#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 0.15 0.52 0.00 0.02 -2.06 -2.15 113.55 110.02 1y9j h SER 9 Ca 0.00 -0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.92 1y9j h SER 9 Cb 0.00 -0.04 0.01 0.00 0.14 0.00 0.00 62.40 62.51 1y9j h SER 9 CO 0.00 0.14 -0.25 0.40 -1.14 0.00 0.00 176.83 175.98 1y9j h ILE 10 N 0.17 0.00 -0.72 3.27 1.08 -2.04 -2.95 117.51 116.33 1y9j h ILE 10 Ca 0.04 -0.38 0.21 0.00 -0.39 0.00 0.00 64.86 64.35 1y9j h ILE 10 Cb 0.04 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 33.76 1y9j h ILE 10 CO -0.01 0.00 0.64 -0.09 -0.69 0.00 0.00 178.15 178.00 1y9j h ARG 11 N -1.08 0.00 0.05 2.37 9.65 -1.98 0.73 114.38 124.13 1y9j h ARG 11 Ca -0.07 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.81 1y9j h ARG 11 Cb 0.54 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.12 1y9j h ARG 11 CO 0.12 0.00 -0.02 0.93 2.80 0.00 0.00 179.97 183.79 1y9j h GLU 12 N 0.00 -0.07 -0.89 0.20 4.39 -1.30 -2.81 114.58 114.10 1y9j h GLU 12 Ca 0.34 0.00 0.15 0.00 0.34 0.00 0.00 59.36 60.19 1y9j h GLU 12 Cb 1.61 0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 30.21 1y9j h GLU 12 CO -0.00 0.21 0.58 0.00 -1.16 0.00 0.00 179.01 178.63 1y9j h ARG 13 N -0.34 0.65 -0.31 2.33 3.08 -0.68 -0.85 114.38 118.26 1y9j h ARG 13 Ca -0.01 -0.04 0.06 0.00 0.07 0.00 0.00 59.98 60.07 1y9j h ARG 13 Cb 0.30 -0.15 -0.06 0.00 0.08 0.00 0.00 29.97 30.15 1y9j h ARG 13 CO 0.01 0.43 -0.09 1.96 -1.07 0.00 0.00 179.97 181.21 1y9j h GLN 14 N 0.67 -0.02 0.00 0.04 4.20 -1.24 -0.21 115.11 118.55 1y9j h GLN 14 Ca 0.45 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 59.12 1y9j h GLN 14 Cb 0.76 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.53 1y9j h GLN 14 CO -0.21 -0.01 -0.20 1.79 -0.67 0.00 0.00 178.83 179.54 1y9j h THR 15 N -0.02 0.64 -0.02 -0.54 1.35 -1.07 -2.93 112.91 110.32 1y9j h THR 15 Ca 0.15 -0.87 0.03 0.00 -0.55 0.00 0.00 66.41 65.18 1y9j h THR 15 Cb 0.24 1.56 -0.05 0.00 -1.73 0.00 0.00 68.15 68.17 1y9j h THR 15 CO -0.33 0.19 -0.25 0.58 -0.25 0.00 0.00 175.52 175.46 1y9j h VAL 16 N 0.00 0.42 -0.14 6.82 2.07 -0.34 1.52 116.25 126.60 1y9j h VAL 16 Ca -0.00 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 1y9j h VAL 16 Cb 0.54 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1y9j h VAL 16 CO 0.03 0.00 -0.13 0.00 0.02 0.00 0.00 177.57 177.48 1y9j h ALA 17 N 0.46 1.53 0.47 1.67 0.00 -1.43 -2.78 119.26 119.16 1y9j h ALA 17 Ca 0.07 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1y9j h ALA 17 Cb 0.48 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1y9j h ALA 17 CO -0.24 0.34 -0.23 -0.07 0.00 0.00 0.00 179.25 179.06 1y9j h LEU 18 N 0.21 -0.53 -1.76 0.00 3.38 -0.86 -2.69 115.31 113.06 1y9j h LEU 18 Ca 0.04 0.02 0.08 0.00 0.09 0.00 0.00 57.88 58.11 1y9j h LEU 18 Cb 0.37 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1y9j h LEU 18 CO 0.02 -0.12 0.51 0.11 0.09 0.00 0.00 178.44 179.05 1y9j h LYS 19 N -1.15 0.00 0.00 1.13 1.57 0.21 0.51 116.57 118.85 1y9j h LYS 19 Ca -0.06 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 58.52 1y9j h LYS 19 Cb 0.48 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.76 1y9j h LYS 19 CO 0.11 0.00 -1.26 0.00 -0.57 0.00 0.00 179.45 177.72 1y9j h ARG 20 N 0.00 0.00 0.08 3.15 3.08 -1.49 -2.78 114.38 116.43 1y9j h ARG 20 Ca 0.13 0.00 -0.31 0.00 0.07 0.00 0.00 59.98 59.87 1y9j h ARG 20 Cb 1.15 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.18 1y9j h ARG 20 CO -0.00 0.52 -1.71 0.00 -1.07 0.00 0.00 179.97 177.71 1y9j h MET 21 N 0.00 0.18 -0.62 0.04 -0.00 0.22 -3.27 114.93 111.48 1y9j h MET 21 Ca -0.14 -0.30 0.00 0.00 -0.00 0.00 0.00 59.70 59.26 1y9j h MET 21 Cb 1.71 0.11 0.00 0.00 -0.00 0.00 0.00 31.60 33.42 1y9j h MET 21 CO 0.07 1.14 0.00 1.47 -0.00 0.00 0.00 176.91 179.60 1y9j n LEU 22 N -3.84 4.50 0.04 -0.10 -0.00 0.47 -4.65 117.00 113.43 1y9j n LEU 22 Ca -0.32 -2.40 0.00 0.00 -0.00 0.00 0.00 56.01 53.30 1y9j n LEU 22 Cb 0.91 -0.54 0.00 0.00 -0.00 0.00 0.00 43.42 43.79 1y9j n LEU 22 CO 0.35 0.82 -0.09 -3.20 -0.00 0.00 0.00 177.39 175.27 1y9j n ASN 23 N 1.05 0.06 -4.48 1.45 2.85 -1.13 -4.81 115.26 110.25 1y9j n ASN 23 Ca 0.24 0.14 -0.42 0.00 -0.11 0.00 0.00 54.58 54.43 1y9j n ASN 23 Cb 0.83 0.08 -0.04 0.00 1.24 0.00 0.00 39.78 41.89 1y9j n ASN 23 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 1y9j s PHE 24 N -2.00 2.56 0.16 1.20 5.36 -1.06 -5.00 117.98 119.20 1y9j s PHE 24 Ca 0.00 -0.42 -0.30 0.00 -0.96 0.00 0.00 56.93 55.25 1y9j s PHE 24 Cb 0.00 -4.40 -0.08 0.00 -0.34 0.00 0.00 43.02 38.20 1y9j s PHE 24 CO 0.00 -1.78 1.32 0.54 -1.46 0.00 0.00 175.22 173.84 1y9j s ASN 25 N 3.71 6.90 0.54 6.13 4.22 -1.26 -4.67 114.94 130.51 1y9j s ASN 25 Ca 0.26 2.34 -0.19 0.00 -2.14 0.00 0.00 52.86 53.14 1y9j s ASN 25 Cb -0.14 -2.60 -0.06 0.00 1.28 0.00 0.00 41.25 39.73 1y9j s ASN 25 CO 0.11 -0.55 1.09 0.68 -2.04 0.00 0.00 177.10 176.39 1y9j s VAL 26 N 0.45 3.43 -0.83 3.54 -7.23 -1.26 -4.85 120.40 113.65 1y9j s VAL 26 Ca 0.59 0.85 -0.22 0.00 -1.81 0.00 0.00 61.98 61.39 1y9j s VAL 26 Cb -0.36 -3.33 -0.20 0.00 0.56 0.00 0.00 36.38 33.05 1y9j s VAL 26 CO 0.35 -0.23 2.41 -2.65 -0.31 0.00 0.00 175.10 174.67 1y9j n PRO 27 N -1.35 0.37 -2.55 4.82 -0.02 -1.26 -4.90 135.00 130.12 1y9j n PRO 27 Ca 0.10 -0.23 -0.25 0.00 -2.02 0.00 0.00 63.50 61.11 1y9j n PRO 27 Cb 0.52 -2.37 0.03 0.00 -0.02 0.00 0.00 33.50 31.66 1y9j n PRO 27 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1y9j s HIS 28 N 8.74 3.17 -0.66 6.00 -3.43 -1.26 -5.03 115.29 122.82 1y9j s HIS 28 Ca 1.15 0.46 -0.20 0.00 -0.80 0.00 0.00 55.06 55.67 1y9j s HIS 28 Cb -0.61 -2.68 0.10 0.00 -1.43 0.00 0.00 32.58 27.96 1y9j s HIS 28 CO 0.36 -0.77 0.83 0.08 -2.00 0.00 0.00 174.74 173.23 1y9j s VAL 29 N -2.88 4.70 -0.32 -5.38 1.01 -1.26 -5.02 120.40 111.25 1y9j s VAL 29 Ca 0.53 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 61.45 1y9j s VAL 29 Cb -0.10 -4.58 -0.03 0.00 0.00 0.00 0.00 36.38 31.67 1y9j s VAL 29 CO 0.43 -1.26 0.22 -1.59 0.00 0.00 0.00 175.10 172.89 1y9j s LYS 30 N 2.97 3.66 0.22 2.72 -2.85 -1.26 -4.95 119.74 120.24 1y9j s LYS 30 Ca 0.17 -0.52 0.07 0.00 -1.00 0.00 0.00 55.97 54.69 1y9j s LYS 30 Cb -0.19 -3.74 0.15 0.00 -2.06 0.00 0.00 37.83 31.99 1y9j s LYS 30 CO 0.05 -0.34 1.49 -0.97 0.10 0.00 0.00 175.35 175.68 1y9j h ASN 31 N 8.44 0.08 -2.82 0.03 -1.24 -2.05 -3.41 115.58 114.62 1y9j h ASN 31 Ca -0.33 -0.06 -0.49 0.00 0.71 0.00 0.00 56.30 56.13 1y9j h ASN 31 Cb 1.17 -0.02 -0.40 0.00 0.73 0.00 0.00 38.32 39.80 1y9j h ASN 31 CO 0.60 0.80 -0.76 -0.44 -1.29 0.00 0.00 177.43 176.34 1y9j s SER 32 N -6.84 3.06 -0.21 1.15 0.01 -1.26 -5.11 113.70 104.50 1y9j s SER 32 Ca -0.01 -1.05 -0.29 0.00 1.31 0.00 0.00 55.95 55.90 1y9j s SER 32 Cb 0.12 -0.25 -0.03 0.00 0.21 0.00 0.00 66.02 66.06 1y9j s SER 32 CO 0.79 -0.41 1.72 -2.16 0.41 0.00 0.00 173.24 173.59 1y9j s PRO 33 N 2.13 3.72 0.00 12.44 0.04 -1.26 -4.45 135.00 147.62 1y9j s PRO 33 Ca 0.07 1.76 0.00 0.00 0.04 0.00 0.00 61.00 62.87 1y9j s PRO 33 Cb -0.16 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.29 1y9j s PRO 33 CO -0.29 -1.39 0.00 0.41 0.04 0.00 0.00 177.00 175.77 1y9j n GLY 34 N 4.83 -0.11 3.91 0.56 0.00 -1.26 -5.15 105.19 107.97 1y9j n GLY 34 Ca 0.20 -0.02 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.51 3.62 0.93 1.61 8.01 -1.26 -5.08 118.70 125.02 1y9j s GLU 35 Ca 0.00 0.05 -0.11 0.00 0.01 0.00 0.00 54.97 54.92 1y9j s GLU 35 Cb 0.00 -2.57 0.15 0.00 -4.31 0.00 0.00 34.13 27.40 1y9j s GLU 35 CO 0.00 0.11 1.09 -1.25 0.01 0.00 0.00 175.26 175.22 1y9j s PRO 36 N -3.87 0.96 -0.62 0.39 0.04 -1.26 -4.98 135.00 125.66 1y9j s PRO 36 Ca 0.45 1.01 -0.18 0.00 0.04 0.00 0.00 61.00 62.32 1y9j s PRO 36 Cb -0.10 -1.76 0.12 0.00 0.04 0.00 0.00 34.50 32.80 1y9j s PRO 36 CO 0.33 -2.50 0.68 0.08 0.04 0.00 0.00 177.00 175.63 1y9j s VAL 37 N -2.80 5.00 0.23 -0.36 1.01 -1.26 -5.05 120.40 117.18 1y9j s VAL 37 Ca 0.65 -1.32 -0.30 0.00 0.00 0.00 0.00 61.98 61.01 1y9j s VAL 37 Cb -0.20 -4.46 -0.09 0.00 0.00 0.00 0.00 36.38 31.63 1y9j s VAL 37 CO 0.58 -1.07 1.01 0.26 0.00 0.00 0.00 175.10 175.88 1y9j s TRP 38 N 2.13 3.80 -0.10 5.22 0.52 -1.26 -4.94 118.94 124.32 1y9j s TRP 38 Ca 0.11 1.80 0.02 0.00 0.02 0.00 0.00 56.10 58.05 1y9j s TRP 38 Cb -0.23 -3.11 0.02 0.00 -1.15 0.00 0.00 33.47 28.99 1y9j s TRP 38 CO 0.03 0.01 -0.13 0.15 0.02 0.00 0.00 176.95 177.03 1y9j s LYS 39 N -1.00 1.97 0.40 4.98 1.02 -0.45 -3.84 119.74 122.82 1y9j s LYS 39 Ca 0.44 -0.47 -0.06 0.00 0.02 0.00 0.00 55.97 55.89 1y9j s LYS 39 Cb -0.28 -1.71 -0.05 0.00 -0.52 0.00 0.00 37.83 35.27 1y9j s LYS 39 CO 0.35 -0.07 0.71 0.08 -0.92 0.00 0.00 175.35 175.50 1y9j s VAL 40 N 1.00 4.91 -0.05 3.17 1.01 0.14 -2.84 120.40 127.75 1y9j s VAL 40 Ca -0.07 0.26 -0.02 0.00 0.00 0.00 0.00 61.98 62.14 1y9j s VAL 40 Cb -0.15 -3.79 0.03 0.00 0.00 0.00 0.00 36.38 32.47 1y9j s VAL 40 CO -0.01 -0.61 0.10 -0.22 0.00 0.00 0.00 175.10 174.37 1y9j s LEU 41 N -4.16 1.06 -0.25 3.92 2.96 -0.73 0.17 118.68 121.64 1y9j s LEU 41 Ca 0.47 0.20 0.00 0.00 -0.22 0.00 0.00 54.13 54.59 1y9j s LEU 41 Cb -0.10 0.24 0.07 0.00 0.50 0.00 0.00 46.19 46.90 1y9j s LEU 41 CO 0.36 -0.11 0.00 -0.63 -1.32 0.00 0.00 176.35 174.65 1y9j s ILE 42 N 0.85 1.32 0.49 6.68 1.09 0.56 -1.74 121.20 130.45 1y9j s ILE 42 Ca -0.07 -1.26 0.07 0.00 -1.10 0.00 0.00 60.65 58.29 1y9j s ILE 42 Cb -0.09 -1.74 0.01 0.00 -1.06 0.00 0.00 42.46 39.59 1y9j s ILE 42 CO -0.04 -0.28 0.40 -0.72 -0.10 0.00 0.00 174.94 174.21 1y9j s TYR 43 N 1.46 2.06 0.10 3.97 -0.85 -0.99 -1.60 117.35 121.50 1y9j s TYR 43 Ca -0.00 -0.70 0.00 0.00 -0.52 0.00 0.00 57.07 55.85 1y9j s TYR 43 Cb -0.18 -2.02 -0.00 0.00 0.38 0.00 0.00 41.96 40.13 1y9j s TYR 43 CO -0.10 -0.35 0.01 -0.25 -1.52 0.00 0.00 175.55 173.34 1y9j n ASP 44 N -1.68 1.98 -0.35 -0.18 8.00 -1.24 -3.02 116.55 120.06 1y9j n ASP 44 Ca 0.01 -1.45 0.24 0.00 0.71 0.00 0.00 54.79 54.30 1y9j n ASP 44 Cb 0.63 0.11 0.48 0.00 -0.02 0.00 0.00 41.12 42.32 1y9j n ASP 44 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 1y9j h ARG 45 N 0.00 0.35 0.06 -1.24 -0.00 -2.00 0.67 114.38 112.21 1y9j h ARG 45 Ca -0.08 -0.02 -0.15 0.00 -0.00 0.00 0.00 59.98 59.73 1y9j h ARG 45 Cb 0.26 -0.08 -0.00 0.00 -0.00 0.00 0.00 29.97 30.15 1y9j h ARG 45 CO 0.13 0.23 -0.74 0.74 -0.00 0.00 0.00 179.97 180.34 1y9j h PHE 46 N 0.36 0.22 -1.30 4.08 -1.00 -1.94 -2.87 116.94 114.49 1y9j h PHE 46 Ca 0.71 -0.16 0.38 0.00 2.81 0.00 0.00 57.97 61.70 1y9j h PHE 46 Cb 1.67 -0.01 -0.05 0.00 3.61 0.00 0.00 35.95 41.17 1y9j h PHE 46 CO -0.01 1.29 0.95 0.78 -1.61 0.00 0.00 178.31 179.71 1y9j h GLY 47 N -0.62 0.00 1.08 -1.45 0.00 -1.17 0.94 103.07 101.85 1y9j h GLY 47 Ca -0.16 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.86 1y9j h GLY 47 CO 0.01 0.00 -1.65 0.06 0.00 0.00 0.00 176.54 174.96 1y9j h GLN 48 N 0.00 0.17 0.00 4.80 3.07 -1.05 -1.54 115.11 120.55 1y9j h GLN 48 Ca 0.62 -0.29 0.00 0.00 0.09 0.00 0.00 58.65 59.07 1y9j h GLN 48 Cb 2.50 0.11 0.00 0.00 0.08 0.00 0.00 27.48 30.17 1y9j h GLN 48 CO -0.01 0.95 0.00 -0.25 0.09 0.00 0.00 178.83 179.62 1y9j n ASP 49 N -3.34 0.15 0.00 0.06 8.00 0.32 -2.07 116.55 119.67 1y9j n ASP 49 Ca -0.19 0.56 0.00 0.00 0.71 0.00 0.00 54.79 55.87 1y9j n ASP 49 Cb 1.04 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 1y9j n ASP 49 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1y9j n ILE 50 N -1.69 0.00 -0.08 0.53 -0.00 -0.62 -4.63 119.36 112.88 1y9j n ILE 50 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 62.75 62.63 1y9j n ILE 50 Cb 0.05 -0.51 -0.05 0.00 -0.00 0.00 0.00 39.64 39.13 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 1.32 0.64 1.39 2.10 -1.24 -3.20 117.51 118.51 1y9j h ILE 51 Ca 0.00 -1.31 -0.03 0.00 1.08 0.00 0.00 64.86 64.60 1y9j h ILE 51 Cb 0.84 1.67 0.01 0.00 -1.09 0.00 0.00 36.82 38.25 1y9j h ILE 51 CO 0.00 0.40 -0.31 -1.28 -1.08 0.00 0.00 178.15 175.89 1y9j h SER 52 N 0.21 -0.73 -0.69 2.19 0.87 -1.53 0.95 113.55 114.83 1y9j h SER 52 Ca 0.04 0.02 0.20 0.00 -1.23 0.00 0.00 61.79 60.82 1y9j h SER 52 Cb 0.71 0.19 -0.03 0.00 -0.44 0.00 0.00 62.40 62.83 1y9j h SER 52 CO 0.05 -0.51 0.76 -0.65 -0.53 0.00 0.00 176.83 175.95 1y9j h PRO 53 N -0.89 0.00 0.00 2.24 0.11 -1.75 0.46 132.00 132.17 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 0.67 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.78 1y9j h PRO 53 CO 0.14 0.00 -0.01 1.28 -0.21 0.00 0.00 178.00 179.20 1y9j n LEU 54 N -3.55 2.01 -3.51 2.35 4.77 -0.98 -5.05 117.00 113.04 1y9j n LEU 54 Ca 0.14 -2.35 -0.11 0.00 -0.03 0.00 0.00 56.01 53.66 1y9j n LEU 54 Cb 1.00 -0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.87 1y9j n LEU 54 CO 0.27 0.56 0.61 -0.22 -1.33 0.00 0.00 177.39 177.28 1y9j s LEU 55 N -1.72 -0.46 0.37 2.23 0.20 0.33 -5.02 118.68 114.61 1y9j s LEU 55 Ca 0.13 0.23 0.04 0.00 0.69 0.00 0.00 54.13 55.22 1y9j s LEU 55 Cb 0.12 2.18 -0.04 0.00 -0.43 0.00 0.00 46.19 48.02 1y9j s LEU 55 CO 0.01 -0.61 0.12 -0.44 -0.29 0.00 0.00 176.35 175.14 1y9j s SER 56 N -1.95 2.44 0.04 3.68 0.01 -1.26 -3.88 113.70 112.78 1y9j s SER 56 Ca -0.00 -1.58 -0.24 0.00 1.31 0.00 0.00 55.95 55.44 1y9j s SER 56 Cb -0.01 0.34 -0.17 0.00 0.21 0.00 0.00 66.02 66.40 1y9j s SER 56 CO -0.04 -0.84 1.52 0.58 0.41 0.00 0.00 173.24 174.88 1y9j h VAL 57 N 1.95 1.18 -0.41 3.43 2.07 -1.98 0.32 116.25 122.81 1y9j h VAL 57 Ca -0.36 -0.55 -0.04 0.00 0.82 0.00 0.00 66.70 66.56 1y9j h VAL 57 Cb 1.26 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 32.53 1y9j h VAL 57 CO 0.59 0.15 0.07 0.07 0.02 0.00 0.00 177.57 178.47 1y9j h LYS 58 N -0.19 0.62 0.00 1.57 2.10 -1.99 -1.45 116.57 117.23 1y9j h LYS 58 Ca 0.01 -0.12 -0.18 0.00 -2.00 0.00 0.00 60.65 58.36 1y9j h LYS 58 Cb 0.23 -0.10 -0.02 0.00 -0.90 0.00 0.00 32.23 31.45 1y9j h LYS 58 CO 0.00 0.59 -0.83 0.93 -2.00 0.00 0.00 179.45 178.14 1y9j h GLU 59 N 0.60 0.08 -0.00 0.07 4.39 -1.93 -0.16 114.58 117.63 1y9j h GLU 59 Ca 0.13 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.75 1y9j h GLU 59 Cb 0.27 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1y9j h GLU 59 CO 0.00 0.87 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.64 1y9j h LEU 60 N 0.05 -0.02 -0.38 1.33 3.38 0.48 0.21 115.31 120.35 1y9j h LEU 60 Ca -0.02 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.86 1y9j h LEU 60 Cb 1.46 0.01 -0.01 0.00 0.09 0.00 0.00 40.66 42.20 1y9j h LEU 60 CO 0.12 -0.01 -0.45 0.03 0.09 0.00 0.00 178.44 178.22 1y9j h ARG 61 N -0.01 0.00 0.00 1.13 2.47 -1.31 -2.61 114.38 114.05 1y9j h ARG 61 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1y9j h ARG 61 Cb 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.33 1y9j h ARG 61 CO -0.01 0.45 0.00 -3.47 0.56 0.00 0.00 179.97 177.50 1y9j n ASP 62 N -3.33 0.72 0.10 7.04 -0.08 -0.08 -3.23 116.55 117.69 1y9j n ASP 62 Ca 0.01 0.57 0.11 0.00 -1.51 0.00 0.00 54.79 53.98 1y9j n ASP 62 Cb 0.64 -0.76 -0.01 0.00 2.34 0.00 0.00 41.12 43.33 1y9j n ASP 62 CO 0.00 0.00 0.00 0.23 0.12 0.00 0.00 177.20 177.55 1y9j n MET 63 N -2.18 0.61 0.00 -0.67 2.81 0.69 -4.95 117.12 113.43 1y9j n MET 63 Ca 0.06 0.10 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 1y9j n MET 63 Cb 0.41 -1.81 0.00 0.00 -0.71 0.00 0.00 33.22 31.12 1y9j n MET 63 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1y9j n GLY 64 N 1.19 1.53 3.75 3.03 0.00 -1.20 -4.92 105.19 108.58 1y9j n GLY 64 Ca -0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.95 5.37 -0.13 -0.61 2.07 -0.99 -1.34 121.20 123.62 1y9j s ILE 65 Ca 0.00 0.35 0.19 0.00 -1.41 0.00 0.00 60.65 59.78 1y9j s ILE 65 Cb 0.00 -3.53 -0.17 0.00 0.13 0.00 0.00 42.46 38.89 1y9j s ILE 65 CO 0.00 0.45 0.69 1.07 -1.91 0.00 0.00 174.94 175.24 1y9j n THR 66 N 3.25 0.89 -3.64 4.00 5.66 -1.13 -4.60 114.28 118.71 1y9j n THR 66 Ca -0.15 -0.65 -0.05 0.00 -3.05 0.00 0.00 64.05 60.14 1y9j n THR 66 Cb 0.52 -0.49 -0.07 0.00 -1.55 0.00 0.00 70.33 68.75 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 -5.42 -0.50 -0.22 1.09 1.98 -1.26 -5.04 118.68 109.30 1y9j s LEU 67 Ca -0.04 0.86 -0.00 0.00 -2.89 0.00 0.00 54.13 52.06 1y9j s LEU 67 Cb 0.09 1.82 0.03 0.00 0.66 0.00 0.00 46.19 48.79 1y9j s LEU 67 CO 0.83 -0.14 -0.11 -1.38 -1.89 0.00 0.00 176.35 173.65 1y9j s HIS 68 N 0.93 2.99 0.17 5.38 -3.43 -1.26 -1.78 115.29 118.30 1y9j s HIS 68 Ca -0.04 -1.66 0.04 0.00 -0.80 0.00 0.00 55.06 52.59 1y9j s HIS 68 Cb -0.04 -1.99 -0.05 0.00 -1.43 0.00 0.00 32.58 29.07 1y9j s HIS 68 CO -0.12 -0.77 -0.06 -1.17 -2.00 0.00 0.00 174.74 170.62 1y9j s LEU 69 N 1.29 2.39 -0.20 5.38 0.20 -0.71 -5.02 118.68 122.00 1y9j s LEU 69 Ca 0.01 -1.09 -0.12 0.00 0.69 0.00 0.00 54.13 53.62 1y9j s LEU 69 Cb -0.16 -0.28 -0.05 0.00 -0.43 0.00 0.00 46.19 45.28 1y9j s LEU 69 CO -0.07 -0.42 0.23 -0.76 -0.29 0.00 0.00 176.35 175.04 1y9j s LEU 70 N -3.20 4.19 0.60 -0.68 1.43 -1.26 -2.35 118.68 117.41 1y9j s LEU 70 Ca 0.21 0.33 0.28 0.00 -1.03 0.00 0.00 54.13 53.92 1y9j s LEU 70 Cb 0.04 -2.25 1.28 0.00 0.03 0.00 0.00 46.19 45.28 1y9j s LEU 70 CO 0.03 0.08 1.68 -0.07 0.23 0.00 0.00 176.35 178.30 1y9j h LEU 71 N 7.04 0.00 -3.99 1.79 4.07 -1.84 0.65 115.31 123.03 1y9j h LEU 71 Ca -0.39 0.00 -0.59 0.00 0.08 0.00 0.00 57.88 56.97 1y9j h LEU 71 Cb 1.16 0.00 -0.30 0.00 1.08 0.00 0.00 40.66 42.60 1y9j h LEU 71 CO 0.73 0.00 0.75 1.57 -1.08 0.00 0.00 178.44 180.40 1y9j n HIS 72 N -3.46 3.13 -3.92 1.13 -0.00 -1.26 -4.93 115.22 105.91 1y9j n HIS 72 Ca 0.12 -2.41 -0.10 0.00 0.46 0.00 0.00 57.72 55.80 1y9j n HIS 72 Cb 0.94 -1.18 -0.10 0.00 -0.12 0.00 0.00 29.99 29.54 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 -1.58 0.14 -0.70 0.26 0.01 0.23 -5.08 113.70 106.98 1y9j s SER 73 Ca 0.61 -0.43 -0.30 0.00 1.31 0.00 0.00 55.95 57.13 1y9j s SER 73 Cb 0.49 0.20 -0.15 0.00 0.21 0.00 0.00 66.02 66.78 1y9j s SER 73 CO 0.05 -0.44 2.50 0.47 0.41 0.00 0.00 173.24 176.24 1y9j n ASP 74 N 1.08 1.31 -4.75 2.44 8.00 -1.26 -4.78 116.55 118.58 1y9j n ASP 74 Ca -0.21 -0.02 -0.41 0.00 0.71 0.00 0.00 54.79 54.86 1y9j n ASP 74 Cb 0.57 -1.21 -0.03 0.00 -0.02 0.00 0.00 41.12 40.43 1y9j n ASP 74 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1y9j s ARG 75 N 8.23 4.41 0.20 -1.24 0.52 -1.26 -5.01 118.95 124.80 1y9j s ARG 75 Ca 1.18 2.09 -0.11 0.00 -0.52 0.00 0.00 55.73 58.37 1y9j s ARG 75 Cb -0.82 -3.14 -0.07 0.00 0.52 0.00 0.00 34.95 31.44 1y9j s ARG 75 CO 0.41 -0.17 0.54 -0.51 0.02 0.00 0.00 175.30 175.60 1y9j s ASP 76 N -0.14 6.68 -0.48 0.23 1.11 -1.26 -5.04 116.67 117.78 1y9j s ASP 76 Ca 0.52 0.96 -0.28 0.00 0.18 0.00 0.00 52.55 53.93 1y9j s ASP 76 Cb -0.37 -2.24 0.03 0.00 1.07 0.00 0.00 42.92 41.41 1y9j s ASP 76 CO 0.44 -0.02 1.07 -2.16 1.18 0.00 0.00 175.17 175.68 1y9j s PRO 77 N -2.56 3.66 -0.37 8.23 0.04 -1.26 -4.74 135.00 138.00 1y9j s PRO 77 Ca 0.44 0.42 0.13 0.00 0.04 0.00 0.00 61.00 62.04 1y9j s PRO 77 Cb -0.12 -3.92 0.40 0.00 0.04 0.00 0.00 34.50 30.90 1y9j s PRO 77 CO 0.20 -1.34 0.87 -0.89 0.04 0.00 0.00 177.00 175.89 1y9j n ILE 78 N 6.72 0.79 0.29 0.56 -0.00 0.45 -4.91 119.36 123.26 1y9j n ILE 78 Ca 0.10 -4.05 0.17 0.00 -0.00 0.00 0.00 62.75 58.97 1y9j n ILE 78 Cb 0.49 -0.04 0.90 0.00 -0.00 0.00 0.00 39.64 40.99 1y9j n ILE 78 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.55 176.63 1y9j h ARG 79 N 2.96 0.00 0.00 0.38 0.11 0.66 -1.96 114.38 116.53 1y9j h ARG 79 Ca 0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.11 1y9j h ARG 79 Cb 1.02 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.10 1y9j h ARG 79 CO 0.55 0.05 0.00 -3.47 0.10 0.00 0.00 179.97 177.20 1y9j n ASP 80 N -3.41 0.00 -3.82 0.08 2.03 -1.26 -2.50 116.55 107.67 1y9j n ASP 80 Ca -0.02 -1.43 -0.13 0.00 0.52 0.00 0.00 54.79 53.74 1y9j n ASP 80 Cb 0.18 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 40.44 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 -2.00 -0.01 0.35 5.18 1.01 -0.74 -4.96 120.40 119.22 1y9j s VAL 81 Ca 0.25 0.04 -0.29 0.00 0.00 0.00 0.00 61.98 61.99 1y9j s VAL 81 Cb 0.12 -0.16 -0.11 0.00 0.00 0.00 0.00 36.38 36.23 1y9j s VAL 81 CO 0.19 0.02 1.51 -2.16 0.00 0.00 0.00 175.10 174.66 1y9j s PRO 82 N 0.30 4.13 0.23 2.72 0.04 -1.25 -2.26 135.00 138.91 1y9j s PRO 82 Ca -0.02 2.55 0.10 0.00 0.04 0.00 0.00 61.00 63.67 1y9j s PRO 82 Cb -0.03 -2.99 -0.04 0.00 0.04 0.00 0.00 34.50 31.47 1y9j s PRO 82 CO -0.01 -0.54 -0.12 0.00 0.04 0.00 0.00 177.00 176.37 1y9j s ALA 83 N -0.78 2.89 0.07 8.56 0.00 -1.06 0.27 121.76 131.70 1y9j s ALA 83 Ca 0.56 -1.66 0.07 0.00 0.00 0.00 0.00 51.96 50.93 1y9j s ALA 83 Cb -0.46 -0.56 -0.03 0.00 0.00 0.00 0.00 23.12 22.07 1y9j s ALA 83 CO 0.58 0.36 -0.20 0.08 0.00 0.00 0.00 175.76 176.57 1y9j s VAL 84 N -2.09 1.63 -0.33 0.00 1.01 0.45 0.12 120.40 121.19 1y9j s VAL 84 Ca 0.27 -1.35 -0.01 0.00 0.00 0.00 0.00 61.98 60.89 1y9j s VAL 84 Cb -0.07 -1.46 0.12 0.00 0.00 0.00 0.00 36.38 34.97 1y9j s VAL 84 CO 0.16 0.06 0.17 -0.31 0.00 0.00 0.00 175.10 175.17 1y9j s TYR 85 N -0.98 0.79 -0.65 5.22 1.51 0.29 0.21 117.35 123.74 1y9j s TYR 85 Ca 0.06 -1.43 -0.11 0.00 -1.01 0.00 0.00 57.07 54.58 1y9j s TYR 85 Cb -0.09 -1.09 0.17 0.00 -0.11 0.00 0.00 41.96 40.84 1y9j s TYR 85 CO 0.03 -0.83 0.56 0.12 -1.11 0.00 0.00 175.55 174.32 1y9j s PHE 86 N 1.46 3.52 0.30 2.71 5.36 -0.63 0.14 117.98 130.84 1y9j s PHE 86 Ca 0.14 -1.94 -0.03 0.00 -0.96 0.00 0.00 56.93 54.14 1y9j s PHE 86 Cb -0.20 -3.64 -0.01 0.00 -0.34 0.00 0.00 43.02 38.83 1y9j s PHE 86 CO -0.16 -0.97 0.39 0.14 -1.46 0.00 0.00 175.22 173.15 1y9j s VAL 87 N 0.70 0.00 0.45 3.12 -7.23 0.29 -3.66 120.40 114.08 1y9j s VAL 87 Ca 0.12 -1.69 -0.22 0.00 -1.81 0.00 0.00 61.98 58.38 1y9j s VAL 87 Cb -0.20 -2.52 -0.09 0.00 0.56 0.00 0.00 36.38 34.13 1y9j s VAL 87 CO -0.04 0.00 1.02 -0.32 -0.31 0.00 0.00 175.10 175.46 1y9j s MET 88 N -3.47 3.99 -0.17 4.82 1.75 -1.26 -2.80 119.30 122.15 1y9j s MET 88 Ca 0.32 1.36 -0.02 0.00 -1.25 0.00 0.00 55.69 56.10 1y9j s MET 88 Cb 0.01 -2.25 0.05 0.00 2.84 0.00 0.00 34.83 35.48 1y9j s MET 88 CO 0.18 -0.27 2.33 -0.35 -0.65 0.00 0.00 175.02 176.26 1y9j n PRO 89 N -0.63 1.61 -1.92 4.11 -0.04 -1.26 -4.61 135.00 132.26 1y9j n PRO 89 Ca 0.08 -1.00 -0.32 0.00 -0.04 0.00 0.00 63.50 62.21 1y9j n PRO 89 Cb 0.52 -1.51 0.02 0.00 -0.04 0.00 0.00 33.50 32.49 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 -0.97 3.79 0.26 0.52 -4.23 -1.26 -4.68 115.64 109.07 1y9j s THR 90 Ca 0.28 0.79 -0.05 0.00 -1.18 0.00 0.00 61.69 61.53 1y9j s THR 90 Cb 0.18 -3.35 0.31 0.00 1.34 0.00 0.00 72.50 70.98 1y9j s THR 90 CO -0.03 -0.56 1.62 -0.33 -0.54 0.00 0.00 174.62 174.78 1y9j h GLU 91 N 0.16 0.09 -0.24 3.99 5.08 -1.99 0.67 114.58 122.33 1y9j h GLU 91 Ca -0.46 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 57.79 1y9j h GLU 91 Cb 1.22 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 1y9j h GLU 91 CO 0.57 0.06 -0.27 1.05 -1.00 0.00 0.00 179.01 179.42 1y9j h GLU 92 N 0.09 0.48 -0.34 2.33 9.09 -1.96 -2.74 114.58 121.53 1y9j h GLU 92 Ca 0.46 -0.19 -0.13 0.00 0.05 0.00 0.00 59.36 59.55 1y9j h GLU 92 Cb 0.84 -0.03 -0.01 0.00 -1.65 0.00 0.00 28.75 27.91 1y9j h GLU 92 CO -0.73 0.71 -0.30 -0.91 0.05 0.00 0.00 179.01 177.83 1y9j h ASN 93 N 0.42 0.86 -0.44 3.06 4.21 -0.20 -2.41 115.58 121.07 1y9j h ASN 93 Ca 0.06 -0.46 0.03 0.00 1.21 0.00 0.00 56.30 57.14 1y9j h ASN 93 Cb 0.69 -0.24 -0.02 0.00 -1.12 0.00 0.00 38.32 37.63 1y9j h ASN 93 CO 0.05 1.13 0.30 0.40 -1.29 0.00 0.00 177.43 178.02 1y9j h ILE 94 N 0.59 1.04 0.00 2.81 1.08 0.13 0.68 117.51 123.84 1y9j h ILE 94 Ca 0.06 -0.17 -0.13 0.00 -0.39 0.00 0.00 64.86 64.23 1y9j h ILE 94 Cb 0.88 0.51 -0.02 0.00 -3.07 0.00 0.00 36.82 35.12 1y9j h ILE 94 CO 0.08 0.09 -0.62 0.44 -0.69 0.00 0.00 178.15 177.45 1y9j h ASP 95 N 0.49 0.00 -0.40 1.72 5.19 -1.30 -3.07 116.42 119.05 1y9j h ASP 95 Ca 0.18 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.45 1y9j h ASP 95 Cb 0.11 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.60 1y9j h ASP 95 CO -0.04 0.62 -0.27 0.03 -3.12 0.00 0.00 179.24 176.46 1y9j h ARG 96 N 0.00 0.92 -0.02 3.56 2.47 -0.39 -1.23 114.38 119.69 1y9j h ARG 96 Ca -0.01 -0.42 0.00 0.00 -1.26 0.00 0.00 59.98 58.30 1y9j h ARG 96 Cb 1.20 -0.02 -0.00 0.00 -1.65 0.00 0.00 29.97 29.50 1y9j h ARG 96 CO 0.08 1.07 0.01 -0.07 0.56 0.00 0.00 179.97 181.63 1y9j h LEU 97 N 0.78 0.02 -1.77 3.04 -0.00 -1.24 0.10 115.31 116.26 1y9j h LEU 97 Ca 0.09 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.93 1y9j h LEU 97 Cb 0.84 -0.01 -0.00 0.00 -0.00 0.00 0.00 40.66 41.49 1y9j h LEU 97 CO 0.07 0.03 -0.16 0.00 -0.00 0.00 0.00 178.44 178.38 1y9j h GLN 99 N 0.00 0.24 0.00 0.00 4.20 -0.31 -1.62 115.11 117.61 1y9j h GLN 99 Ca -0.00 -0.19 -0.17 0.00 0.06 0.00 0.00 58.65 58.34 1y9j h GLN 99 Cb 0.38 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1y9j h GLN 99 CO 0.02 0.84 -0.83 0.38 -0.67 0.00 0.00 178.83 178.57 1y9j h ASP 100 N -0.31 0.00 0.73 1.46 3.04 -0.55 -2.89 116.42 117.90 1y9j h ASP 100 Ca -0.01 0.00 -0.17 0.00 -3.24 0.00 0.00 57.03 53.61 1y9j h ASP 100 Cb 0.88 0.00 -0.02 0.00 -1.04 0.00 0.00 39.33 39.15 1y9j h ASP 100 CO 0.05 0.83 -0.78 -0.07 -2.04 0.00 0.00 179.24 177.23 1y9j h LEU 101 N 0.00 0.05 0.03 0.15 3.38 0.61 -2.73 115.31 116.80 1y9j h LEU 101 Ca -0.01 -0.04 -0.23 0.00 0.09 0.00 0.00 57.88 57.69 1y9j h LEU 101 Cb 1.63 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 42.35 1y9j h LEU 101 CO 0.11 0.80 -1.12 0.03 0.09 0.00 0.00 178.44 178.35 1y9j h ARG 102 N 0.02 0.06 0.00 1.13 3.08 -1.34 -3.26 114.38 114.08 1y9j h ARG 102 Ca -0.01 -0.11 -0.09 0.00 0.07 0.00 0.00 59.98 59.84 1y9j h ARG 102 Cb 1.37 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.45 1y9j h ARG 102 CO 0.10 1.01 -0.42 -0.91 -1.07 0.00 0.00 179.97 178.69 1y9j h ASN 103 N 0.02 0.00 -4.35 7.04 2.35 -1.51 -3.47 115.58 115.66 1y9j h ASN 103 Ca -0.07 0.00 -0.36 0.00 -0.55 0.00 0.00 56.30 55.32 1y9j h ASN 103 Cb 1.84 0.00 0.07 0.00 0.05 0.00 0.00 38.32 40.28 1y9j h ASN 103 CO 0.14 0.42 -0.56 0.00 -1.65 0.00 0.00 177.43 175.78 1y9j n GLN 104 N -3.47 -5.07 -0.27 0.81 6.02 -1.03 -4.89 117.38 109.47 1y9j n GLN 104 Ca 0.00 0.80 -0.02 0.00 -0.01 0.00 0.00 57.00 57.78 1y9j n GLN 104 Cb 0.56 -5.50 0.10 0.00 1.02 0.00 0.00 30.24 26.43 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 -1.53 0.75 -9.43 1.08 3.38 -1.90 -3.41 115.31 104.25 1y9j h LEU 105 Ca -0.48 0.01 -0.60 0.00 0.09 0.00 0.00 57.88 56.89 1y9j h LEU 105 Cb 1.33 -0.15 -0.12 0.00 0.09 0.00 0.00 40.66 41.81 1y9j h LEU 105 CO 0.51 0.50 -0.68 -0.31 0.09 0.00 0.00 178.44 178.55 1y9j s TYR 106 N -6.10 2.45 -0.00 1.13 1.51 -1.26 0.17 117.35 115.25 1y9j s TYR 106 Ca -0.13 -0.39 -0.24 0.00 -1.01 0.00 0.00 57.07 55.30 1y9j s TYR 106 Cb 0.16 -1.27 -0.18 0.00 -0.11 0.00 0.00 41.96 40.57 1y9j s TYR 106 CO 0.78 0.60 1.29 1.49 -1.11 0.00 0.00 175.55 178.60 1y9j h GLU 107 N 2.02 0.12 0.00 -0.62 4.22 -1.14 -3.43 114.58 115.75 1y9j h GLU 107 Ca -0.42 -0.06 -0.57 0.00 0.08 0.00 0.00 59.36 58.39 1y9j h GLU 107 Cb 1.25 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.44 1y9j h GLU 107 CO 0.65 0.57 -0.31 0.45 -2.18 0.00 0.00 179.01 178.19 1y9j n SER 108 N -4.75 2.85 -2.85 1.04 2.88 -1.26 -3.97 113.62 107.56 1y9j n SER 108 Ca -0.08 -2.89 -0.12 0.00 -1.33 0.00 0.00 58.87 54.45 1y9j n SER 108 Cb 0.29 0.06 0.03 0.00 -0.75 0.00 0.00 64.21 63.84 1y9j n SER 108 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1y9j n TYR 109 N -1.60 -2.51 -1.63 0.66 4.01 -0.21 -2.57 117.16 113.31 1y9j n TYR 109 Ca -0.07 -2.28 -0.15 0.00 -0.16 0.00 0.00 57.90 55.24 1y9j n TYR 109 Cb 0.60 1.13 -0.07 0.00 -0.31 0.00 0.00 39.34 40.69 1y9j n TYR 109 CO 0.00 0.00 0.00 -0.47 -0.46 0.00 0.00 176.86 175.93 1y9j s TYR 110 N 0.07 1.23 0.51 -0.72 6.14 0.32 -2.98 117.35 121.92 1y9j s TYR 110 Ca 0.31 1.89 -0.19 0.00 0.64 0.00 0.00 57.07 59.71 1y9j s TYR 110 Cb 0.24 -3.49 -0.08 0.00 0.42 0.00 0.00 41.96 39.06 1y9j s TYR 110 CO -0.17 -1.44 1.05 -0.51 0.64 0.00 0.00 175.55 175.12 1y9j s LEU 111 N 14.63 3.79 -0.18 6.97 1.43 0.73 0.10 118.68 146.15 1y9j s LEU 111 Ca 0.88 1.92 -0.08 0.00 -1.03 0.00 0.00 54.13 55.82 1y9j s LEU 111 Cb -0.11 -4.56 0.07 0.00 0.03 0.00 0.00 46.19 41.63 1y9j s LEU 111 CO 0.09 -0.86 0.41 0.21 0.23 0.00 0.00 176.35 176.43 1y9j s ASN 112 N -2.10 -0.40 -0.17 2.29 3.04 0.38 0.10 114.94 118.08 1y9j s ASN 112 Ca 0.67 0.92 -0.04 0.00 0.04 0.00 0.00 52.86 54.45 1y9j s ASN 112 Cb -0.17 0.98 -0.02 0.00 -1.54 0.00 0.00 41.25 40.50 1y9j s ASN 112 CO 0.23 -0.21 -0.03 -0.36 -3.04 0.00 0.00 177.10 173.69 1y9j s PHE 113 N 1.87 3.02 0.15 0.43 0.08 -1.23 0.11 117.98 122.40 1y9j s PHE 113 Ca -0.06 -0.39 -0.10 0.00 0.12 0.00 0.00 56.93 56.50 1y9j s PHE 113 Cb -0.10 -2.00 -0.01 0.00 -0.57 0.00 0.00 43.02 40.34 1y9j s PHE 113 CO -0.13 -0.13 1.49 -0.84 -0.10 0.00 0.00 175.22 175.51 1y9j h ILE 114 N 5.26 1.27 -5.72 0.64 -2.65 -1.86 -3.36 117.51 111.08 1y9j h ILE 114 Ca -0.33 -1.57 -0.37 0.00 1.03 0.00 0.00 64.86 63.62 1y9j h ILE 114 Cb 1.19 1.41 0.00 0.00 -2.05 0.00 0.00 36.82 37.37 1y9j h ILE 114 CO 0.62 0.52 -0.09 -0.24 0.03 0.00 0.00 178.15 178.99 1y9j n SER 115 N -4.05 1.75 -4.47 2.16 2.88 -1.26 -1.14 113.62 109.49 1y9j n SER 115 Ca -0.02 -2.19 -0.43 0.00 -1.33 0.00 0.00 58.87 54.89 1y9j n SER 115 Cb 0.55 -0.23 -0.05 0.00 -0.75 0.00 0.00 64.21 63.73 1y9j n SER 115 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1y9j s ALA 116 N -2.52 3.30 0.70 -1.46 0.00 -1.26 -4.80 121.76 115.71 1y9j s ALA 116 Ca 0.38 -1.61 -0.11 0.00 0.00 0.00 0.00 51.96 50.62 1y9j s ALA 116 Cb -0.03 -3.51 0.01 0.00 0.00 0.00 0.00 23.12 19.59 1y9j s ALA 116 CO 0.24 -2.19 1.06 -1.50 0.00 0.00 0.00 175.76 173.37 1y9j s ILE 117 N 3.14 3.93 0.20 0.00 2.07 -1.26 -5.04 121.20 124.25 1y9j s ILE 117 Ca 0.20 0.63 0.05 0.00 -1.41 0.00 0.00 60.65 60.12 1y9j s ILE 117 Cb -0.17 -3.42 -0.04 0.00 0.13 0.00 0.00 42.46 38.96 1y9j s ILE 117 CO 0.14 -0.82 0.22 -0.94 -1.91 0.00 0.00 174.94 171.63 1y9j s SER 118 N -3.91 5.79 0.34 4.50 1.04 -1.26 -4.93 113.70 115.27 1y9j s SER 118 Ca 0.58 -0.08 0.10 0.00 0.48 0.00 0.00 55.95 57.03 1y9j s SER 118 Cb -0.13 -1.58 0.87 0.00 0.10 0.00 0.00 66.02 65.27 1y9j s SER 118 CO 0.55 0.01 1.79 0.03 0.98 0.00 0.00 173.24 176.59 1y9j h ARG 119 N 1.85 0.61 0.03 4.02 2.47 -1.98 0.51 114.38 121.90 1y9j h ARG 119 Ca -0.49 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.19 1y9j h ARG 119 Cb 1.22 -0.14 0.00 0.00 -1.65 0.00 0.00 29.97 29.40 1y9j h ARG 119 CO 0.63 0.41 -0.02 1.03 0.56 0.00 0.00 179.97 182.58 1y9j h SER 120 N 0.63 -0.04 -0.64 7.04 0.87 -1.99 -1.00 113.55 118.42 1y9j h SER 120 Ca 0.57 -0.26 -0.07 0.00 -1.23 0.00 0.00 61.79 60.80 1y9j h SER 120 Cb 1.07 0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 63.01 1y9j h SER 120 CO -0.34 0.24 0.14 0.11 -0.53 0.00 0.00 176.83 176.45 1y9j h LYS 121 N -0.31 1.05 0.27 2.24 1.57 -1.58 -2.85 116.57 116.96 1y9j h LYS 121 Ca -0.00 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.51 1y9j h LYS 121 Cb 0.29 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1y9j h LYS 121 CO 0.01 0.94 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.63 1y9j h LEU 122 N 1.00 -0.31 -1.81 2.94 3.38 0.03 -1.87 115.31 118.68 1y9j h LEU 122 Ca 0.21 -0.01 0.26 0.00 0.09 0.00 0.00 57.88 58.43 1y9j h LEU 122 Cb 0.37 0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 1y9j h LEU 122 CO 0.00 -0.20 0.67 -0.33 0.09 0.00 0.00 178.44 178.68 1y9j h GLU 123 N -0.39 0.14 0.68 1.13 5.08 -1.08 0.34 114.58 120.48 1y9j h GLU 123 Ca -0.04 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1y9j h GLU 123 Cb 0.30 -0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.53 1y9j h GLU 123 CO 0.06 0.09 -0.33 0.22 -1.00 0.00 0.00 179.01 178.05 1y9j h ASP 124 N 0.14 -0.77 -0.56 1.42 1.82 -1.12 0.37 116.42 117.73 1y9j h ASP 124 Ca 0.48 -0.01 -0.01 0.00 -0.39 0.00 0.00 57.03 57.11 1y9j h ASP 124 Cb 1.66 0.20 -0.03 0.00 0.68 0.00 0.00 39.33 41.85 1y9j h ASP 124 CO -0.08 -0.43 0.32 0.40 -1.61 0.00 0.00 179.24 177.84 1y9j h ILE 125 N -1.13 1.18 -0.91 2.25 5.03 -0.80 0.97 117.51 124.09 1y9j h ILE 125 Ca -0.09 -0.43 0.10 0.00 -0.12 0.00 0.00 64.86 64.32 1y9j h ILE 125 Cb 0.73 0.45 -0.07 0.00 -3.03 0.00 0.00 36.82 34.91 1y9j h ILE 125 CO 0.15 0.19 0.59 0.00 -0.68 0.00 0.00 178.15 178.40 1y9j h ALA 126 N 1.15 1.61 0.01 1.87 0.00 -0.39 0.69 119.26 124.20 1y9j h ALA 126 Ca 0.20 -0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.90 1y9j h ALA 126 Cb 0.02 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 1y9j h ALA 126 CO -0.03 0.20 -0.97 -0.91 0.00 0.00 0.00 179.25 177.53 1y9j h ASN 127 N 0.91 0.02 -0.94 0.00 2.35 0.01 -3.05 115.58 114.88 1y9j h ASN 127 Ca 0.42 -0.02 0.27 0.00 -0.55 0.00 0.00 56.30 56.42 1y9j h ASN 127 Cb 0.41 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 38.73 1y9j h ASN 127 CO -0.19 0.98 0.67 0.00 -1.65 0.00 0.00 177.43 177.25 1y9j h ALA 128 N 1.02 2.81 0.11 -0.83 0.00 0.34 -0.00 119.26 122.71 1y9j h ALA 128 Ca -0.02 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.58 1y9j h ALA 128 Cb 1.72 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.56 1y9j h ALA 128 CO 0.13 -1.09 -1.52 0.00 0.00 0.00 0.00 179.25 176.77 1y9j h ALA 129 N 1.54 0.22 -1.03 0.00 0.00 -1.47 -3.35 119.26 115.17 1y9j h ALA 129 Ca 0.46 -1.15 0.30 0.00 0.00 0.00 0.00 54.91 54.52 1y9j h ALA 129 Cb 1.74 0.53 -0.04 0.00 0.00 0.00 0.00 17.79 20.02 1y9j h ALA 129 CO -0.03 0.91 0.76 -0.07 0.00 0.00 0.00 179.25 180.82 1y9j h LEU 130 N -0.27 0.00 -1.56 0.00 3.38 -0.91 1.85 115.31 117.81 1y9j h LEU 130 Ca -0.33 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.61 1y9j h LEU 130 Cb 1.80 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.54 1y9j h LEU 130 CO 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 178.44 178.52 1y9j h ALA 131 N 1.45 1.64 -0.00 1.53 0.00 -1.50 -2.83 119.26 119.54 1y9j h ALA 131 Ca 0.49 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.26 1y9j h ALA 131 Cb 2.01 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.72 1y9j h ALA 131 CO -0.01 0.27 -0.01 0.00 0.00 0.00 0.00 179.25 179.50 1y9j n ALA 132 N -2.50 2.49 -2.56 0.00 0.00 0.28 -4.99 120.51 113.23 1y9j n ALA 132 Ca -0.01 -0.51 -0.19 0.00 0.00 0.00 0.00 53.44 52.73 1y9j n ALA 132 Cb 0.21 -0.14 -0.00 0.00 0.00 0.00 0.00 19.45 19.52 1y9j n ALA 132 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1y9j n ASN 133 N 0.16 -5.31 -4.79 0.00 3.02 0.56 -4.95 115.26 103.95 1y9j n ASN 133 Ca 0.02 -0.02 -0.36 0.00 -0.03 0.00 0.00 54.58 54.19 1y9j n ASN 133 Cb 0.10 -4.41 -0.06 0.00 -0.61 0.00 0.00 39.78 34.79 1y9j n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1y9j s ALA 134 N -2.95 3.17 -0.23 5.41 0.00 -1.05 -4.96 121.76 121.15 1y9j s ALA 134 Ca 0.07 0.50 -0.29 0.00 0.00 0.00 0.00 51.96 52.24 1y9j s ALA 134 Cb -0.03 -3.18 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 1y9j s ALA 134 CO 0.09 0.16 1.42 0.08 0.00 0.00 0.00 175.76 177.50 1y9j s VAL 135 N -1.73 3.99 0.15 0.00 1.01 -1.25 -4.73 120.40 117.83 1y9j s VAL 135 Ca 0.53 1.14 0.02 0.00 0.00 0.00 0.00 61.98 63.66 1y9j s VAL 135 Cb -0.17 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 1y9j s VAL 135 CO 0.22 -0.32 -0.03 0.42 0.00 0.00 0.00 175.10 175.39 1y9j s THR 136 N 4.44 0.75 -0.30 3.92 -4.23 -1.26 -1.05 115.64 117.92 1y9j s THR 136 Ca 0.62 -1.98 -0.10 0.00 -1.18 0.00 0.00 61.69 59.05 1y9j s THR 136 Cb -0.21 -1.97 0.15 0.00 1.34 0.00 0.00 72.50 71.80 1y9j s THR 136 CO 0.24 -0.61 0.71 0.00 -0.54 0.00 0.00 174.62 174.41 1y9j s GLN 137 N -3.87 0.52 -0.58 3.99 0.00 -1.16 -4.96 119.66 113.60 1y9j s GLN 137 Ca 0.20 1.25 -0.27 0.00 -0.00 0.00 0.00 55.36 56.54 1y9j s GLN 137 Cb 0.05 0.74 0.03 0.00 0.00 0.00 0.00 33.01 33.84 1y9j s GLN 137 CO 0.01 -0.25 1.12 0.08 0.00 0.00 0.00 175.29 176.25 1y9j s VAL 138 N 2.82 4.12 1.34 3.63 1.01 -1.26 -0.19 120.40 131.87 1y9j s VAL 138 Ca -0.01 0.66 -0.22 0.00 0.00 0.00 0.00 61.98 62.41 1y9j s VAL 138 Cb -0.11 -4.68 0.34 0.00 0.00 0.00 0.00 36.38 31.93 1y9j s VAL 138 CO -0.19 -1.30 1.01 0.00 0.00 0.00 0.00 175.10 174.62 1y9j n ALA 139 N 8.17 -4.21 -1.47 5.51 0.00 0.29 -4.94 120.51 123.86 1y9j n ALA 139 Ca 0.06 -1.60 -0.30 0.00 0.00 0.00 0.00 53.44 51.60 1y9j n ALA 139 Cb 0.48 -0.12 0.11 0.00 0.00 0.00 0.00 19.45 19.92 1y9j n ALA 139 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1y9j s LYS 140 N -5.33 1.72 0.11 0.00 1.02 -1.26 -4.45 119.74 111.54 1y9j s LYS 140 Ca 0.70 0.61 0.04 0.00 0.02 0.00 0.00 55.97 57.34 1y9j s LYS 140 Cb -0.09 -1.88 -0.04 0.00 -0.52 0.00 0.00 37.83 35.30 1y9j s LYS 140 CO 0.55 -1.87 0.08 0.08 -0.92 0.00 0.00 175.35 173.27 1y9j s VAL 141 N -3.13 4.39 0.00 3.17 1.01 -1.26 -4.31 120.40 120.27 1y9j s VAL 141 Ca 0.62 -0.93 0.00 0.00 0.00 0.00 0.00 61.98 61.67 1y9j s VAL 141 Cb -0.15 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.08 1y9j s VAL 141 CO 0.55 0.05 0.00 2.22 0.00 0.00 0.00 175.10 177.91 1y9j n PHE 142 N 0.22 0.00 0.07 5.22 -1.74 -1.25 -4.75 117.46 115.22 1y9j n PHE 142 Ca -0.09 0.00 0.03 0.00 -0.56 0.00 0.00 57.45 56.83 1y9j n PHE 142 Cb 0.53 0.09 0.13 0.00 1.52 0.00 0.00 39.48 41.75 1y9j n PHE 142 CO 0.00 0.00 0.00 -3.47 -0.56 0.00 0.00 176.76 172.73 1y9j n ASP 143 N -2.56 0.10 0.32 5.98 2.03 -0.29 -2.61 116.55 119.53 1y9j n ASP 143 Ca 0.00 0.55 0.18 0.00 0.52 0.00 0.00 54.79 56.04 1y9j n ASP 143 Cb 0.34 -0.56 0.97 0.00 -0.72 0.00 0.00 41.12 41.15 1y9j n ASP 143 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 1y9j h GLN 144 N 0.00 0.00 0.00 -0.67 -0.00 -1.59 -2.41 115.11 110.44 1y9j h GLN 144 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.65 58.52 1y9j h GLN 144 Cb 0.02 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 27.48 1y9j h GLN 144 CO 0.00 0.00 -1.57 2.48 0.00 0.00 0.00 178.83 179.74 1y9j n TYR 145 N -2.91 0.00 -4.22 3.99 4.11 -1.07 -4.96 117.16 112.09 1y9j n TYR 145 Ca -0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 57.90 57.76 1y9j n TYR 145 Cb 0.23 -0.39 -0.03 0.00 -0.00 0.00 0.00 39.34 39.14 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 -2.24 0.00 0.00 -3.48 -0.00 -0.91 -5.22 117.00 105.16 1y9j n LEU 146 Ca -0.12 -1.39 0.00 0.00 -0.00 0.00 0.00 56.01 54.50 1y9j n LEU 146 Cb 0.69 0.45 0.00 0.00 -0.00 0.00 0.00 43.42 44.56 1y9j n LEU 146 CO 0.19 -0.21 0.00 0.59 -0.00 0.00 0.00 177.39 177.95