11 -0.35 3.99 5.08 -1.99 0.49 114.58 122.82 1y9j h GLU 91 Ca -0.47 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 57.79 1y9j h GLU 91 Cb 1.19 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1y9j h GLU 91 CO 0.61 0.07 -0.16 1.05 -1.00 0.00 0.00 179.01 179.59 1y9j h GLU 92 N 0.11 0.72 -0.14 2.33 4.11 -1.95 -2.81 114.58 116.96 1y9j h GLU 92 Ca 0.62 -0.31 -0.00 0.00 0.07 0.00 0.00 59.36 59.74 1y9j h GLU 92 Cb 1.36 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 1y9j h GLU 92 CO -0.76 0.92 0.07 -0.91 0.07 0.00 0.00 179.01 178.40 1y9j h ASN 93 N 0.50 0.17 -0.76 3.06 2.35 -0.47 -2.13 115.58 118.30 1y9j h ASN 93 Ca 0.08 -0.10 0.18 0.00 -0.55 0.00 0.00 56.30 55.91 1y9j h ASN 93 Cb 0.69 -0.04 -0.04 0.00 0.05 0.00 0.00 38.32 38.97 1y9j h ASN 93 CO 0.05 0.22 0.52 0.40 -1.65 0.00 0.00 177.43 176.98 1y9j h ILE 94 N 0.11 0.71 0.00 2.81 1.08 -0.49 0.46 117.51 122.18 1y9j h ILE 94 Ca 0.05 -0.08 -0.13 0.00 -0.39 0.00 0.00 64.86 64.30 1y9j h ILE 94 Cb 0.09 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 34.27 1y9j h ILE 94 CO -0.01 0.04 -0.64 -0.78 -0.69 0.00 0.00 178.15 176.08 1y9j h ASP 95 N 0.24 0.00 1.27 1.72 1.82 -1.13 -2.99 116.42 117.35 1y9j h ASP 95 Ca 0.38 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.93 1y9j h ASP 95 Cb 1.12 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 41.11 1y9j h ASP 95 CO -0.09 0.64 -0.42 0.03 -1.61 0.00 0.00 179.24 177.79 1y9j h ARG 96 N 0.00 0.00 -0.25 0.28 -0.00 0.41 -2.48 114.38 112.34 1y9j h ARG 96 Ca -0.01 0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 59.33 1y9j h ARG 96 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 31.17 1y9j h ARG 96 CO 0.08 0.42 -0.39 -0.07 0.00 0.00 0.00 179.97 180.01 1y9j h LEU 97 N 0.00 0.78 -1.00 3.04 -0.00 -1.09 -0.36 115.31 116.68 1y9j h LEU 97 Ca -0.00 -0.52 -0.04 0.00 -0.00 0.00 0.00 57.88 57.32 1y9j h LEU 97 Cb 1.16 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 41.60 1y9j h LEU 97 CO 0.05 1.15 -0.17 0.00 -0.00 0.00 0.00 178.44 179.47 1y9j h GLN 99 N 0.00 0.24 0.00 0.00 1.08 -1.24 -2.84 115.11 112.35 1y9j h GLN 99 Ca -0.00 -0.41 -0.17 0.00 -1.45 0.00 0.00 58.65 56.62 1y9j h GLN 99 Cb 0.77 0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 28.32 1y9j h GLN 99 CO 0.02 1.19 -0.81 0.38 -0.95 0.00 0.00 178.83 178.66 1y9j h ASP 100 N -0.49 0.00 0.42 1.46 3.04 -1.04 -2.46 116.42 117.34 1y9j h ASP 100 Ca -0.12 0.00 -0.16 0.00 -3.24 0.00 0.00 57.03 53.50 1y9j h ASP 100 Cb 1.52 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 39.80 1y9j h ASP 100 CO 0.12 0.81 -0.70 -0.07 -2.04 0.00 0.00 179.24 177.36 1y9j h LEU 101 N 0.00 0.28 0.04 0.15 3.38 -1.00 -2.69 115.31 115.48 1y9j h LEU 101 Ca -0.01 -0.18 -0.24 0.00 0.09 0.00 0.00 57.88 57.54 1y9j h LEU 101 Cb 1.46 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.12 1y9j h LEU 101 CO 0.11 0.89 -1.10 0.03 0.09 0.00 0.00 178.44 178.45 1y9j h ARG 102 N 0.16 0.13 0.00 1.13 2.47 -1.51 -3.23 114.38 113.54 1y9j h ARG 102 Ca -0.02 -0.22 -0.06 0.00 -1.26 0.00 0.00 59.98 58.42 1y9j h ARG 102 Cb 1.24 0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 29.63 1y9j h ARG 102 CO 0.11 1.10 -0.29 -0.91 0.56 0.00 0.00 179.97 180.54 1y9j h ASN 103 N 0.04 0.00 -3.47 7.04 2.35 -1.41 -3.47 115.58 116.65 1y9j h ASN 103 Ca -0.07 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.33 1y9j h ASN 103 Cb 1.85 0.00 0.03 0.00 0.05 0.00 0.00 38.32 40.25 1y9j h ASN 103 CO 0.16 0.29 -0.51 0.00 -1.65 0.00 0.00 177.43 175.73 1y9j n GLN 104 N -3.55 -3.32 0.29 0.81 6.02 -1.02 -4.86 117.38 111.76 1y9j n GLN 104 Ca -0.01 0.82 0.18 0.00 -0.01 0.00 0.00 57.00 57.99 1y9j n GLN 104 Cb 0.43 -5.40 0.99 0.00 1.02 0.00 0.00 30.24 27.29 1y9j n GLN 104 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1y9j h LEU 105 N -0.80 0.00 -8.36 1.08 3.38 -1.84 -3.43 115.31 105.33 1y9j h LEU 105 Ca -0.45 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.35 1y9j h LEU 105 Cb 1.32 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.92 1y9j h LEU 105 CO 0.50 0.00 -0.60 -0.31 0.09 0.00 0.00 178.44 178.12 1y9j s TYR 106 N -4.42 0.77 -0.04 1.13 1.51 -1.17 0.16 117.35 115.27 1y9j s TYR 106 Ca -0.05 -1.15 -0.25 0.00 -1.01 0.00 0.00 57.07 54.61 1y9j s TYR 106 Cb 0.14 -0.41 -0.22 0.00 -0.11 0.00 0.00 41.96 41.36 1y9j s TYR 106 CO 0.47 -0.54 1.10 0.93 -1.11 0.00 0.00 175.55 176.41 1y9j h GLU 107 N 2.84 0.11 -5.53 -0.62 5.08 -0.66 -3.47 114.58 112.33 1y9j h GLU 107 Ca -0.34 -0.09 -0.64 0.00 -1.00 0.00 0.00 59.36 57.28 1y9j h GLU 107 Cb 1.20 0.02 -0.12 0.00 0.50 0.00 0.00 28.75 30.35 1y9j h GLU 107 CO 0.58 0.77 -0.53 -1.12 -1.00 0.00 0.00 179.01 177.71 1y9j s SER 108 N -6.07 4.11 -0.45 1.42 0.01 -1.26 -3.94 113.70 107.52 1y9j s SER 108 Ca -0.16 -1.44 0.05 0.00 1.31 0.00 0.00 55.95 55.72 1y9j s SER 108 Cb 0.01 0.02 0.18 0.00 0.21 0.00 0.00 66.02 66.44 1y9j s SER 108 CO 0.71 -0.67 0.50 -0.31 0.41 0.00 0.00 173.24 173.88 1y9j s TYR 109 N -2.77 -0.08 -0.83 2.43 1.51 -0.60 -1.64 117.35 115.37 1y9j s TYR 109 Ca 0.24 -1.56 -0.25 0.00 -1.01 0.00 0.00 57.07 54.49 1y9j s TYR 109 Cb 0.05 -0.39 -0.08 0.00 -0.11 0.00 0.00 41.96 41.43 1y9j s TYR 109 CO 0.13 -1.02 2.15 -0.47 -1.11 0.00 0.00 175.55 175.23 1y9j s TYR 110 N 0.43 1.50 0.42 2.71 6.14 0.12 -2.79 117.35 125.88 1y9j s TYR 110 Ca 0.31 1.24 -0.19 0.00 0.64 0.00 0.00 57.07 59.08 1y9j s TYR 110 Cb 0.02 -3.78 -0.10 0.00 0.42 0.00 0.00 41.96 38.52 1y9j s TYR 110 CO -0.13 -1.72 0.91 -0.51 0.64 0.00 0.00 175.55 174.74 1y9j s LEU 111 N 12.09 3.90 -0.18 6.97 1.43 0.17 0.14 118.68 143.21 1y9j s LEU 111 Ca 0.80 1.56 -0.23 0.00 -1.03 0.00 0.00 54.13 55.23 1y9j s LEU 111 Cb -0.10 -4.42 0.06 0.00 0.03 0.00 0.00 46.19 41.76 1y9j s LEU 111 CO 0.04 -0.37 0.62 0.21 0.23 0.00 0.00 176.35 177.08 1y9j s ASN 112 N -2.40 -0.62 -0.09 2.29 2.47 0.07 0.21 114.94 116.86 1y9j s ASN 112 Ca 0.59 1.05 0.04 0.00 0.42 0.00 0.00 52.86 54.97 1y9j s ASN 112 Cb -0.09 1.04 0.00 0.00 -1.45 0.00 0.00 41.25 40.75 1y9j s ASN 112 CO 0.18 -0.32 -0.22 -0.36 -3.72 0.00 0.00 177.10 172.66 1y9j s PHE 113 N -0.13 2.36 0.16 0.43 0.08 -1.21 -1.38 117.98 118.29 1y9j s PHE 113 Ca -0.03 -0.96 0.21 0.00 0.12 0.00 0.00 56.93 56.27 1y9j s PHE 113 Cb -0.03 -1.60 0.81 0.00 -0.57 0.00 0.00 43.02 41.63 1y9j s PHE 113 CO 0.03 -0.40 1.79 -0.84 -0.10 0.00 0.00 175.22 175.70 1y9j h ILE 114 N 5.76 0.72 -1.98 0.64 -2.65 -1.85 -3.34 117.51 114.81 1y9j h ILE 114 Ca -0.21 -1.30 -0.62 0.00 1.03 0.00 0.00 64.86 63.76 1y9j h ILE 114 Cb 1.23 1.83 -0.14 0.00 -2.05 0.00 0.00 36.82 37.70 1y9j h ILE 114 CO 0.47 0.29 -0.69 -0.94 0.03 0.00 0.00 178.15 177.31 1y9j s SER 115 N -6.32 3.70 -0.65 2.16 1.04 -1.26 -2.21 113.70 110.15 1y9j s SER 115 Ca 0.00 -1.18 -0.27 0.00 0.48 0.00 0.00 55.95 54.99 1y9j s SER 115 Cb 0.11 -0.34 -0.01 0.00 0.10 0.00 0.00 66.02 65.88 1y9j s SER 115 CO 0.66 -0.18 1.68 0.00 0.98 0.00 0.00 173.24 176.38 1y9j s ALA 116 N -2.60 2.35 0.68 5.32 0.00 -1.26 -4.70 121.76 121.54 1y9j s ALA 116 Ca 0.32 -0.88 -0.12 0.00 0.00 0.00 0.00 51.96 51.28 1y9j s ALA 116 Cb 0.02 -4.29 0.00 0.00 0.00 0.00 0.00 23.12 18.85 1y9j s ALA 116 CO 0.16 -3.71 1.06 -1.50 0.00 0.00 0.00 175.76 171.78 1y9j s ILE 117 N 8.04 3.88 0.77 0.00 2.07 -1.26 -5.07 121.20 129.63 1y9j s ILE 117 Ca 0.57 0.68 -0.04 0.00 -1.41 0.00 0.00 60.65 60.45 1y9j s ILE 117 Cb -0.11 -3.33 0.14 0.00 0.13 0.00 0.00 42.46 39.29 1y9j s ILE 117 CO 0.19 -0.73 1.07 -0.44 -1.91 0.00 0.00 174.94 173.12 1y9j s SER 118 N -3.48 4.08 0.18 4.50 0.01 -1.26 -4.97 113.70 112.75 1y9j s SER 118 Ca 0.60 -0.24 0.06 0.00 1.31 0.00 0.00 55.95 57.68 1y9j s SER 118 Cb -0.15 -0.06 0.01 0.00 0.21 0.00 0.00 66.02 66.04 1y9j s SER 118 CO 0.50 -2.06 1.40 0.03 0.41 0.00 0.00 173.24 173.53 1y9j h ARG 119 N -0.77 0.07 0.03 12.44 3.08 -1.99 -2.94 114.38 124.31 1y9j h ARG 119 Ca -0.38 -0.08 -0.00 0.00 0.07 0.00 0.00 59.98 59.59 1y9j h ARG 119 Cb 1.26 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.34 1y9j h ARG 119 CO 0.39 0.88 -0.02 0.77 -1.07 0.00 0.00 179.97 180.93 1y9j h SER 120 N 0.04 -0.04 -0.94 7.04 0.02 -2.00 -2.81 113.55 114.86 1y9j h SER 120 Ca -0.02 -0.64 0.09 0.00 -0.84 0.00 0.00 61.79 60.38 1y9j h SER 120 Cb 1.50 0.01 -0.07 0.00 0.14 0.00 0.00 62.40 63.97 1y9j h SER 120 CO 0.12 0.65 0.58 0.11 -1.14 0.00 0.00 176.83 177.16 1y9j h LYS 121 N -0.77 0.96 -0.23 3.45 1.57 -1.97 -0.51 116.57 119.08 1y9j h LYS 121 Ca -0.00 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 1y9j h LYS 121 Cb 0.67 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1y9j h LYS 121 CO 0.01 0.64 -0.14 -0.07 -0.57 0.00 0.00 179.45 179.31 1y9j h LEU 122 N 0.99 0.37 -1.80 2.94 3.38 -1.59 -1.86 115.31 117.74 1y9j h LEU 122 Ca 0.44 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.32 1y9j h LEU 122 Cb 0.33 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1y9j h LEU 122 CO -0.22 0.54 0.14 -0.33 0.09 0.00 0.00 178.44 178.66 1y9j h GLU 123 N 0.36 0.26 0.27 1.13 5.08 -0.82 0.18 114.58 121.04 1y9j h GLU 123 Ca 0.07 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.40 1y9j h GLU 123 Cb 0.47 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.66 1y9j h GLU 123 CO 0.03 0.17 -0.13 -0.44 -1.00 0.00 0.00 179.01 177.64 1y9j h ASP 124 N 0.27 -0.31 -0.41 1.42 5.19 -1.11 -0.53 116.42 120.95 1y9j h ASP 124 Ca 0.08 -0.19 -0.02 0.00 -0.62 0.00 0.00 57.03 56.27 1y9j h ASP 124 Cb -0.02 0.08 -0.02 0.00 0.18 0.00 0.00 39.33 39.55 1y9j h ASP 124 CO -0.02 0.05 0.16 0.40 -3.12 0.00 0.00 179.24 176.72 1y9j h ILE 125 N -0.70 1.20 -0.54 0.35 5.03 -1.35 1.49 117.51 122.98 1y9j h ILE 125 Ca -0.04 -0.60 0.06 0.00 -0.12 0.00 0.00 64.86 64.17 1y9j h ILE 125 Cb 0.48 0.83 -0.06 0.00 -3.03 0.00 0.00 36.82 35.05 1y9j h ILE 125 CO 0.06 0.22 0.24 0.00 -0.68 0.00 0.00 178.15 177.99 1y9j h ALA 126 N 1.01 0.69 0.00 1.87 0.00 -0.68 -0.92 119.26 121.23 1y9j h ALA 126 Ca 0.14 0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 1y9j h ALA 126 Cb 0.19 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1y9j h ALA 126 CO -0.01 -0.14 -0.63 -0.91 0.00 0.00 0.00 179.25 177.56 1y9j h ASN 127 N 0.45 0.00 -1.04 0.00 2.35 -0.79 -3.01 115.58 113.54 1y9j h ASN 127 Ca 0.25 0.00 0.27 0.00 -0.55 0.00 0.00 56.30 56.28 1y9j h ASN 127 Cb 0.23 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.52 1y9j h ASN 127 CO -0.22 0.63 0.69 0.00 -1.65 0.00 0.00 177.43 176.89 1y9j h ALA 128 N 1.37 2.40 0.17 -0.83 0.00 0.35 0.25 119.26 122.97 1y9j h ALA 128 Ca -0.01 0.04 -0.36 0.00 0.00 0.00 0.00 54.91 54.58 1y9j h ALA 128 Cb 1.36 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1y9j h ALA 128 CO 0.08 -0.78 -1.84 0.00 0.00 0.00 0.00 179.25 176.71 1y9j h ALA 129 N 1.58 0.25 -0.86 0.00 0.00 -1.46 -3.35 119.26 115.42 1y9j h ALA 129 Ca 0.57 -1.23 0.25 0.00 0.00 0.00 0.00 54.91 54.50 1y9j h ALA 129 Cb 1.60 0.55 -0.03 0.00 0.00 0.00 0.00 17.79 19.91 1y9j h ALA 129 CO -0.22 1.12 0.75 -0.07 0.00 0.00 0.00 179.25 180.83 1y9j h LEU 130 N 0.09 0.00 -1.05 0.00 3.38 -0.83 2.68 115.31 119.57 1y9j h LEU 130 Ca -0.37 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.50 1y9j h LEU 130 Cb 2.08 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.81 1y9j h LEU 130 CO 0.15 0.00 -0.38 0.00 0.09 0.00 0.00 178.44 178.29 1y9j h ALA 131 N 1.32 1.21 -0.00 1.53 0.00 -1.53 -3.17 119.26 118.61 1y9j h ALA 131 Ca 0.41 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1y9j h ALA 131 Cb 1.90 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1y9j h ALA 131 CO -0.00 0.55 -0.13 0.00 0.00 0.00 0.00 179.25 179.66 1y9j n ALA 132 N -2.47 2.59 -2.35 0.00 0.00 0.30 -4.99 120.51 113.58 1y9j n ALA 132 Ca -0.01 -0.33 -0.18 0.00 0.00 0.00 0.00 53.44 52.91 1y9j n ALA 132 Cb 0.45 -0.19 -0.01 0.00 0.00 0.00 0.00 19.45 19.70 1y9j n ALA 132 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1y9j n ASN 133 N -0.44 -5.34 -4.69 0.00 2.85 0.82 -4.94 115.26 103.53 1y9j n ASN 133 Ca 0.02 -0.02 -0.42 0.00 -0.11 0.00 0.00 54.58 54.05 1y9j n ASN 133 Cb 0.11 -4.40 -0.03 0.00 1.24 0.00 0.00 39.78 36.71 1y9j n ASN 133 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1y9j s ALA 134 N -2.92 3.45 -0.18 5.20 0.00 -1.08 -4.95 121.76 121.28 1y9j s ALA 134 Ca 0.00 0.52 -0.31 0.00 0.00 0.00 0.00 51.96 52.17 1y9j s ALA 134 Cb -0.00 -3.48 -0.08 0.00 0.00 0.00 0.00 23.12 19.56 1y9j s ALA 134 CO 0.00 -0.69 2.12 0.28 0.00 0.00 0.00 175.76 177.47 1y9j n VAL 135 N 4.58 0.43 -4.34 0.00 0.31 -1.25 -4.78 118.33 113.27 1y9j n VAL 135 Ca 0.10 -0.31 -0.18 0.00 -0.01 0.00 0.00 64.34 63.94 1y9j n VAL 135 Cb 0.47 -2.24 -0.10 0.00 -0.91 0.00 0.00 33.84 31.06 1y9j n VAL 135 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1y9j s THR 136 N 6.80 1.44 -0.30 2.52 -4.23 -1.26 -1.55 115.64 119.06 1y9j s THR 136 Ca 0.99 -2.12 -0.09 0.00 -1.18 0.00 0.00 61.69 59.30 1y9j s THR 136 Cb -0.51 -2.18 0.14 0.00 1.34 0.00 0.00 72.50 71.30 1y9j s THR 136 CO 0.42 -0.49 0.66 0.00 -0.54 0.00 0.00 174.62 174.67 1y9j s GLN 137 N -3.73 0.56 -0.08 3.99 0.00 -1.12 -4.95 119.66 114.32 1y9j s GLN 137 Ca 0.24 1.34 -0.24 0.00 -0.00 0.00 0.00 55.36 56.70 1y9j s GLN 137 Cb 0.02 0.80 -0.03 0.00 0.00 0.00 0.00 33.01 33.80 1y9j s GLN 137 CO 0.07 -0.27 0.75 0.08 0.00 0.00 0.00 175.29 175.91 1y9j s VAL 138 N 2.87 5.00 0.77 3.63 1.01 -1.26 0.43 120.40 132.86 1y9j s VAL 138 Ca -0.01 1.52 -0.02 0.00 0.00 0.00 0.00 61.98 63.48 1y9j s VAL 138 Cb -0.12 -4.08 0.16 0.00 0.00 0.00 0.00 36.38 32.33 1y9j s VAL 138 CO -0.19 0.20 1.06 0.00 0.00 0.00 0.00 175.10 176.17 1y9j s ALA 139 N 1.09 3.62 0.81 5.51 0.00 0.56 -4.92 121.76 128.43 1y9j s ALA 139 Ca 0.39 -1.85 -0.12 0.00 0.00 0.00 0.00 51.96 50.38 1y9j s ALA 139 Cb -0.18 -1.99 0.08 0.00 0.00 0.00 0.00 23.12 21.03 1y9j s ALA 139 CO 0.18 -1.68 1.11 0.15 0.00 0.00 0.00 175.76 175.51 1y9j s LYS 140 N -5.26 2.00 -0.11 0.00 -0.14 -1.26 -4.30 119.74 110.67 1y9j s LYS 140 Ca 0.69 0.55 -0.03 0.00 -1.36 0.00 0.00 55.97 55.82 1y9j s LYS 140 Cb -0.04 -1.92 -0.03 0.00 -1.68 0.00 0.00 37.83 34.16 1y9j s LYS 140 CO 0.46 -1.66 0.01 0.08 -0.76 0.00 0.00 175.35 173.48 1y9j s VAL 141 N -3.21 4.35 -0.09 3.17 1.01 -1.25 -4.22 120.40 120.16 1y9j s VAL 141 Ca 0.61 -0.22 0.10 0.00 0.00 0.00 0.00 61.98 62.47 1y9j s VAL 141 Cb -0.14 -2.86 -0.13 0.00 0.00 0.00 0.00 36.38 33.24 1y9j s VAL 141 CO 0.54 0.56 0.06 2.22 0.00 0.00 0.00 175.10 178.48 1y9j n PHE 142 N 2.61 0.00 -0.02 5.22 -1.74 -1.26 -4.54 117.46 117.73 1y9j n PHE 142 Ca -0.18 0.00 -0.03 0.00 -0.56 0.00 0.00 57.45 56.68 1y9j n PHE 142 Cb 0.53 -0.48 0.16 0.00 1.52 0.00 0.00 39.48 41.20 1y9j n PHE 142 CO 0.00 0.00 0.00 -0.25 -0.56 0.00 0.00 176.76 175.95 1y9j n ASP 143 N -2.33 3.38 0.13 5.98 9.92 -0.94 -4.12 116.55 128.57 1y9j n ASP 143 Ca -0.15 -2.61 -0.00 0.00 -0.53 0.00 0.00 54.79 51.50 1y9j n ASP 143 Cb 0.77 -0.63 0.07 0.00 -0.64 0.00 0.00 41.12 40.70 1y9j n ASP 143 CO 0.00 0.00 0.00 0.06 0.13 0.00 0.00 177.20 177.39 1y9j h GLN 144 N 1.37 0.00 0.00 -1.24 3.07 -1.72 -3.29 115.11 113.30 1y9j h GLN 144 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.87 1y9j h GLN 144 Cb 1.54 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.10 1y9j h GLN 144 CO 0.38 0.63 -1.27 2.48 0.09 0.00 0.00 178.83 181.14 1y9j n TYR 145 N -3.40 0.00 -4.27 0.06 4.11 -1.26 -4.88 117.16 107.52 1y9j n TYR 145 Ca 0.01 0.00 -0.18 0.00 -0.00 0.00 0.00 57.90 57.72 1y9j n TYR 145 Cb 0.73 -0.20 -0.07 0.00 -0.00 0.00 0.00 39.34 39.80 1y9j n TYR 145 CO 0.00 0.00 0.00 1.47 -0.00 0.00 0.00 176.86 178.33 1y9j n LEU 146 N -1.74 0.00 0.00 -3.48 -0.00 -1.24 -5.22 117.00 105.32 1y9j n LEU 146 Ca -0.00 -2.95 0.00 0.00 -0.00 0.00 0.00 56.01 53.05 1y9j n LEU 146 Cb 0.33 1.54 0.00 0.00 -0.00 0.00 0.00 43.42 45.28 1y9j n LEU 146 CO 0.31 -0.49 0.00 -3.20 -0.00 0.00 0.00 177.39 174.01