#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a8v n HIS 0 N 0.00 0.00 -3.13 1.61 -0.00 -1.26 -4.86 115.22 107.57 1a8v n HIS 0 Ca 0.00 0.00 -0.40 0.00 -0.00 0.00 0.00 57.72 57.32 1a8v n HIS 0 Cb 0.00 -0.09 -0.06 0.00 -0.00 0.00 0.00 29.99 29.84 1a8v n HIS 0 CO 0.00 0.00 0.00 -1.64 -0.00 0.00 0.00 176.34 174.70 1a8v s MET 1 N -2.87 4.22 -0.08 -1.40 -1.94 -1.26 -5.03 119.30 110.94 1a8v s MET 1 Ca 0.12 0.60 0.02 0.00 -1.71 0.00 0.00 55.69 54.72 1a8v s MET 1 Cb 0.17 -3.57 0.02 0.00 2.01 0.00 0.00 34.83 33.46 1a8v s MET 1 CO 0.74 -0.22 -0.12 1.21 -0.01 0.00 0.00 175.02 176.62 1a8v s ASN 2 N 1.18 1.89 0.27 3.03 3.84 -1.26 -1.99 114.94 121.90 1a8v s ASN 2 Ca 0.28 -0.31 -0.04 0.00 0.21 0.00 0.00 52.86 53.00 1a8v s ASN 2 Cb -0.16 -0.85 0.33 0.00 -0.55 0.00 0.00 41.25 40.03 1a8v s ASN 2 CO 0.10 0.01 1.94 0.25 -2.79 0.00 0.00 177.10 176.61 1a8v h LEU 3 N 7.21 1.08 -0.28 3.21 5.85 -1.05 -2.43 115.31 128.89 1a8v h LEU 3 Ca -0.31 -0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.39 1a8v h LEU 3 Cb 1.18 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.93 1a8v h LEU 3 CO 0.47 0.77 0.18 0.74 -0.34 0.00 0.00 178.44 180.26 1a8v h THR 4 N 1.27 1.08 -0.73 1.05 2.02 -1.91 -1.96 112.91 113.73 1a8v h THR 4 Ca 0.36 -0.17 0.04 0.00 0.77 0.00 0.00 66.41 67.41 1a8v h THR 4 Cb -0.11 0.69 -0.05 0.00 -1.74 0.00 0.00 68.15 66.94 1a8v h THR 4 CO -0.09 0.08 0.45 -0.08 0.37 0.00 0.00 175.52 176.26 1a8v h GLU 5 N 0.37 0.84 -0.04 6.66 4.57 -1.84 -2.37 114.58 122.77 1a8v h GLU 5 Ca 0.10 -0.05 -0.09 0.00 -1.18 0.00 0.00 59.36 58.14 1a8v h GLU 5 Cb -0.02 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 1a8v h GLU 5 CO -0.02 0.56 -0.40 -0.07 -1.18 0.00 0.00 179.01 177.90 1a8v h LEU 6 N 0.87 0.09 -1.03 1.64 3.38 -1.18 -2.27 115.31 116.81 1a8v h LEU 6 Ca 0.30 -0.03 -0.08 0.00 0.09 0.00 0.00 57.88 58.16 1a8v h LEU 6 Cb 0.07 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1a8v h LEU 6 CO -0.13 0.48 -0.40 0.11 0.09 0.00 0.00 178.44 178.59 1a8v h LYS 7 N 0.07 0.00 -0.64 1.13 1.57 -1.06 -1.46 116.57 116.19 1a8v h LYS 7 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1a8v h LYS 7 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 1a8v h LYS 7 CO 0.05 0.40 0.00 0.09 -0.57 0.00 0.00 179.45 179.42 1a8v n ASN 8 N -3.67 4.70 -4.71 0.86 3.02 -0.88 -4.87 115.26 109.71 1a8v n ASN 8 Ca -0.01 -2.63 -0.35 0.00 -0.03 0.00 0.00 54.58 51.56 1a8v n ASN 8 Cb 0.49 -0.61 -0.08 0.00 -0.61 0.00 0.00 39.78 38.97 1a8v n ASN 8 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1a8v s THR 9 N -2.22 5.32 0.49 3.41 2.01 -0.55 -5.04 115.64 119.05 1a8v s THR 9 Ca 0.46 0.16 -0.22 0.00 0.31 0.00 0.00 61.69 62.40 1a8v s THR 9 Cb 0.33 -3.43 -0.09 0.00 0.01 0.00 0.00 72.50 69.32 1a8v s THR 9 CO 0.17 0.44 0.84 -2.65 -0.69 0.00 0.00 174.62 172.73 1a8v n PRO 10 N 3.55 0.98 -0.01 4.92 -0.02 -1.26 -4.79 135.00 138.37 1a8v n PRO 10 Ca -0.16 0.36 0.01 0.00 -2.02 0.00 0.00 63.50 61.70 1a8v n PRO 10 Cb 0.52 -1.92 0.34 0.00 -0.02 0.00 0.00 33.50 32.42 1a8v n PRO 10 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1a8v h VAL 11 N 0.97 1.16 -0.55 -1.45 2.07 -1.97 -2.20 116.25 114.28 1a8v h VAL 11 Ca -0.45 -0.54 0.08 0.00 0.82 0.00 0.00 66.70 66.61 1a8v h VAL 11 Cb 1.36 0.73 -0.06 0.00 -1.52 0.00 0.00 31.29 31.80 1a8v h VAL 11 CO 0.53 0.20 0.20 0.77 0.02 0.00 0.00 177.57 179.29 1a8v h SER 12 N 0.55 0.19 0.09 0.57 4.64 -1.99 0.21 113.55 117.82 1a8v h SER 12 Ca 0.13 0.07 -0.10 0.00 -0.47 0.00 0.00 61.79 61.43 1a8v h SER 12 Cb 0.16 0.05 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1a8v h SER 12 CO -0.01 0.13 -0.32 -0.33 -0.87 0.00 0.00 176.83 175.44 1a8v h GLU 13 N 0.38 0.33 -0.50 4.77 5.08 -1.77 -1.51 114.58 121.36 1a8v h GLU 13 Ca 0.27 -0.13 -0.11 0.00 -1.00 0.00 0.00 59.36 58.38 1a8v h GLU 13 Cb 0.31 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1a8v h GLU 13 CO -0.27 0.62 -0.12 -0.07 -1.00 0.00 0.00 179.01 178.16 1a8v h LEU 14 N 0.29 0.97 -0.76 1.33 3.38 -0.68 -2.18 115.31 117.66 1a8v h LEU 14 Ca 0.04 -0.36 -0.01 0.00 0.09 0.00 0.00 57.88 57.63 1a8v h LEU 14 Cb 0.70 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.15 1a8v h LEU 14 CO 0.05 1.11 0.43 0.40 0.09 0.00 0.00 178.44 180.52 1a8v h ILE 15 N 0.82 1.22 0.01 1.22 2.04 -0.54 0.22 117.51 122.51 1a8v h ILE 15 Ca 0.13 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 65.45 1a8v h ILE 15 Cb 0.69 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1a8v h ILE 15 CO 0.05 0.25 -0.07 0.74 0.00 0.00 0.00 178.15 179.12 1a8v h THR 16 N 1.05 0.83 -0.27 -0.27 2.02 -1.00 0.19 112.91 115.45 1a8v h THR 16 Ca 0.27 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.46 1a8v h THR 16 Cb 0.01 0.83 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1a8v h THR 16 CO -0.05 0.00 0.16 0.25 0.37 0.00 0.00 175.52 176.25 1a8v h LEU 17 N -0.12 0.26 -0.17 2.58 5.85 -0.75 -1.27 115.31 121.69 1a8v h LEU 17 Ca 0.03 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1a8v h LEU 17 Cb 0.15 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.12 1a8v h LEU 17 CO -0.06 0.19 0.08 1.23 -0.34 0.00 0.00 178.44 179.53 1a8v h GLY 18 N 0.33 0.27 2.00 3.75 0.00 -0.32 -2.11 103.07 107.00 1a8v h GLY 18 Ca 0.11 -0.14 -0.06 0.00 0.00 0.00 0.00 47.33 47.24 1a8v h GLY 18 CO -0.05 0.13 -0.26 1.05 0.00 0.00 0.00 176.54 177.41 1a8v h GLU 19 N 0.14 0.00 0.00 4.80 4.11 -0.88 -0.35 114.58 122.39 1a8v h GLU 19 Ca 0.06 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.43 1a8v h GLU 19 Cb 0.15 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1a8v h GLU 19 CO -0.01 0.26 -0.29 -0.97 0.07 0.00 0.00 179.01 178.08 1a8v h ASN 20 N 0.00 0.00 0.21 3.06 -0.00 -0.97 0.10 115.58 117.98 1a8v h ASN 20 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.30 1a8v h ASN 20 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.86 1a8v h ASN 20 CO 0.03 0.29 -0.03 0.23 -0.00 0.00 0.00 177.43 177.95 1a8v n MET 21 N -4.09 0.87 -0.12 6.67 2.81 -0.47 -4.89 117.12 117.91 1a8v n MET 21 Ca -0.02 -0.17 0.00 0.00 -1.81 0.00 0.00 57.70 55.70 1a8v n MET 21 Cb 0.34 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.35 1a8v n MET 21 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1a8v n GLY 22 N 1.15 0.93 3.94 3.03 0.00 0.02 -5.08 105.19 109.19 1a8v n GLY 22 Ca 0.19 -0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 1a8v n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a8v s LEU 23 N 0.00 3.13 -0.99 0.99 1.43 -0.27 -4.99 118.68 117.98 1a8v s LEU 23 Ca 0.00 0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 53.24 1a8v s LEU 23 Cb 0.00 -3.14 0.07 0.00 0.03 0.00 0.00 46.19 43.15 1a8v s LEU 23 CO 0.00 -1.25 1.37 -0.70 0.23 0.00 0.00 176.35 176.00 1a8v s GLU 24 N -4.97 3.59 -0.27 1.70 2.56 -1.26 -4.44 118.70 115.60 1a8v s GLU 24 Ca 0.57 -1.28 -0.02 0.00 0.00 0.00 0.00 54.97 54.24 1a8v s GLU 24 Cb -0.10 -5.24 0.00 0.00 2.00 0.00 0.00 34.13 30.79 1a8v s GLU 24 CO 0.42 -2.10 0.19 0.09 -0.56 0.00 0.00 175.26 173.30 1a8v n ASN 25 N 8.30 -1.41 0.18 -1.70 3.02 -1.26 -4.77 115.26 117.62 1a8v n ASN 25 Ca 0.30 -0.32 0.02 0.00 -0.03 0.00 0.00 54.58 54.56 1a8v n ASN 25 Cb 0.50 -0.48 0.34 0.00 -0.61 0.00 0.00 39.78 39.53 1a8v n ASN 25 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1a8v h LEU 26 N 0.75 0.00 -0.69 3.41 3.38 -1.94 -2.83 115.31 117.40 1a8v h LEU 26 Ca -0.20 0.00 0.12 0.00 0.09 0.00 0.00 57.88 57.89 1a8v h LEU 26 Cb 0.43 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.05 1a8v h LEU 26 CO 0.12 0.40 -0.31 0.00 0.09 0.00 0.00 178.44 178.74 1a8v h ALA 27 N 1.60 0.11 -0.01 1.53 0.00 -1.96 -1.69 119.26 118.85 1a8v h ALA 27 Ca -0.00 0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.12 1a8v h ALA 27 Cb 0.71 0.77 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1a8v h ALA 27 CO 0.05 -0.61 -0.24 2.89 0.00 0.00 0.00 179.25 181.35 1a8v n ARG 28 N -5.46 1.00 -2.63 0.00 1.85 -1.08 -4.97 116.66 105.38 1a8v n ARG 28 Ca 0.06 -0.62 -0.27 0.00 -1.00 0.00 0.00 57.85 56.03 1a8v n ARG 28 Cb 0.37 -1.49 0.01 0.00 -1.05 0.00 0.00 32.46 30.30 1a8v n ARG 28 CO 0.00 0.00 0.00 -1.64 -0.01 0.00 0.00 177.63 175.98 1a8v s MET 29 N -2.42 3.39 0.76 2.89 1.00 -0.64 -5.07 119.30 119.21 1a8v s MET 29 Ca 0.26 0.10 -0.11 0.00 0.00 0.00 0.00 55.69 55.94 1a8v s MET 29 Cb 0.19 -2.38 0.05 0.00 0.00 0.00 0.00 34.83 32.70 1a8v s MET 29 CO 0.50 -0.29 1.08 1.03 0.00 0.00 0.00 175.02 177.34 1a8v s ARG 30 N -4.77 2.33 0.13 2.03 0.52 -1.26 -4.88 118.95 113.05 1a8v s ARG 30 Ca 0.48 1.08 -0.19 0.00 -0.52 0.00 0.00 55.73 56.59 1a8v s ARG 30 Cb -0.10 -1.91 -0.04 0.00 0.52 0.00 0.00 34.95 33.42 1a8v s ARG 30 CO 0.44 -1.56 1.77 -0.22 0.02 0.00 0.00 175.30 175.75 1a8v h LYS 31 N -1.07 0.25 -0.92 3.54 3.64 -1.97 -2.05 116.57 117.99 1a8v h LYS 31 Ca -0.44 -0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.00 1a8v h LYS 31 Cb 1.23 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.92 1a8v h LYS 31 CO 0.53 0.17 0.57 0.37 -2.27 0.00 0.00 179.45 178.81 1a8v h GLN 32 N 0.26 0.96 0.00 1.90 4.15 -2.00 -2.26 115.11 118.12 1a8v h GLN 32 Ca 0.10 -0.06 -0.10 0.00 0.77 0.00 0.00 58.65 59.35 1a8v h GLN 32 Cb 0.02 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 27.47 1a8v h GLN 32 CO -0.06 0.64 -0.50 -0.44 -1.93 0.00 0.00 178.83 176.54 1a8v h ASP 33 N 0.99 0.00 -0.37 -0.69 3.32 -1.76 -2.00 116.42 115.92 1a8v h ASP 33 Ca 0.42 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.40 1a8v h ASP 33 Cb 0.27 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 1a8v h ASP 33 CO -0.21 0.50 -0.02 0.40 -1.72 0.00 0.00 179.24 178.20 1a8v h ILE 34 N 0.00 1.26 -0.72 0.35 2.04 -0.93 -1.59 117.51 117.93 1a8v h ILE 34 Ca -0.00 -1.02 -0.04 0.00 1.00 0.00 0.00 64.86 64.79 1a8v h ILE 34 Cb 0.91 1.20 -0.03 0.00 -0.74 0.00 0.00 36.82 38.15 1a8v h ILE 34 CO 0.06 0.34 0.29 0.40 0.00 0.00 0.00 178.15 179.24 1a8v h ILE 35 N 0.47 1.25 -0.68 -0.67 2.04 -1.14 -1.34 117.51 117.45 1a8v h ILE 35 Ca 0.10 -0.78 -0.05 0.00 1.00 0.00 0.00 64.86 65.13 1a8v h ILE 35 Cb 0.49 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 1a8v h ILE 35 CO 0.02 0.31 0.24 -0.26 0.00 0.00 0.00 178.15 178.47 1a8v h PHE 36 N 1.03 1.06 -0.38 1.37 -1.00 -1.29 -0.44 116.94 117.30 1a8v h PHE 36 Ca 0.24 -0.09 -0.00 0.00 2.81 0.00 0.00 57.97 60.92 1a8v h PHE 36 Cb 0.21 -0.31 -0.02 0.00 3.61 0.00 0.00 35.95 39.44 1a8v h PHE 36 CO 0.02 0.84 0.22 0.00 -1.61 0.00 0.00 178.31 177.77 1a8v h ALA 37 N 1.11 0.48 0.07 2.45 0.00 -1.01 -1.03 119.26 121.32 1a8v h ALA 37 Ca 0.22 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1a8v h ALA 37 Cb 0.25 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 1a8v h ALA 37 CO -0.01 -0.01 -0.06 0.82 0.00 0.00 0.00 179.25 179.98 1a8v h ILE 38 N 0.49 0.85 -0.45 0.00 2.04 -1.04 -2.18 117.51 117.22 1a8v h ILE 38 Ca 0.13 0.00 -0.13 0.00 1.00 0.00 0.00 64.86 65.87 1a8v h ILE 38 Cb 0.03 0.85 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 1a8v h ILE 38 CO -0.02 0.00 -0.21 -0.07 0.00 0.00 0.00 178.15 177.84 1a8v h LEU 39 N -0.14 0.94 -0.39 1.44 3.38 -0.98 -1.39 115.31 118.16 1a8v h LEU 39 Ca 0.00 -0.35 0.00 0.00 0.09 0.00 0.00 57.88 57.62 1a8v h LEU 39 Cb 0.14 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1a8v h LEU 39 CO -0.02 1.12 0.25 0.11 0.09 0.00 0.00 178.44 179.99 1a8v h LYS 40 N 0.80 0.53 -0.41 1.13 1.57 -1.15 0.74 116.57 119.77 1a8v h LYS 40 Ca 0.11 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 1a8v h LYS 40 Cb 0.77 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.95 1a8v h LYS 40 CO 0.06 0.38 -0.01 0.37 -0.57 0.00 0.00 179.45 179.68 1a8v h GLN 41 N 0.52 0.74 -0.41 3.15 5.75 -1.20 -3.00 115.11 120.66 1a8v h GLN 41 Ca 0.14 -0.24 -0.06 0.00 -0.15 0.00 0.00 58.65 58.34 1a8v h GLN 41 Cb -0.03 -0.06 -0.02 0.00 1.07 0.00 0.00 27.48 28.44 1a8v h GLN 41 CO -0.03 0.83 0.00 1.25 -2.65 0.00 0.00 178.83 178.23 1a8v h HIS 42 N 0.57 0.69 0.00 3.99 2.76 -1.05 -2.54 115.15 119.58 1a8v h HIS 42 Ca 0.12 -0.08 -0.02 0.00 -2.20 0.00 0.00 60.37 58.19 1a8v h HIS 42 Cb 0.50 -0.20 -0.00 0.00 1.55 0.00 0.00 27.41 29.26 1a8v h HIS 42 CO 0.04 0.66 -0.07 0.00 -1.30 0.00 0.00 177.93 177.25 1a8v h ALA 43 N 1.38 1.19 0.00 5.26 0.00 -0.71 -2.88 119.26 123.50 1a8v h ALA 43 Ca 0.13 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1a8v h ALA 43 Cb 0.39 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1a8v h ALA 43 CO 0.01 0.09 -0.06 0.87 0.00 0.00 0.00 179.25 180.17 1a8v h LYS 44 N 0.00 0.00 0.00 0.00 1.57 -1.37 -1.66 116.57 115.12 1a8v h LYS 44 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1a8v h LYS 44 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.61 1a8v h LYS 44 CO 0.01 0.06 0.00 -1.13 -0.57 0.00 0.00 179.45 177.82 1a8v n SER 45 N -3.37 0.00 0.00 0.86 3.41 -1.08 -4.87 113.62 108.57 1a8v n SER 45 Ca -0.02 0.40 0.00 0.00 -0.26 0.00 0.00 58.87 58.99 1a8v n SER 45 Cb 0.21 -0.46 0.00 0.00 -0.26 0.00 0.00 64.21 63.70 1a8v n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1a8v n GLY 46 N 0.63 0.66 3.75 5.00 0.00 -0.62 -5.05 105.19 109.56 1a8v n GLY 46 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1a8v n GLY 46 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1a8v s GLU 47 N -0.19 2.34 0.21 1.61 2.56 -1.26 -5.01 118.70 118.96 1a8v s GLU 47 Ca 0.00 1.39 -0.25 0.00 0.00 0.00 0.00 54.97 56.12 1a8v s GLU 47 Cb 0.00 -1.89 -0.08 0.00 2.00 0.00 0.00 34.13 34.15 1a8v s GLU 47 CO 0.00 -1.61 0.80 -0.51 -0.56 0.00 0.00 175.26 173.39 1a8v s ASP 48 N -2.77 7.33 0.03 -1.70 1.01 -1.26 -4.79 116.67 114.52 1a8v s ASP 48 Ca 0.66 1.65 0.07 0.00 0.71 0.00 0.00 52.55 55.64 1a8v s ASP 48 Cb -0.21 -2.50 -0.02 0.00 1.01 0.00 0.00 42.92 41.20 1a8v s ASP 48 CO 0.48 0.13 -0.20 -0.63 0.21 0.00 0.00 175.17 175.16 1a8v s ILE 49 N -1.30 1.58 0.26 0.77 1.01 -1.26 -3.62 121.20 118.63 1a8v s ILE 49 Ca 0.40 -1.09 0.10 0.00 0.00 0.00 0.00 60.65 60.06 1a8v s ILE 49 Cb -0.21 -1.36 -0.04 0.00 0.01 0.00 0.00 42.46 40.85 1a8v s ILE 49 CO 0.25 0.24 -0.04 -0.36 0.00 0.00 0.00 174.94 175.03 1a8v s PHE 50 N -0.72 2.63 0.23 3.97 0.08 -0.84 -0.75 117.98 122.58 1a8v s PHE 50 Ca 0.07 -0.24 -0.20 0.00 0.12 0.00 0.00 56.93 56.69 1a8v s PHE 50 Cb -0.08 -1.17 0.03 0.00 -0.57 0.00 0.00 43.02 41.22 1a8v s PHE 50 CO 0.01 0.63 0.63 0.20 -0.10 0.00 0.00 175.22 176.58 1a8v s GLY 51 N -3.57 -0.12 0.29 4.36 0.00 -0.88 -0.31 107.32 107.09 1a8v s GLY 51 Ca 0.31 -0.21 -0.14 0.00 0.00 0.00 0.00 44.72 44.68 1a8v s GLY 51 CO 0.19 -0.14 0.59 0.51 0.00 0.00 0.00 173.10 174.24 1a8v s ASP 52 N -2.89 0.04 0.00 1.64 1.47 -1.26 -1.91 116.67 113.76 1a8v s ASP 52 Ca 0.10 -0.98 0.00 0.00 1.18 0.00 0.00 52.55 52.85 1a8v s ASP 52 Cb -0.03 0.68 0.00 0.00 -0.34 0.00 0.00 42.92 43.23 1a8v s ASP 52 CO 0.01 -1.31 0.00 0.61 0.68 0.00 0.00 175.17 175.16 1a8v n GLY 53 N -0.45 -2.47 3.70 2.12 0.00 -0.78 -4.87 105.19 102.43 1a8v n GLY 53 Ca -0.03 -1.28 -0.36 0.00 0.00 0.00 0.00 46.02 44.35 1a8v n GLY 53 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a8v s VAL 54 N -2.24 5.32 0.20 1.61 1.01 -0.36 -1.55 120.40 124.39 1a8v s VAL 54 Ca 0.00 0.41 -0.30 0.00 0.00 0.00 0.00 61.98 62.09 1a8v s VAL 54 Cb 0.00 -3.58 -0.09 0.00 0.00 0.00 0.00 36.38 32.71 1a8v s VAL 54 CO 0.00 0.36 1.27 -0.22 0.00 0.00 0.00 175.10 176.51 1a8v s LEU 55 N 0.79 4.43 -0.09 3.92 2.96 0.13 -0.35 118.68 130.46 1a8v s LEU 55 Ca 0.13 2.35 0.00 0.00 -0.22 0.00 0.00 54.13 56.39 1a8v s LEU 55 Cb -0.13 -3.61 0.02 0.00 0.50 0.00 0.00 46.19 42.97 1a8v s LEU 55 CO 0.04 -0.47 -0.09 -0.70 -1.32 0.00 0.00 176.35 173.81 1a8v s GLU 56 N -0.21 1.53 -0.11 1.98 2.12 0.20 -0.94 118.70 123.26 1a8v s GLU 56 Ca 0.55 -0.29 -0.17 0.00 0.36 0.00 0.00 54.97 55.42 1a8v s GLU 56 Cb -0.35 -1.48 -0.04 0.00 0.26 0.00 0.00 34.13 32.52 1a8v s GLU 56 CO 0.38 -0.17 0.45 0.42 -0.54 0.00 0.00 175.26 175.80 1a8v s ILE 57 N 1.34 5.18 0.70 -3.70 1.01 -1.26 -1.46 121.20 123.02 1a8v s ILE 57 Ca -0.02 0.90 0.01 0.00 0.00 0.00 0.00 60.65 61.54 1a8v s ILE 57 Cb -0.14 -3.79 0.14 0.00 0.01 0.00 0.00 42.46 38.68 1a8v s ILE 57 CO -0.04 0.36 0.96 0.18 0.00 0.00 0.00 174.94 176.40 1a8v n LEU 58 N 3.49 0.00 0.22 2.97 4.77 -0.38 -4.98 117.00 123.09 1a8v n LEU 58 Ca -0.08 -2.14 0.08 0.00 -0.03 0.00 0.00 56.01 53.84 1a8v n LEU 58 Cb 0.52 -0.61 0.49 0.00 -2.33 0.00 0.00 43.42 41.49 1a8v n LEU 58 CO 0.42 -0.94 0.81 1.56 -1.33 0.00 0.00 177.39 177.91 1a8v h GLN 59 N 0.00 0.00 0.00 3.23 4.20 -1.98 0.15 115.11 120.71 1a8v h GLN 59 Ca -0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.39 1a8v h GLN 59 Cb 1.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.99 1a8v h GLN 59 CO 0.36 0.26 0.00 -0.25 -0.67 0.00 0.00 178.83 178.53 1a8v n ASP 60 N -3.64 0.00 0.00 1.46 9.92 -1.26 -4.91 116.55 118.12 1a8v n ASP 60 Ca -0.01 0.23 0.00 0.00 -0.53 0.00 0.00 54.79 54.48 1a8v n ASP 60 Cb 0.39 -0.40 0.00 0.00 -0.64 0.00 0.00 41.12 40.47 1a8v n ASP 60 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1a8v n GLY 61 N 0.98 0.25 3.98 0.44 0.00 0.53 -5.05 105.19 106.32 1a8v n GLY 61 Ca 0.09 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.88 1a8v n GLY 61 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1a8v s PHE 62 N -2.04 2.24 0.34 1.61 -0.12 -1.26 -4.30 117.98 114.45 1a8v s PHE 62 Ca 0.00 -0.08 0.07 0.00 -0.05 0.00 0.00 56.93 56.88 1a8v s PHE 62 Cb 0.00 -2.95 -0.03 0.00 -0.63 0.00 0.00 43.02 39.41 1a8v s PHE 62 CO 0.00 -1.37 0.27 0.41 -0.05 0.00 0.00 175.22 174.48 1a8v n GLY 63 N -2.67 2.93 3.07 1.99 0.00 0.23 -1.25 105.19 109.49 1a8v n GLY 63 Ca 0.11 -1.92 -0.20 0.00 0.00 0.00 0.00 46.02 44.02 1a8v n GLY 63 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1a8v s PHE 64 N -3.34 1.00 -0.35 1.61 0.08 -0.53 -0.90 117.98 115.55 1a8v s PHE 64 Ca 0.38 -0.22 -0.29 0.00 0.12 0.00 0.00 56.93 56.92 1a8v s PHE 64 Cb 0.02 -0.63 0.02 0.00 -0.57 0.00 0.00 43.02 41.85 1a8v s PHE 64 CO 0.27 -0.01 1.08 -0.51 -0.10 0.00 0.00 175.22 175.95 1a8v s LEU 65 N -0.44 3.89 0.33 -0.37 1.43 -0.11 -0.63 118.68 122.77 1a8v s LEU 65 Ca 0.03 0.93 -0.08 0.00 -1.03 0.00 0.00 54.13 53.98 1a8v s LEU 65 Cb -0.05 -3.53 -0.06 0.00 0.03 0.00 0.00 46.19 42.58 1a8v s LEU 65 CO -0.00 -0.94 0.65 -0.13 0.23 0.00 0.00 176.35 176.16 1a8v s ARG 66 N 3.77 3.72 0.09 1.70 1.81 0.53 -2.32 118.95 128.26 1a8v s ARG 66 Ca 0.45 0.24 0.01 0.00 -1.72 0.00 0.00 55.73 54.72 1a8v s ARG 66 Cb -0.11 -2.54 0.01 0.00 -0.45 0.00 0.00 34.95 31.87 1a8v s ARG 66 CO 0.18 0.12 0.11 -1.13 -0.68 0.00 0.00 175.30 173.91 1a8v n SER 67 N -0.98 0.61 -4.76 0.23 3.41 -1.26 -1.22 113.62 109.65 1a8v n SER 67 Ca 0.00 -1.27 -0.32 0.00 -0.26 0.00 0.00 58.87 57.03 1a8v n SER 67 Cb 0.54 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 64.36 1a8v n SER 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1a8v s ALA 68 N -2.12 4.04 -0.80 7.33 0.00 -1.26 -4.94 121.76 124.02 1a8v s ALA 68 Ca 0.09 -0.69 -0.10 0.00 0.00 0.00 0.00 51.96 51.25 1a8v s ALA 68 Cb -0.01 -0.04 0.10 0.00 0.00 0.00 0.00 23.12 23.18 1a8v s ALA 68 CO 0.05 -0.07 0.25 -0.25 0.00 0.00 0.00 175.76 175.74 1a8v n ASP 69 N -1.28 -1.01 0.00 0.00 8.00 -1.26 -5.20 116.55 115.80 1a8v n ASP 69 Ca -0.16 -0.41 0.00 0.00 0.71 0.00 0.00 54.79 54.93 1a8v n ASP 69 Cb 0.67 -0.92 0.00 0.00 -0.02 0.00 0.00 41.12 40.85 1a8v n ASP 69 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a8v n ALA 74 N -2.42 0.00 0.00 2.24 0.00 -1.26 -5.37 120.51 113.70 1a8v n ALA 74 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1a8v n ALA 74 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.76 1a8v n ALA 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1a8v n GLY 75 N -0.81 -0.20 0.28 0.00 0.00 -1.26 -4.99 105.19 98.22 1a8v n GLY 75 Ca 0.00 -0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.20 1a8v n GLY 75 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1a8v h PRO 76 N 0.00 0.00 -0.20 1.61 0.11 -2.03 -2.38 132.00 129.12 1a8v h PRO 76 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1a8v h PRO 76 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1a8v h PRO 76 CO 0.00 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.39 1a8v n ASP 77 N -3.03 2.45 -4.51 -2.05 5.75 -1.26 -4.73 116.55 109.17 1a8v n ASP 77 Ca -0.00 -1.76 -0.37 0.00 -0.01 0.00 0.00 54.79 52.65 1a8v n ASP 77 Cb 0.25 -0.13 0.06 0.00 -1.03 0.00 0.00 41.12 40.27 1a8v n ASP 77 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1a8v n ASP 78 N 0.52 -0.57 -4.37 -1.12 9.92 -0.90 -4.91 116.55 115.11 1a8v n ASP 78 Ca 0.09 0.66 -0.35 0.00 -0.53 0.00 0.00 54.79 54.67 1a8v n ASP 78 Cb 0.35 -1.27 -0.13 0.00 -0.64 0.00 0.00 41.12 39.43 1a8v n ASP 78 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1a8v s ILE 79 N -1.80 3.58 0.27 0.53 1.01 -0.98 -4.45 121.20 119.37 1a8v s ILE 79 Ca 0.69 -0.44 -0.30 0.00 0.00 0.00 0.00 60.65 60.61 1a8v s ILE 79 Cb -0.38 -2.61 -0.10 0.00 0.01 0.00 0.00 42.46 39.38 1a8v s ILE 79 CO 0.54 0.43 1.44 -0.47 0.00 0.00 0.00 174.94 176.89 1a8v s TYR 80 N 1.18 2.96 -0.10 3.97 5.04 0.26 -0.94 117.35 129.71 1a8v s TYR 80 Ca 0.02 1.06 0.01 0.00 -2.44 0.00 0.00 57.07 55.72 1a8v s TYR 80 Cb -0.14 -3.85 0.02 0.00 0.35 0.00 0.00 41.96 38.34 1a8v s TYR 80 CO -0.00 -2.70 -0.10 0.08 -1.34 0.00 0.00 175.55 171.50 1a8v s VAL 81 N -0.24 1.10 0.70 3.14 1.01 -0.08 -0.92 120.40 125.11 1a8v s VAL 81 Ca 0.58 -0.38 -0.12 0.00 0.00 0.00 0.00 61.98 62.06 1a8v s VAL 81 Cb -0.43 -1.07 0.02 0.00 0.00 0.00 0.00 36.38 34.90 1a8v s VAL 81 CO 0.47 0.37 1.08 -0.55 0.00 0.00 0.00 175.10 176.47 1a8v s SER 82 N 1.33 5.07 0.47 3.32 0.15 -1.26 -0.60 113.70 122.19 1a8v s SER 82 Ca -0.02 1.81 0.23 0.00 0.70 0.00 0.00 55.95 58.67 1a8v s SER 82 Cb -0.14 -2.52 1.19 0.00 -1.71 0.00 0.00 66.02 62.84 1a8v s SER 82 CO -0.04 -1.65 1.98 -0.65 1.20 0.00 0.00 173.24 174.08 1a8v h PRO 83 N -0.51 0.00 0.00 5.44 0.11 -1.93 -2.11 132.00 133.00 1a8v h PRO 83 Ca -0.45 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.52 1a8v h PRO 83 Cb 1.23 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 1a8v h PRO 83 CO 0.54 0.19 -0.65 0.66 -0.21 0.00 0.00 178.00 178.53 1a8v h SER 84 N 0.00 0.00 -0.14 -2.05 4.64 -1.92 -1.66 113.55 112.42 1a8v h SER 84 Ca -0.00 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.18 1a8v h SER 84 Cb 0.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.54 1a8v h SER 84 CO 0.02 0.65 -0.47 1.56 -0.87 0.00 0.00 176.83 177.73 1a8v h GLN 85 N 0.00 0.56 -0.13 4.77 4.20 -1.76 -1.84 115.11 120.91 1a8v h GLN 85 Ca -0.01 -0.42 0.04 0.00 0.06 0.00 0.00 58.65 58.33 1a8v h GLN 85 Cb 1.21 0.08 -0.05 0.00 0.30 0.00 0.00 27.48 29.01 1a8v h GLN 85 CO 0.08 1.04 -0.19 0.82 -0.67 0.00 0.00 178.83 179.92 1a8v h ILE 86 N 0.19 0.52 -0.34 2.54 2.04 -1.30 -2.02 117.51 119.15 1a8v h ILE 86 Ca -0.02 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 1a8v h ILE 86 Cb 1.10 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 1a8v h ILE 86 CO 0.10 0.00 0.15 -0.09 0.00 0.00 0.00 178.15 178.31 1a8v h ARG 87 N -0.24 0.49 0.03 2.37 2.43 -1.32 0.27 114.38 118.41 1a8v h ARG 87 Ca 0.10 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1a8v h ARG 87 Cb 0.38 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1a8v h ARG 87 CO -0.27 0.46 -0.03 -0.09 -1.51 0.00 0.00 179.97 178.53 1a8v h ARG 88 N 0.40 -0.06 -0.01 0.20 2.43 -1.31 -2.90 114.38 113.13 1a8v h ARG 88 Ca 0.11 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1a8v h ARG 88 Cb 0.14 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1a8v h ARG 88 CO -0.01 -0.04 -0.24 1.19 -1.51 0.00 0.00 179.97 179.36 1a8v n PHE 89 N -5.13 0.00 -3.35 2.20 3.72 -0.76 -4.96 117.46 109.18 1a8v n PHE 89 Ca -0.07 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.16 1a8v n PHE 89 Cb 0.06 -0.10 0.07 0.00 -0.94 0.00 0.00 39.48 38.57 1a8v n PHE 89 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 1a8v n ASN 90 N -0.47 -5.33 -4.85 4.37 5.15 0.87 -4.98 115.26 110.03 1a8v n ASN 90 Ca 0.13 -0.72 -0.33 0.00 -0.60 0.00 0.00 54.58 53.06 1a8v n ASN 90 Cb 0.36 -4.98 -0.06 0.00 -0.53 0.00 0.00 39.78 34.57 1a8v n ASN 90 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1a8v s LEU 91 N -5.75 4.10 0.16 1.20 1.43 -0.72 -5.05 118.68 114.06 1a8v s LEU 91 Ca 0.34 1.22 0.01 0.00 -1.03 0.00 0.00 54.13 54.67 1a8v s LEU 91 Cb -0.05 -3.97 -0.04 0.00 0.03 0.00 0.00 46.19 42.15 1a8v s LEU 91 CO 0.75 -0.16 0.01 -0.13 0.23 0.00 0.00 176.35 177.05 1a8v s ARG 92 N -2.88 1.06 0.18 1.70 0.52 -1.26 -4.89 118.95 113.38 1a8v s ARG 92 Ca 0.52 -1.51 -0.31 0.00 -0.52 0.00 0.00 55.73 53.91 1a8v s ARG 92 Cb -0.11 -0.15 -0.10 0.00 0.52 0.00 0.00 34.95 35.11 1a8v s ARG 92 CO 0.18 -0.16 1.58 0.99 0.02 0.00 0.00 175.30 177.91 1a8v s THR 93 N -3.75 2.54 0.00 0.02 2.01 -1.26 -1.59 115.64 113.62 1a8v s THR 93 Ca 0.24 0.40 0.00 0.00 0.31 0.00 0.00 61.69 62.63 1a8v s THR 93 Cb 0.06 -3.25 0.00 0.00 0.01 0.00 0.00 72.50 69.32 1a8v s THR 93 CO 0.03 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.61 1a8v n GLY 94 N 3.65 0.64 3.77 4.40 0.00 -0.11 -5.02 105.19 112.52 1a8v n GLY 94 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 1a8v n GLY 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1a8v s ASP 95 N -2.63 6.57 -0.24 1.61 1.01 -0.62 -4.71 116.67 117.65 1a8v s ASP 95 Ca 0.00 2.83 -0.17 0.00 0.71 0.00 0.00 52.55 55.92 1a8v s ASP 95 Cb 0.00 -2.66 -0.03 0.00 1.01 0.00 0.00 42.92 41.24 1a8v s ASP 95 CO 0.00 -0.69 0.48 -0.89 0.21 0.00 0.00 175.17 174.28 1a8v s THR 96 N -1.14 5.11 -0.01 -1.27 2.01 -1.26 -0.69 115.64 118.38 1a8v s THR 96 Ca 0.51 0.83 0.07 0.00 0.31 0.00 0.00 61.69 63.40 1a8v s THR 96 Cb -0.42 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.27 1a8v s THR 96 CO 0.57 0.13 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.79 1a8v s ILE 97 N 2.03 1.67 0.11 1.82 1.01 -0.60 -5.00 121.20 122.25 1a8v s ILE 97 Ca 0.21 -0.92 0.06 0.00 0.00 0.00 0.00 60.65 59.99 1a8v s ILE 97 Cb -0.15 -1.39 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 1a8v s ILE 97 CO 0.09 0.46 -0.14 -0.94 0.00 0.00 0.00 174.94 174.42 1a8v s SER 98 N -0.52 1.89 0.00 3.58 1.04 -1.24 -1.87 113.70 116.57 1a8v s SER 98 Ca 0.08 -0.78 0.00 0.00 0.48 0.00 0.00 55.95 55.73 1a8v s SER 98 Cb -0.08 -0.06 0.00 0.00 0.10 0.00 0.00 66.02 65.98 1a8v s SER 98 CO -0.01 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.67 1a8v n GLY 99 N 0.64 -1.19 3.81 7.32 0.00 -0.32 -2.25 105.19 113.20 1a8v n GLY 99 Ca -0.16 -1.00 -0.34 0.00 0.00 0.00 0.00 46.02 44.51 1a8v n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1a8v s LYS 100 N -1.76 4.23 0.26 1.61 1.02 -0.03 -2.08 119.74 122.99 1a8v s LYS 100 Ca 0.00 1.21 0.06 0.00 0.02 0.00 0.00 55.97 57.25 1a8v s LYS 100 Cb 0.00 -2.29 -0.06 0.00 -0.52 0.00 0.00 37.83 34.96 1a8v s LYS 100 CO 0.00 -0.04 -0.04 0.96 -0.92 0.00 0.00 175.35 175.31 1a8v s ILE 101 N -2.03 1.47 0.21 2.17 -4.36 0.07 -0.75 121.20 117.97 1a8v s ILE 101 Ca 0.61 -2.10 0.04 0.00 -0.26 0.00 0.00 60.65 58.94 1a8v s ILE 101 Cb -0.12 -2.42 -0.05 0.00 1.25 0.00 0.00 42.46 41.12 1a8v s ILE 101 CO 0.16 -0.31 -0.03 0.00 0.24 0.00 0.00 174.94 175.00 1a8v s ARG 102 N -3.77 1.29 0.65 0.37 1.70 0.26 -4.42 118.95 115.04 1a8v s ARG 102 Ca 0.29 -1.63 -0.13 0.00 -0.47 0.00 0.00 55.73 53.79 1a8v s ARG 102 Cb 0.04 -0.68 -0.01 0.00 -0.57 0.00 0.00 34.95 33.74 1a8v s ARG 102 CO 0.11 -0.04 1.06 -2.14 -1.08 0.00 0.00 175.30 173.21 1a8v s PRO 103 N -3.82 3.11 0.52 3.89 0.02 -1.26 -1.56 135.00 135.91 1a8v s PRO 103 Ca 0.26 1.06 -0.23 0.00 0.02 0.00 0.00 61.00 62.11 1a8v s PRO 103 Cb 0.05 -2.01 -0.06 0.00 0.02 0.00 0.00 34.50 32.50 1a8v s PRO 103 CO 0.07 -0.97 1.39 -1.25 -0.33 0.00 0.00 177.00 175.91 1a8v s PRO 104 N -4.63 3.27 0.49 5.54 0.04 -1.24 -4.71 135.00 133.77 1a8v s PRO 104 Ca 0.60 2.32 0.06 0.00 0.04 0.00 0.00 61.00 64.02 1a8v s PRO 104 Cb -0.15 -2.37 0.06 0.00 0.04 0.00 0.00 34.50 32.08 1a8v s PRO 104 CO 0.47 -1.11 0.47 0.36 0.04 0.00 0.00 177.00 177.22 1a8v n LYS 105 N -0.81 0.74 -1.65 4.56 -0.00 -1.26 -4.93 118.16 114.82 1a8v n LYS 105 Ca 0.09 -2.90 -0.54 0.00 -0.00 0.00 0.00 58.31 54.96 1a8v n LYS 105 Cb 0.44 0.15 -0.06 0.00 -0.00 0.00 0.00 35.03 35.55 1a8v n LYS 105 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 1a8v n GLU 106 N -1.77 1.21 0.00 -1.58 1.02 -1.26 -0.03 120.64 118.23 1a8v n GLU 106 Ca 0.03 0.44 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 1a8v n GLU 106 Cb 0.54 -2.11 0.00 0.00 -0.02 0.00 0.00 31.44 29.84 1a8v n GLU 106 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1a8v n GLY 107 N 3.32 2.17 3.85 0.62 0.00 -1.26 -5.06 105.19 108.83 1a8v n GLY 107 Ca 0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.98 1a8v n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1a8v s GLU 108 N -0.93 3.09 0.00 1.61 2.02 0.95 -5.04 118.70 120.40 1a8v s GLU 108 Ca 0.00 -0.78 0.07 0.00 0.02 0.00 0.00 54.97 54.29 1a8v s GLU 108 Cb 0.00 -2.76 -0.07 0.00 0.10 0.00 0.00 34.13 31.40 1a8v s GLU 108 CO 0.00 0.50 0.33 0.54 0.02 0.00 0.00 175.26 176.64 1a8v n ARG 109 N -0.44 4.41 -4.23 1.61 1.74 -1.26 -4.63 116.66 113.86 1a8v n ARG 109 Ca -0.08 -0.04 -0.19 0.00 -0.77 0.00 0.00 57.85 56.77 1a8v n ARG 109 Cb 0.54 -0.86 -0.12 0.00 -1.02 0.00 0.00 32.46 31.01 1a8v n ARG 109 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1a8v s TYR 110 N -1.65 1.42 0.53 -1.55 2.02 -1.26 -4.94 117.35 111.92 1a8v s TYR 110 Ca 0.03 -0.51 -0.22 0.00 -0.37 0.00 0.00 57.07 56.01 1a8v s TYR 110 Cb 0.06 -0.76 -0.06 0.00 -0.40 0.00 0.00 41.96 40.79 1a8v s TYR 110 CO 0.29 0.14 1.21 1.19 -1.57 0.00 0.00 175.55 176.80 1a8v n PHE 111 N 0.80 1.77 -4.69 2.71 3.01 -1.26 -3.63 117.46 116.17 1a8v n PHE 111 Ca -0.17 0.46 -0.23 0.00 1.01 0.00 0.00 57.45 58.51 1a8v n PHE 111 Cb 0.56 -2.29 -0.15 0.00 -0.01 0.00 0.00 39.48 37.58 1a8v n PHE 111 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1a8v s ALA 112 N -1.33 1.26 0.22 4.37 0.00 -0.60 -0.58 121.76 125.10 1a8v s ALA 112 Ca 0.71 -0.62 -0.30 0.00 0.00 0.00 0.00 51.96 51.74 1a8v s ALA 112 Cb -0.44 -0.35 -0.09 0.00 0.00 0.00 0.00 23.12 22.23 1a8v s ALA 112 CO 0.50 0.28 1.39 -1.17 0.00 0.00 0.00 175.76 176.77 1a8v s LEU 113 N -0.22 4.40 -0.19 0.00 2.96 -0.10 -0.57 118.68 124.96 1a8v s LEU 113 Ca 0.03 2.54 -0.17 0.00 -0.22 0.00 0.00 54.13 56.32 1a8v s LEU 113 Cb -0.07 -3.61 -0.07 0.00 0.50 0.00 0.00 46.19 42.94 1a8v s LEU 113 CO 0.00 -0.64 -0.32 0.18 -1.32 0.00 0.00 176.35 174.25 1a8v n LEU 114 N 2.61 1.93 -3.82 -0.68 4.77 0.07 -4.84 117.00 117.02 1a8v n LEU 114 Ca 0.07 0.37 -0.17 0.00 -0.03 0.00 0.00 56.01 56.25 1a8v n LEU 114 Cb 0.41 -0.77 -0.16 0.00 -2.33 0.00 0.00 43.42 40.57 1a8v n LEU 114 CO 0.59 -0.16 -0.37 -0.54 -1.33 0.00 0.00 177.39 175.58 1a8v s LYS 115 N -2.77 0.29 0.88 3.23 1.02 -1.14 -4.98 119.74 116.26 1a8v s LYS 115 Ca -0.29 0.07 -0.13 0.00 0.02 0.00 0.00 55.97 55.63 1a8v s LYS 115 Cb 0.05 -0.46 0.14 0.00 -0.52 0.00 0.00 37.83 37.04 1a8v s LYS 115 CO 0.42 -0.12 1.24 0.14 -0.92 0.00 0.00 175.35 176.10 1a8v s VAL 116 N 0.95 2.02 0.00 3.17 -7.23 -1.26 -0.85 120.40 117.21 1a8v s VAL 116 Ca -0.10 -0.04 0.00 0.00 -1.81 0.00 0.00 61.98 60.04 1a8v s VAL 116 Cb -0.13 -2.98 0.00 0.00 0.56 0.00 0.00 36.38 33.82 1a8v s VAL 116 CO -0.02 0.00 0.00 -3.20 -0.31 0.00 0.00 175.10 171.57 1a8v n ASN 117 N -3.51 -0.58 0.00 4.85 2.85 -0.97 -4.86 115.26 113.03 1a8v n ASN 117 Ca 0.12 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.59 1a8v n ASN 117 Cb 0.60 -0.13 0.00 0.00 1.24 0.00 0.00 39.78 41.49 1a8v n ASN 117 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53