#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qyz s ARG 5 N 0.00 4.21 -0.09 -3.83 1.70 -1.26 -4.98 118.95 114.70 2qyz s ARG 5 Ca 0.00 2.42 -0.30 0.00 -0.47 0.00 0.00 55.73 57.39 2qyz s ARG 5 Cb 0.00 -3.02 -0.03 0.00 -0.57 0.00 0.00 34.95 31.33 2qyz s ARG 5 CO 0.00 -0.40 1.35 -1.21 -1.08 0.00 0.00 175.30 173.96 2qyz s GLU 6 N -1.76 4.25 -0.34 3.89 2.02 -1.26 -5.00 118.70 120.50 2qyz s GLU 6 Ca 0.52 1.82 -0.07 0.00 0.02 0.00 0.00 54.97 57.27 2qyz s GLU 6 Cb -0.44 -3.73 0.04 0.00 0.10 0.00 0.00 34.13 30.10 2qyz s GLU 6 CO 0.57 -0.66 0.11 0.08 0.02 0.00 0.00 175.26 175.38 2qyz s VAL 7 N 3.16 3.81 0.21 2.63 1.01 -1.26 -4.84 120.40 125.12 2qyz s VAL 7 Ca 0.60 -1.15 -0.19 0.00 0.00 0.00 0.00 61.98 61.24 2qyz s VAL 7 Cb -0.26 -3.17 0.03 0.00 0.00 0.00 0.00 36.38 32.98 2qyz s VAL 7 CO 0.21 -0.20 0.59 -1.59 0.00 0.00 0.00 175.10 174.11 2qyz s LYS 8 N 1.40 1.48 0.09 2.72 -2.85 -1.26 -5.07 119.74 116.25 2qyz s LYS 8 Ca -0.01 -0.83 0.05 0.00 -1.00 0.00 0.00 55.97 54.17 2qyz s LYS 8 Cb -0.20 0.56 -0.03 0.00 -2.06 0.00 0.00 37.83 36.10 2qyz s LYS 8 CO 0.03 -0.64 -0.13 -0.06 0.10 0.00 0.00 175.35 174.65 2qyz s PHE 9 N -3.87 1.20 0.32 1.78 0.08 -1.26 -0.51 117.98 115.73 2qyz s PHE 9 Ca 0.08 -0.54 0.09 0.00 0.12 0.00 0.00 56.93 56.68 2qyz s PHE 9 Cb -0.02 -0.66 -0.05 0.00 -0.57 0.00 0.00 43.02 41.72 2qyz s PHE 9 CO -0.02 0.06 0.03 -0.98 -0.10 0.00 0.00 175.22 174.21 2qyz s ARG 10 N -2.28 2.16 -0.01 0.44 1.70 0.32 -4.83 118.95 116.44 2qyz s ARG 10 Ca 0.03 -1.65 0.03 0.00 -0.47 0.00 0.00 55.73 53.67 2qyz s ARG 10 Cb -0.07 -2.02 -0.00 0.00 -0.57 0.00 0.00 34.95 32.29 2qyz s ARG 10 CO 0.02 0.18 -0.09 0.00 -1.08 0.00 0.00 175.30 174.33 2qyz s ALA 11 N -2.46 0.79 -0.32 7.88 0.00 0.12 -0.99 121.76 126.79 2qyz s ALA 11 Ca 0.35 -0.36 -0.13 0.00 0.00 0.00 0.00 51.96 51.82 2qyz s ALA 11 Cb -0.02 -0.25 -0.03 0.00 0.00 0.00 0.00 23.12 22.83 2qyz s ALA 11 CO 0.20 0.16 0.28 -0.46 0.00 0.00 0.00 175.76 175.94 2qyz s TRP 12 N -0.03 3.22 -0.47 0.00 -0.11 0.45 0.89 118.94 122.89 2qyz s TRP 12 Ca 0.01 0.01 -0.27 0.00 1.22 0.00 0.00 56.10 57.07 2qyz s TRP 12 Cb -0.06 -2.52 0.03 0.00 -1.50 0.00 0.00 33.47 29.42 2qyz s TRP 12 CO -0.00 -0.31 1.04 0.34 -4.62 0.00 0.00 176.95 173.40 2qyz s ASP 13 N 1.73 6.56 0.27 5.86 -1.08 0.15 -1.07 116.67 129.09 2qyz s ASP 13 Ca 0.09 0.29 0.25 0.00 -0.52 0.00 0.00 52.55 52.66 2qyz s ASP 13 Cb -0.17 -2.50 0.95 0.00 -1.46 0.00 0.00 42.92 39.74 2qyz s ASP 13 CO 0.11 -1.16 1.75 0.11 0.52 0.00 0.00 175.17 176.49 2qyz h LYS 14 N 9.17 0.00 0.16 4.34 1.57 -1.09 0.25 116.57 130.97 2qyz h LYS 14 Ca -0.24 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.21 2qyz h LYS 14 Cb 1.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.38 2qyz h LYS 14 CO 1.08 0.00 -1.69 0.93 -0.57 0.00 0.00 179.45 179.20 2qyz h GLU 15 N 0.00 0.33 -0.01 3.15 4.39 -1.91 -3.38 114.58 117.15 2qyz h GLU 15 Ca 0.00 -0.57 0.00 0.00 0.34 0.00 0.00 59.36 59.13 2qyz h GLU 15 Cb 0.50 0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 2qyz h GLU 15 CO 0.00 1.23 -0.17 1.28 -1.16 0.00 0.00 179.01 180.19 2qyz n LEU 16 N -3.53 1.45 -3.37 1.33 4.77 -1.16 -5.02 117.00 111.48 2qyz n LEU 16 Ca -0.22 -0.83 -0.14 0.00 -0.03 0.00 0.00 56.01 54.80 2qyz n LEU 16 Cb 1.06 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 42.17 2qyz n LEU 16 CO 0.51 0.28 0.10 0.59 -1.33 0.00 0.00 177.39 177.54 2qyz n ASN 17 N -0.01 -6.53 -3.70 -1.43 3.02 0.85 -5.01 115.26 102.45 2qyz n ASN 17 Ca 0.05 -0.54 -0.13 0.00 -0.03 0.00 0.00 54.58 53.93 2qyz n ASN 17 Cb 0.24 -4.14 -0.09 0.00 -0.61 0.00 0.00 39.78 35.18 2qyz n ASN 17 CO 0.00 0.00 0.00 -0.32 -2.62 0.00 0.00 177.26 174.32 2qyz s MET 18 N -4.21 0.59 -0.15 3.52 1.75 -1.13 -4.98 119.30 114.69 2qyz s MET 18 Ca 0.16 0.65 -0.11 0.00 -1.25 0.00 0.00 55.69 55.14 2qyz s MET 18 Cb -0.04 0.29 -0.05 0.00 2.84 0.00 0.00 34.83 37.87 2qyz s MET 18 CO 0.80 -0.08 0.22 1.41 -0.65 0.00 0.00 175.02 176.72 2qyz s MET 19 N 0.18 4.04 -0.12 4.11 1.75 -1.26 0.32 119.30 128.32 2qyz s MET 19 Ca -0.01 -0.03 0.01 0.00 -1.25 0.00 0.00 55.69 54.42 2qyz s MET 19 Cb -0.03 -3.36 -0.01 0.00 2.84 0.00 0.00 34.83 34.27 2qyz s MET 19 CO 0.01 0.41 -0.18 0.08 -0.65 0.00 0.00 175.02 174.69 2qyz s VAL 20 N -0.00 2.58 -0.00 10.11 1.01 0.26 -4.91 120.40 129.45 2qyz s VAL 20 Ca 0.14 -0.82 -0.02 0.00 0.00 0.00 0.00 61.98 61.27 2qyz s VAL 20 Cb -0.12 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 2qyz s VAL 20 CO 0.03 0.54 -0.06 -1.22 0.00 0.00 0.00 175.10 174.39 2qyz n TYR 21 N 3.65 0.00 0.00 5.22 4.01 -1.26 0.14 117.16 128.92 2qyz n TYR 21 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 2qyz n TYR 21 Cb 0.53 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 39.43 2qyz n TYR 21 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2qyz n THR 22 N -3.39 0.00 -0.45 -0.72 -2.24 -1.26 -4.91 114.28 101.32 2qyz n THR 22 Ca -0.06 0.00 0.07 0.00 -2.27 0.00 0.00 64.05 61.79 2qyz n THR 22 Cb 0.36 0.00 0.20 0.00 -2.10 0.00 0.00 70.33 68.80 2qyz n THR 22 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qyz n LYS 23 N 0.00 2.96 -0.43 -0.78 4.76 -1.26 -4.52 118.16 118.89 2qyz n LYS 23 Ca 0.00 -2.36 0.40 0.00 -2.87 0.00 0.00 58.31 53.49 2qyz n LYS 23 Cb 0.00 -1.49 0.76 0.00 -1.84 0.00 0.00 35.03 32.46 2qyz n LYS 23 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 2qyz h GLU 24 N 2.19 0.00 -4.36 1.97 3.07 -1.95 -3.40 114.58 112.10 2qyz h GLU 24 Ca 0.00 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 58.65 2qyz h GLU 24 Cb 1.00 0.00 -0.19 0.00 -0.84 0.00 0.00 28.75 28.71 2qyz h GLU 24 CO 0.08 0.00 -0.71 -0.65 -1.40 0.00 0.00 179.01 176.33 2qyz s GLN 25 N -4.88 0.53 0.46 2.33 -0.21 -1.26 -5.09 119.66 111.53 2qyz s GLN 25 Ca -0.05 -0.87 0.08 0.00 0.02 0.00 0.00 55.36 54.54 2qyz s GLN 25 Cb 0.24 -0.09 0.01 0.00 1.00 0.00 0.00 33.01 34.17 2qyz s GLN 25 CO 0.81 -0.01 0.51 -0.08 -2.12 0.00 0.00 175.29 174.40 2qyz s THR 26 N -2.12 2.58 -1.03 -0.19 -1.32 -1.26 -5.05 115.64 107.25 2qyz s THR 26 Ca -0.06 -1.19 0.00 0.00 -1.21 0.00 0.00 61.69 59.23 2qyz s THR 26 Cb -0.05 -2.77 0.00 0.00 -1.51 0.00 0.00 72.50 68.17 2qyz s THR 26 CO -0.02 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.00 2qyz n GLY 27 N -1.78 -1.39 3.12 6.08 0.00 -1.26 -5.11 105.19 104.85 2qyz n GLY 27 Ca 0.06 -1.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.05 2qyz n GLY 27 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2qyz s HIS 28 N -2.41 -1.18 -0.12 1.61 5.65 -1.26 -5.16 115.29 112.42 2qyz s HIS 28 Ca 0.00 1.41 -0.04 0.00 0.25 0.00 0.00 55.06 56.67 2qyz s HIS 28 Cb 0.00 0.34 -0.04 0.00 -1.18 0.00 0.00 32.58 31.71 2qyz s HIS 28 CO 0.00 -0.75 0.04 0.42 -0.65 0.00 0.00 174.74 173.81 2qyz s ILE 29 N 2.71 4.67 -0.08 0.89 -1.09 -1.26 -5.10 121.20 121.93 2qyz s ILE 29 Ca 0.12 -0.10 -0.03 0.00 -2.23 0.00 0.00 60.65 58.41 2qyz s ILE 29 Cb -0.15 -3.01 0.04 0.00 -1.58 0.00 0.00 42.46 37.76 2qyz s ILE 29 CO -0.18 0.57 0.16 -0.70 -1.23 0.00 0.00 174.94 173.56 2qyz s GLU 30 N -0.58 0.07 -0.01 2.79 2.12 -1.26 -5.14 118.70 116.68 2qyz s GLU 30 Ca 0.10 0.47 -0.04 0.00 0.36 0.00 0.00 54.97 55.87 2qyz s GLU 30 Cb -0.12 -0.21 0.00 0.00 0.26 0.00 0.00 34.13 34.06 2qyz s GLU 30 CO 0.02 -0.23 0.08 0.71 -0.54 0.00 0.00 175.26 175.31 2qyz s TYR 31 N 1.70 0.01 -0.83 5.30 1.51 -1.26 -5.06 117.35 118.71 2qyz s TYR 31 Ca -0.04 -0.00 0.00 0.00 -1.01 0.00 0.00 57.07 56.03 2qyz s TYR 31 Cb -0.12 -0.03 0.34 0.00 -0.11 0.00 0.00 41.96 42.05 2qyz s TYR 31 CO -0.06 -0.15 1.65 0.09 -1.11 0.00 0.00 175.55 175.97 2qyz n ASN 32 N 2.30 6.59 -3.30 2.29 5.03 -1.26 -4.97 115.26 121.94 2qyz n ASN 32 Ca -0.18 -3.74 -0.20 0.00 0.87 0.00 0.00 54.58 51.34 2qyz n ASN 32 Cb 0.57 -0.95 -0.08 0.00 -1.02 0.00 0.00 39.78 38.31 2qyz n ASN 32 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 2qyz s THR 33 N -4.72 0.00 0.77 3.41 -1.32 -1.26 -5.16 115.64 107.36 2qyz s THR 33 Ca 0.46 -1.99 -0.12 0.00 -1.21 0.00 0.00 61.69 58.83 2qyz s THR 33 Cb 0.30 -2.50 0.05 0.00 -1.51 0.00 0.00 72.50 68.84 2qyz s THR 33 CO -0.22 0.00 1.11 0.54 -2.21 0.00 0.00 174.62 173.84 2qyz s ASN 34 N -3.38 4.79 0.23 8.08 2.20 -1.26 -4.86 114.94 120.74 2qyz s ASN 34 Ca 0.41 1.12 -0.10 0.00 -0.94 0.00 0.00 52.86 53.35 2qyz s ASN 34 Cb 0.02 -1.83 0.34 0.00 -2.00 0.00 0.00 41.25 37.78 2qyz s ASN 34 CO 0.29 -1.76 1.64 -0.65 -2.94 0.00 0.00 177.10 173.68 2qyz h PRO 35 N -0.94 0.07 -0.20 3.55 0.11 -2.01 -1.38 132.00 131.21 2qyz h PRO 35 Ca -0.46 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 2qyz h PRO 35 Cb 1.28 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2qyz h PRO 35 CO 0.62 0.05 -0.05 0.00 -0.21 0.00 0.00 178.00 178.41 2qyz h ALA 36 N 1.66 0.27 -0.22 -0.75 0.00 -2.00 -2.23 119.26 115.99 2qyz h ALA 36 Ca 0.36 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2qyz h ALA 36 Cb 0.60 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2qyz h ALA 36 CO -0.64 0.05 -0.05 0.22 0.00 0.00 0.00 179.25 178.83 2qyz h ASP 37 N 0.10 0.31 -0.35 0.00 3.58 -1.88 -2.50 116.42 115.68 2qyz h ASP 37 Ca 0.05 -0.05 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 2qyz h ASP 37 Cb 0.49 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.45 2qyz h ASP 37 CO 0.02 0.41 0.08 0.74 -2.88 0.00 0.00 179.24 177.61 2qyz h THR 38 N 0.32 1.23 -0.49 2.25 2.02 -0.89 -0.95 112.91 116.40 2qyz h THR 38 Ca 0.07 -0.78 -0.02 0.00 0.77 0.00 0.00 66.41 66.45 2qyz h THR 38 Cb 0.31 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.76 2qyz h THR 38 CO 0.01 0.26 0.24 0.40 0.37 0.00 0.00 175.52 176.81 2qyz h ILE 39 N 0.42 1.19 -0.57 3.11 2.04 -1.16 -1.75 117.51 120.78 2qyz h ILE 39 Ca 0.11 -0.52 -0.03 0.00 1.00 0.00 0.00 64.86 65.42 2qyz h ILE 39 Cb 0.32 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 2qyz h ILE 39 CO 0.00 0.21 0.23 0.78 0.00 0.00 0.00 178.15 179.37 2qyz h ASN 40 N 0.65 0.79 -0.14 1.72 2.35 -1.27 -0.29 115.58 119.40 2qyz h ASN 40 Ca 0.17 -0.17 0.01 0.00 -0.55 0.00 0.00 56.30 55.76 2qyz h ASN 40 Cb 0.10 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2qyz h ASN 40 CO -0.02 0.74 0.07 0.40 -1.65 0.00 0.00 177.43 176.97 2qyz h ILE 41 N 0.79 1.01 -0.62 2.81 2.04 -0.98 -1.70 117.51 120.85 2qyz h ILE 41 Ca 0.19 -0.05 -0.04 0.00 1.00 0.00 0.00 64.86 65.95 2qyz h ILE 41 Cb 0.20 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 2qyz h ILE 41 CO -0.02 0.03 0.22 0.40 0.00 0.00 0.00 178.15 178.78 2qyz h ILE 42 N 0.15 1.24 -0.08 -0.67 2.04 -1.16 -2.09 117.51 116.94 2qyz h ILE 42 Ca 0.05 -0.80 -0.07 0.00 1.00 0.00 0.00 64.86 65.04 2qyz h ILE 42 Cb 0.00 0.59 -0.01 0.00 -0.74 0.00 0.00 36.82 36.66 2qyz h ILE 42 CO -0.03 0.31 -0.29 -0.07 0.00 0.00 0.00 178.15 178.07 2qyz h LEU 43 N 0.88 0.15 -2.64 1.44 3.38 -0.70 -3.06 115.31 114.75 2qyz h LEU 43 Ca 0.20 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.13 2qyz h LEU 43 Cb 0.26 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.97 2qyz h LEU 43 CO -0.01 0.44 0.00 0.59 0.09 0.00 0.00 178.44 179.55 2qyz n ASN 44 N -4.15 3.41 -4.57 -0.43 3.02 -0.67 -4.78 115.26 107.09 2qyz n ASN 44 Ca -0.01 -1.97 -0.41 0.00 -0.03 0.00 0.00 54.58 52.16 2qyz n ASN 44 Cb 0.37 -0.33 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 2qyz n ASN 44 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 2qyz s GLN 45 N -1.09 3.66 0.13 3.52 -1.52 -0.81 -4.87 119.66 118.68 2qyz s GLN 45 Ca 0.37 -1.44 -0.12 0.00 -1.95 0.00 0.00 55.36 52.21 2qyz s GLN 45 Cb 0.20 -5.41 -0.04 0.00 -0.22 0.00 0.00 33.01 27.54 2qyz s GLN 45 CO 0.26 -2.36 1.49 -0.44 -0.25 0.00 0.00 175.29 174.00 2qyz h ASP 46 N 8.96 0.91 0.11 5.90 3.32 -1.89 -2.94 116.42 130.78 2qyz h ASP 46 Ca 0.30 -0.43 0.00 0.00 0.02 0.00 0.00 57.03 56.92 2qyz h ASP 46 Cb 0.95 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.25 2qyz h ASP 46 CO 1.42 1.14 0.00 -0.90 -1.72 0.00 0.00 179.24 179.18 2qyz n ASP 47 N -4.18 0.00 0.28 6.45 5.68 -1.26 -1.35 116.55 122.17 2qyz n ASP 47 Ca -0.02 0.32 0.18 0.00 -0.50 0.00 0.00 54.79 54.77 2qyz n ASP 47 Cb 0.47 -0.36 0.73 0.00 -1.14 0.00 0.00 41.12 40.81 2qyz n ASP 47 CO 0.00 0.00 0.00 0.22 -1.33 0.00 0.00 177.20 176.09 2qyz h TYR 48 N 0.00 0.00 0.00 2.11 3.20 -1.94 -3.47 116.97 116.88 2qyz h TYR 48 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2qyz h TYR 48 Cb 0.05 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.32 2qyz h TYR 48 CO 0.00 0.00 0.00 0.41 -1.64 0.00 0.00 178.16 176.93 2qyz n GLY 49 N -0.08 0.51 3.77 1.82 0.00 -0.46 -4.96 105.19 105.79 2qyz n GLY 49 Ca 0.00 -0.81 -0.36 0.00 0.00 0.00 0.00 46.02 44.86 2qyz n GLY 49 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qyz s TYR 50 N -2.00 3.46 -0.28 1.61 1.51 -1.26 -0.49 117.35 119.90 2qyz s TYR 50 Ca 0.00 0.40 -0.09 0.00 -1.01 0.00 0.00 57.07 56.37 2qyz s TYR 50 Cb 0.00 -2.12 -0.03 0.00 -0.11 0.00 0.00 41.96 39.70 2qyz s TYR 50 CO 0.00 0.40 0.14 0.08 -1.11 0.00 0.00 175.55 175.06 2qyz s VAL 51 N 0.02 4.77 0.09 0.71 1.01 -0.23 -4.90 120.40 121.87 2qyz s VAL 51 Ca 0.10 -0.14 -0.23 0.00 0.00 0.00 0.00 61.98 61.71 2qyz s VAL 51 Cb -0.11 -3.32 -0.07 0.00 0.00 0.00 0.00 36.38 32.88 2qyz s VAL 51 CO 0.00 0.21 0.70 -0.36 0.00 0.00 0.00 175.10 175.65 2qyz s PHE 52 N 1.67 3.81 -0.05 5.22 0.08 -1.26 -0.41 117.98 127.04 2qyz s PHE 52 Ca 0.06 1.45 0.01 0.00 0.12 0.00 0.00 56.93 58.57 2qyz s PHE 52 Cb -0.16 -2.70 0.02 0.00 -0.57 0.00 0.00 43.02 39.61 2qyz s PHE 52 CO 0.07 0.44 -0.05 -1.64 -0.10 0.00 0.00 175.22 173.95 2qyz s MET 53 N -0.71 0.90 0.03 0.44 -1.94 -0.16 -4.99 119.30 112.86 2qyz s MET 53 Ca 0.34 -0.13 -0.14 0.00 -1.71 0.00 0.00 55.69 54.06 2qyz s MET 53 Cb -0.21 -0.89 -0.06 0.00 2.01 0.00 0.00 34.83 35.68 2qyz s MET 53 CO 0.22 -0.08 0.43 -1.14 -0.01 0.00 0.00 175.02 174.44 2qyz s GLN 54 N 0.93 3.91 0.07 2.03 0.74 -1.26 -0.52 119.66 125.55 2qyz s GLN 54 Ca -0.11 0.40 -0.31 0.00 0.05 0.00 0.00 55.36 55.39 2qyz s GLN 54 Cb -0.14 -3.16 -0.07 0.00 1.10 0.00 0.00 33.01 30.74 2qyz s GLN 54 CO 0.00 0.65 1.44 -0.47 -0.55 0.00 0.00 175.29 176.36 2qyz s TYR 55 N -1.17 2.96 -0.03 1.67 5.04 0.33 -1.41 117.35 124.74 2qyz s TYR 55 Ca 0.27 0.79 0.29 0.00 -2.44 0.00 0.00 57.07 55.98 2qyz s TYR 55 Cb -0.16 -3.73 0.99 0.00 0.35 0.00 0.00 41.96 39.41 2qyz s TYR 55 CO 0.15 -2.68 1.85 1.79 -1.34 0.00 0.00 175.55 175.32 2qyz h THR 56 N 4.57 0.15 0.00 4.34 1.35 -1.13 -3.44 112.91 118.75 2qyz h THR 56 Ca -0.41 -0.81 0.00 0.00 -0.55 0.00 0.00 66.41 64.64 2qyz h THR 56 Cb 1.20 1.71 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 2qyz h THR 56 CO 0.89 0.06 0.00 0.61 -0.25 0.00 0.00 175.52 176.83 2qyz n GLY 57 N 0.35 0.70 3.32 5.82 0.00 -1.26 -5.05 105.19 109.07 2qyz n GLY 57 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 2qyz n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qyz s LEU 58 N 0.00 2.38 0.06 0.99 1.43 -1.26 -5.04 118.68 117.24 2qyz s LEU 58 Ca 0.00 -0.79 0.09 0.00 -1.03 0.00 0.00 54.13 52.40 2qyz s LEU 58 Cb 0.00 -0.87 -0.03 0.00 0.03 0.00 0.00 46.19 45.32 2qyz s LEU 58 CO 0.00 0.01 -0.25 -0.54 0.23 0.00 0.00 176.35 175.80 2qyz s LYS 59 N -2.42 1.62 0.41 1.70 1.02 -1.26 0.06 119.74 120.87 2qyz s LYS 59 Ca 0.12 -1.13 -0.06 0.00 0.02 0.00 0.00 55.97 54.92 2qyz s LYS 59 Cb -0.08 -1.86 0.09 0.00 -0.52 0.00 0.00 37.83 35.47 2qyz s LYS 59 CO 0.06 0.47 0.56 -0.40 -0.92 0.00 0.00 175.35 175.11 2qyz n ASP 60 N 1.59 0.16 -0.29 2.83 5.75 0.19 -4.77 116.55 122.00 2qyz n ASP 60 Ca -0.17 -1.27 0.32 0.00 -0.01 0.00 0.00 54.79 53.65 2qyz n ASP 60 Cb 0.52 -0.41 0.70 0.00 -1.03 0.00 0.00 41.12 40.90 2qyz n ASP 60 CO 0.00 0.00 0.00 0.50 -0.11 0.00 0.00 177.20 177.59 2qyz h LYS 61 N 0.00 0.08 -0.55 0.11 3.64 -0.92 -0.43 116.57 118.50 2qyz h LYS 61 Ca -0.18 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.19 2qyz h LYS 61 Cb 0.53 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 2qyz h LYS 61 CO 0.14 0.05 0.00 0.09 -2.27 0.00 0.00 179.45 177.46 2qyz n ASN 62 N -4.29 4.36 0.00 4.20 5.03 -1.26 -4.93 115.26 118.37 2qyz n ASN 62 Ca 0.24 -2.46 0.00 0.00 0.87 0.00 0.00 54.58 53.23 2qyz n ASN 62 Cb 1.12 -0.52 0.00 0.00 -1.02 0.00 0.00 39.78 39.36 2qyz n ASN 62 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2qyz n GLU 63 N 0.79 -0.40 -2.64 3.52 4.71 -0.17 -4.99 120.64 121.46 2qyz n GLU 63 Ca 0.23 0.10 -0.42 0.00 -0.01 0.00 0.00 57.16 57.06 2qyz n GLU 63 Cb 0.82 -3.39 -0.03 0.00 -1.01 0.00 0.00 31.44 27.83 2qyz n GLU 63 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 2qyz s LYS 64 N -0.43 4.51 0.23 3.49 2.20 -1.26 -4.72 119.74 123.75 2qyz s LYS 64 Ca 0.00 1.49 -0.30 0.00 -0.36 0.00 0.00 55.97 56.80 2qyz s LYS 64 Cb 0.00 -3.46 -0.09 0.00 -1.51 0.00 0.00 37.83 32.77 2qyz s LYS 64 CO 0.00 -0.15 1.33 -1.21 -0.36 0.00 0.00 175.35 174.97 2qyz s GLU 65 N 1.23 4.36 -0.25 4.03 2.02 -1.26 0.54 118.70 129.37 2qyz s GLU 65 Ca 0.53 2.12 -0.10 0.00 0.02 0.00 0.00 54.97 57.54 2qyz s GLU 65 Cb -0.22 -3.16 -0.05 0.00 0.10 0.00 0.00 34.13 30.80 2qyz s GLU 65 CO 0.26 -0.27 0.14 0.42 0.02 0.00 0.00 175.26 175.84 2qyz s ILE 66 N -0.10 5.09 0.12 -1.63 1.01 0.11 -4.88 121.20 120.92 2qyz s ILE 66 Ca 0.56 0.09 0.05 0.00 0.00 0.00 0.00 60.65 61.35 2qyz s ILE 66 Cb -0.38 -3.39 -0.04 0.00 0.01 0.00 0.00 42.46 38.66 2qyz s ILE 66 CO 0.41 0.32 0.03 -0.31 0.00 0.00 0.00 174.94 175.39 2qyz s TYR 67 N 1.37 3.01 0.05 3.97 2.02 -1.26 -0.51 117.35 125.99 2qyz s TYR 67 Ca 0.07 -0.04 -0.38 0.00 -0.37 0.00 0.00 57.07 56.35 2qyz s TYR 67 Cb -0.15 -1.51 -0.18 0.00 -0.40 0.00 0.00 41.96 39.72 2qyz s TYR 67 CO 0.06 0.50 1.13 -1.91 -1.57 0.00 0.00 175.55 173.76 2qyz n GLU 68 N 0.25 0.46 -0.10 -0.62 2.13 -0.50 -1.18 120.64 121.09 2qyz n GLU 68 Ca -0.10 0.17 0.00 0.00 0.66 0.00 0.00 57.16 57.89 2qyz n GLU 68 Cb 0.53 -1.68 0.00 0.00 0.27 0.00 0.00 31.44 30.56 2qyz n GLU 68 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qyz n GLY 69 N 1.90 1.19 3.75 8.31 0.00 0.95 -4.63 105.19 116.66 2qyz n GLY 69 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 2qyz n GLY 69 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qyz s ASP 70 N -2.91 5.11 -0.18 1.61 1.01 -0.32 -1.33 116.67 119.65 2qyz s ASP 70 Ca 0.00 2.42 -0.02 0.00 0.71 0.00 0.00 52.55 55.66 2qyz s ASP 70 Cb 0.00 -2.60 -0.01 0.00 1.01 0.00 0.00 42.92 41.32 2qyz s ASP 70 CO 0.00 -1.65 -0.09 -0.63 0.21 0.00 0.00 175.17 173.01 2qyz s ILE 71 N -1.57 3.14 0.24 0.77 1.01 0.58 -0.72 121.20 124.65 2qyz s ILE 71 Ca 0.78 -0.59 0.12 0.00 0.00 0.00 0.00 60.65 60.96 2qyz s ILE 71 Cb -0.31 -2.38 -0.05 0.00 0.01 0.00 0.00 42.46 39.73 2qyz s ILE 71 CO 0.34 0.47 -0.22 0.27 0.00 0.00 0.00 174.94 175.80 2qyz s ILE 72 N 1.04 2.43 0.20 2.92 -4.36 -0.56 -0.50 121.20 122.36 2qyz s ILE 72 Ca -0.00 -2.25 0.11 0.00 -0.26 0.00 0.00 60.65 58.25 2qyz s ILE 72 Cb -0.15 -2.23 -0.04 0.00 1.25 0.00 0.00 42.46 41.29 2qyz s ILE 72 CO -0.01 -0.28 -0.22 -1.59 0.24 0.00 0.00 174.94 173.08 2qyz s LYS 73 N -3.15 1.51 -0.39 0.37 -2.85 -0.73 -1.37 119.74 113.13 2qyz s LYS 73 Ca 0.26 -1.55 -0.17 0.00 -1.00 0.00 0.00 55.97 53.51 2qyz s LYS 73 Cb -0.06 -1.75 0.01 0.00 -2.06 0.00 0.00 37.83 33.97 2qyz s LYS 73 CO 0.13 0.37 0.42 0.21 0.10 0.00 0.00 175.35 176.58 2qyz s LYS 74 N -2.84 3.32 -0.12 1.78 2.20 -1.26 -1.77 119.74 121.05 2qyz s LYS 74 Ca 0.22 -0.56 -0.06 0.00 -0.36 0.00 0.00 55.97 55.21 2qyz s LYS 74 Cb -0.07 -3.89 -0.07 0.00 -1.51 0.00 0.00 37.83 32.29 2qyz s LYS 74 CO 0.10 -0.72 1.23 0.43 -0.36 0.00 0.00 175.35 176.04 2qyz n SER 75 N 5.56 0.76 -0.00 1.43 7.64 0.71 -4.13 113.62 125.58 2qyz n SER 75 Ca -0.07 -2.13 0.01 0.00 1.01 0.00 0.00 58.87 57.69 2qyz n SER 75 Cb 0.48 -0.58 -0.02 0.00 -1.01 0.00 0.00 64.21 63.08 2qyz n SER 75 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2qyz n ASN 76 N 5.57 4.48 0.00 6.43 4.05 -1.26 -4.96 115.26 129.57 2qyz n ASN 76 Ca 0.13 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.16 2qyz n ASN 76 Cb 0.09 1.04 0.00 0.00 1.23 0.00 0.00 39.78 42.13 2qyz n ASN 76 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 177.26 173.07 2qyz n ARG 77 N -1.64 0.00 -2.72 1.20 0.63 -1.26 -5.06 116.66 107.81 2qyz n ARG 77 Ca -0.01 0.00 -0.31 0.00 -0.92 0.00 0.00 57.85 56.61 2qyz n ARG 77 Cb 0.12 -2.60 -0.03 0.00 0.45 0.00 0.00 32.46 30.40 2qyz n ARG 77 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2qyz s SER 78 N -2.48 6.56 0.00 6.15 1.04 -1.26 -5.00 113.70 118.71 2qyz s SER 78 Ca 0.00 1.28 0.31 0.00 0.48 0.00 0.00 55.95 58.02 2qyz s SER 78 Cb 0.00 -2.38 1.74 0.00 0.10 0.00 0.00 66.02 65.47 2qyz s SER 78 CO 0.00 -0.45 2.14 -1.20 0.98 0.00 0.00 173.24 174.71 2qyz n SER 79 N -1.35 0.00 -4.88 7.02 7.64 -1.26 -4.85 113.62 115.93 2qyz n SER 79 Ca 0.04 -0.64 -0.30 0.00 1.01 0.00 0.00 58.87 58.98 2qyz n SER 79 Cb 0.54 -0.12 -0.04 0.00 -1.01 0.00 0.00 64.21 63.59 2qyz n SER 79 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 2qyz s ASN 80 N -2.23 6.53 0.03 6.43 -0.87 -1.26 -4.50 114.94 119.06 2qyz s ASN 80 Ca 0.40 0.96 0.06 0.00 -1.57 0.00 0.00 52.86 52.70 2qyz s ASN 80 Cb 0.21 -2.25 -0.02 0.00 -0.02 0.00 0.00 41.25 39.17 2qyz s ASN 80 CO 0.40 -0.26 -0.16 -0.76 -2.57 0.00 0.00 177.10 173.75 2qyz s LEU 81 N -3.53 2.14 0.10 0.60 1.43 0.78 -4.47 118.68 115.72 2qyz s LEU 81 Ca 0.48 -0.44 0.07 0.00 -1.03 0.00 0.00 54.13 53.22 2qyz s LEU 81 Cb -0.11 -0.75 -0.03 0.00 0.03 0.00 0.00 46.19 45.33 2qyz s LEU 81 CO 0.28 0.10 -0.19 -0.31 0.23 0.00 0.00 176.35 176.47 2qyz s TYR 82 N -0.73 1.63 -0.12 0.29 2.02 -0.47 0.11 117.35 120.08 2qyz s TYR 82 Ca 0.04 -0.44 -0.03 0.00 -0.37 0.00 0.00 57.07 56.28 2qyz s TYR 82 Cb -0.08 -0.89 -0.03 0.00 -0.40 0.00 0.00 41.96 40.56 2qyz s TYR 82 CO 0.01 0.17 -0.01 -2.00 -1.57 0.00 0.00 175.55 172.15 2qyz s GLU 83 N -1.92 3.33 -0.31 -0.62 2.12 0.18 -1.50 118.70 119.98 2qyz s GLU 83 Ca 0.05 -0.44 -0.28 0.00 0.36 0.00 0.00 54.97 54.65 2qyz s GLU 83 Cb -0.10 -2.88 0.01 0.00 0.26 0.00 0.00 34.13 31.43 2qyz s GLU 83 CO 0.04 0.49 1.04 0.42 -0.54 0.00 0.00 175.26 176.71 2qyz s ILE 84 N -0.31 4.56 0.14 -3.70 -1.09 0.10 0.41 121.20 121.32 2qyz s ILE 84 Ca 0.06 1.72 0.10 0.00 -2.23 0.00 0.00 60.65 60.31 2qyz s ILE 84 Cb -0.12 -4.38 -0.04 0.00 -1.58 0.00 0.00 42.46 36.34 2qyz s ILE 84 CO 0.02 -0.42 -0.25 -0.51 -1.23 0.00 0.00 174.94 172.56 2qyz s ILE 85 N 3.52 2.16 -0.20 2.92 2.07 -0.37 -0.03 121.20 131.27 2qyz s ILE 85 Ca 0.44 -1.80 -0.10 0.00 -1.41 0.00 0.00 60.65 57.78 2qyz s ILE 85 Cb -0.13 -1.95 -0.05 0.00 0.13 0.00 0.00 42.46 40.47 2qyz s ILE 85 CO 0.14 -0.01 0.13 -0.47 -1.91 0.00 0.00 174.94 172.81 2qyz s TYR 86 N -1.29 3.38 -0.35 3.50 5.04 -1.26 -1.42 117.35 124.95 2qyz s TYR 86 Ca 0.14 0.28 -0.07 0.00 -2.44 0.00 0.00 57.07 54.99 2qyz s TYR 86 Cb -0.09 -2.17 0.05 0.00 0.35 0.00 0.00 41.96 40.10 2qyz s TYR 86 CO 0.07 0.24 0.13 -1.14 -1.34 0.00 0.00 175.55 173.51 2qyz s GLN 87 N 0.47 2.61 0.35 4.97 0.74 -0.20 -4.98 119.66 123.63 2qyz s GLN 87 Ca 0.07 -1.23 0.09 0.00 0.05 0.00 0.00 55.36 54.35 2qyz s GLN 87 Cb -0.12 -3.52 0.82 0.00 1.10 0.00 0.00 33.01 31.29 2qyz s GLN 87 CO -0.01 -0.71 1.86 -0.44 -0.55 0.00 0.00 175.29 175.44 2qyz h ASP 88 N 8.25 0.66 1.22 6.67 3.32 -1.98 -1.26 116.42 133.31 2qyz h ASP 88 Ca -0.23 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.87 2qyz h ASP 88 Cb 1.08 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.55 2qyz h ASP 88 CO 0.63 0.32 0.00 -1.54 -1.72 0.00 0.00 179.24 176.93 2qyz n SER 89 N -4.58 0.70 -0.24 6.45 3.41 -1.26 -0.45 113.62 117.65 2qyz n SER 89 Ca 0.18 0.59 0.03 0.00 -0.26 0.00 0.00 58.87 59.42 2qyz n SER 89 Cb 0.49 -0.77 0.08 0.00 -0.26 0.00 0.00 64.21 63.74 2qyz n SER 89 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2qyz n ILE 90 N -2.19 1.19 -4.28 -1.33 -5.35 -0.78 -5.03 119.36 101.60 2qyz n ILE 90 Ca 0.05 -1.21 -0.31 0.00 -0.27 0.00 0.00 62.75 61.01 2qyz n ILE 90 Cb 0.36 0.36 -0.09 0.00 -1.74 0.00 0.00 39.64 38.53 2qyz n ILE 90 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qyz n ALA 91 N -0.33 -1.99 -3.24 -1.28 0.00 0.40 -4.92 120.51 109.14 2qyz n ALA 91 Ca 0.07 -0.40 -0.13 0.00 0.00 0.00 0.00 53.44 52.98 2qyz n ALA 91 Cb 0.39 -0.92 -0.09 0.00 0.00 0.00 0.00 19.45 18.83 2qyz n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qyz s PHE 93 N -1.17 3.85 0.19 0.00 0.08 -1.26 -1.03 117.98 118.64 2qyz s PHE 93 Ca -0.12 1.78 -0.07 0.00 0.12 0.00 0.00 56.93 58.64 2qyz s PHE 93 Cb -0.05 -2.89 -0.02 0.00 -0.57 0.00 0.00 43.02 39.49 2qyz s PHE 93 CO 0.04 0.38 0.28 -0.98 -0.10 0.00 0.00 175.22 174.84 2qyz s ARG 94 N -1.53 1.26 -0.02 0.44 1.70 -0.50 -4.53 118.95 115.75 2qyz s ARG 94 Ca 0.43 -1.33 -0.22 0.00 -0.47 0.00 0.00 55.73 54.15 2qyz s ARG 94 Cb -0.22 0.37 -0.05 0.00 -0.57 0.00 0.00 34.95 34.48 2qyz s ARG 94 CO 0.27 -0.46 0.64 0.00 -1.08 0.00 0.00 175.30 174.68 2qyz s LYS 96 N 0.19 3.55 0.17 0.00 2.20 0.17 -4.78 119.74 121.24 2qyz s LYS 96 Ca 0.34 -0.57 -0.32 0.00 -0.36 0.00 0.00 55.97 55.06 2qyz s LYS 96 Cb -0.18 -2.89 -0.11 0.00 -1.51 0.00 0.00 37.83 33.14 2qyz s LYS 96 CO 0.18 0.14 1.75 0.08 -0.36 0.00 0.00 175.35 177.13 2qyz s VAL 97 N 0.62 2.28 -0.23 4.02 1.01 -1.26 0.47 120.40 127.31 2qyz s VAL 97 Ca -0.03 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.04 2qyz s VAL 97 Cb -0.15 -3.05 -0.19 0.00 0.00 0.00 0.00 36.38 32.99 2qyz s VAL 97 CO 0.03 0.00 -0.10 -0.38 0.00 0.00 0.00 175.10 174.65 2qyz n ILE 98 N 4.27 1.53 -3.64 2.22 5.41 0.12 -4.82 119.36 124.45 2qyz n ILE 98 Ca 0.16 -0.61 -0.10 0.00 1.00 0.00 0.00 62.75 63.21 2qyz n ILE 98 Cb 0.37 -1.38 -0.07 0.00 -0.71 0.00 0.00 39.64 37.85 2qyz n ILE 98 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2qyz s LYS 99 N -2.52 0.74 0.09 0.38 2.20 -0.98 -4.73 119.74 114.91 2qyz s LYS 99 Ca -0.30 1.09 0.00 0.00 -0.36 0.00 0.00 55.97 56.39 2qyz s LYS 99 Cb 0.08 0.25 0.00 0.00 -1.51 0.00 0.00 37.83 36.65 2qyz s LYS 99 CO 0.65 -0.12 0.00 0.41 -0.36 0.00 0.00 175.35 175.93 2qyz n GLY 100 N 3.56 -0.08 3.49 5.54 0.00 -1.26 -0.16 105.19 116.28 2qyz n GLY 100 Ca -0.17 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.38 2qyz n GLY 100 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2qyz n ASP 101 N -3.03 2.20 -0.96 1.61 10.43 -1.26 -4.81 116.55 120.74 2qyz n ASP 101 Ca 0.00 0.23 -0.01 0.00 2.57 0.00 0.00 54.79 57.58 2qyz n ASP 101 Cb 0.00 -1.33 0.06 0.00 1.84 0.00 0.00 41.12 41.69 2qyz n ASP 101 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 2qyz n ILE 102 N 7.43 0.89 0.04 0.53 -6.64 -1.26 -4.52 119.36 115.83 2qyz n ILE 102 Ca 0.41 -0.29 -0.22 0.00 -1.77 0.00 0.00 62.75 60.87 2qyz n ILE 102 Cb 0.29 -0.66 -0.14 0.00 -1.44 0.00 0.00 39.64 37.69 2qyz n ILE 102 CO 0.00 0.00 0.00 0.07 -1.77 0.00 0.00 176.55 174.85 2qyz h LYS 103 N 0.48 0.33 0.00 6.28 2.10 -2.00 -3.45 116.57 120.32 2qyz h LYS 103 Ca 0.05 -0.57 0.00 0.00 -2.00 0.00 0.00 60.65 58.13 2qyz h LYS 103 Cb 1.02 0.21 0.00 0.00 -0.90 0.00 0.00 32.23 32.56 2qyz h LYS 103 CO 0.14 1.27 0.00 0.43 -2.00 0.00 0.00 179.45 179.29 2qyz n SER 104 N -3.67 0.00 -4.24 7.07 7.64 -1.26 -4.94 113.62 114.22 2qyz n SER 104 Ca -0.26 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.28 2qyz n SER 104 Cb 1.02 0.00 -0.15 0.00 -1.01 0.00 0.00 64.21 64.07 2qyz n SER 104 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2qyz s PHE 105 N 0.00 2.83 0.22 1.43 5.36 -1.26 -4.98 117.98 121.58 2qyz s PHE 105 Ca 0.00 -1.17 0.00 0.00 -0.96 0.00 0.00 56.93 54.80 2qyz s PHE 105 Cb 0.00 -1.96 0.00 0.00 -0.34 0.00 0.00 43.02 40.72 2qyz s PHE 105 CO 0.00 -0.58 0.00 -2.30 -1.46 0.00 0.00 175.22 170.88 2qyz n PRO 106 N 4.40 1.38 -1.48 10.12 -0.02 -1.26 -4.78 135.00 143.37 2qyz n PRO 106 Ca -0.19 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 60.86 2qyz n PRO 106 Cb 0.51 -0.44 0.00 0.00 -0.02 0.00 0.00 33.50 33.55 2qyz n PRO 106 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qyz s LEU 108 N 1.50 3.70 0.33 0.00 2.96 -1.26 -4.71 118.68 121.20 2qyz s LEU 108 Ca 0.63 0.35 -0.09 0.00 -0.22 0.00 0.00 54.13 54.80 2qyz s LEU 108 Cb -0.63 -3.44 0.02 0.00 0.50 0.00 0.00 46.19 42.63 2qyz s LEU 108 CO 0.58 -1.23 0.57 0.54 -1.32 0.00 0.00 176.35 175.49 2qyz s ASN 109 N 2.47 0.40 0.28 3.68 2.20 -1.26 -4.98 114.94 117.72 2qyz s ASN 109 Ca 0.45 -1.24 -0.03 0.00 -0.94 0.00 0.00 52.86 51.11 2qyz s ASN 109 Cb -0.08 0.70 0.40 0.00 -2.00 0.00 0.00 41.25 40.27 2qyz s ASN 109 CO 0.30 -1.38 1.94 -0.29 -2.94 0.00 0.00 177.10 174.74 2qyz h ILE 110 N 2.11 1.19 0.60 0.54 2.10 -1.97 -2.05 117.51 120.04 2qyz h ILE 110 Ca -0.28 -0.41 -0.03 0.00 1.08 0.00 0.00 64.86 65.22 2qyz h ILE 110 Cb 1.25 -0.10 0.01 0.00 -1.09 0.00 0.00 36.82 36.88 2qyz h ILE 110 CO 0.38 0.22 -0.29 1.23 -1.08 0.00 0.00 178.15 178.61 2qyz h GLY 111 N 1.19 -0.85 2.00 8.18 0.00 -1.97 -3.18 103.07 108.45 2qyz h GLY 111 Ca 0.35 0.31 0.00 0.00 0.00 0.00 0.00 47.33 47.99 2qyz h GLY 111 CO -0.09 -0.31 0.00 -0.91 0.00 0.00 0.00 176.54 175.23 2qyz h THR 112 N -0.82 0.00 -0.03 4.70 1.35 -1.73 -2.30 112.91 114.08 2qyz h THR 112 Ca -0.08 -0.34 0.00 0.00 -0.55 0.00 0.00 66.41 65.43 2qyz h THR 112 Cb 0.63 1.20 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 2qyz h THR 112 CO 0.14 0.00 -0.03 1.33 -0.25 0.00 0.00 175.52 176.71 2qyz n VAL 113 N -2.65 0.00 0.24 6.82 0.24 -0.81 -4.36 118.33 117.81 2qyz n VAL 113 Ca 0.01 -0.48 0.14 0.00 -2.04 0.00 0.00 64.34 61.97 2qyz n VAL 113 Cb 0.25 1.48 0.81 0.00 -1.47 0.00 0.00 33.84 34.91 2qyz n VAL 113 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 2qyz h ARG 114 N 4.56 0.00 -0.11 7.34 0.11 -1.38 -1.85 114.38 123.05 2qyz h ARG 114 Ca 0.00 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 60.03 2qyz h ARG 114 Cb 0.98 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 32.03 2qyz h ARG 114 CO 0.00 0.00 -0.34 0.09 0.10 0.00 0.00 179.97 179.82 2qyz n ASN 115 N -4.05 2.01 -4.79 0.08 3.02 -1.26 -4.20 115.26 106.07 2qyz n ASN 115 Ca -0.01 -3.80 -0.22 0.00 -0.03 0.00 0.00 54.58 50.52 2qyz n ASN 115 Cb 0.18 -0.55 -0.05 0.00 -0.61 0.00 0.00 39.78 38.75 2qyz n ASN 115 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qyz s GLU 117 N -3.86 0.60 0.07 0.00 2.12 -0.73 -0.63 118.70 116.27 2qyz s GLU 117 Ca 0.36 -0.06 -0.31 0.00 0.36 0.00 0.00 54.97 55.33 2qyz s GLU 117 Cb -0.06 -0.66 -0.07 0.00 0.26 0.00 0.00 34.13 33.60 2qyz s GLU 117 CO 0.24 -0.07 1.41 0.08 -0.54 0.00 0.00 175.26 176.38 2qyz s VAL 118 N 0.81 3.43 -0.16 3.70 1.01 -1.26 -1.77 120.40 126.15 2qyz s VAL 118 Ca -0.10 0.96 0.04 0.00 0.00 0.00 0.00 61.98 62.88 2qyz s VAL 118 Cb -0.13 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.59 2qyz s VAL 118 CO -0.00 0.04 0.16 -0.38 0.00 0.00 0.00 175.10 174.92 2qyz n ILE 119 N 4.26 0.00 -2.86 2.22 2.08 0.34 -4.99 119.36 120.42 2qyz n ILE 119 Ca 0.12 -0.34 0.00 0.00 0.56 0.00 0.00 62.75 63.09 2qyz n ILE 119 Cb 0.43 0.88 0.00 0.00 -0.75 0.00 0.00 39.64 40.20 2qyz n ILE 119 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2qyz n GLY 120 N 1.33 -1.17 3.47 7.39 0.00 -1.23 -5.00 105.19 109.98 2qyz n GLY 120 Ca 0.00 -1.36 -0.11 0.00 0.00 0.00 0.00 46.02 44.56 2qyz n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qyz s ASN 121 N -3.43 0.12 0.14 1.61 2.20 -1.26 -0.31 114.94 114.00 2qyz s ASN 121 Ca 0.00 -1.13 0.21 0.00 -0.94 0.00 0.00 52.86 50.99 2qyz s ASN 121 Cb 0.00 0.54 0.85 0.00 -2.00 0.00 0.00 41.25 40.64 2qyz s ASN 121 CO 0.00 -1.08 1.64 2.30 -2.94 0.00 0.00 177.10 177.02 2qyz n ILE 122 N -0.38 0.81 -0.12 0.54 -5.35 -0.44 -1.05 119.36 113.36 2qyz n ILE 122 Ca -0.00 0.17 -0.26 0.00 -0.27 0.00 0.00 62.75 62.39 2qyz n ILE 122 Cb 0.63 -1.00 -0.11 0.00 -1.74 0.00 0.00 39.64 37.42 2qyz n ILE 122 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2qyz n TYR 123 N -1.90 0.27 0.82 4.28 4.01 -1.26 -4.57 117.16 118.81 2qyz n TYR 123 Ca 0.03 0.10 0.13 0.00 -0.16 0.00 0.00 57.90 58.00 2qyz n TYR 123 Cb 0.23 -1.03 0.38 0.00 -0.31 0.00 0.00 39.34 38.62 2qyz n TYR 123 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2qyz n GLU 124 N -4.03 0.12 -3.14 -0.72 1.02 -1.06 -4.38 120.64 108.45 2qyz n GLU 124 Ca -0.47 0.07 -0.24 0.00 -0.02 0.00 0.00 57.16 56.49 2qyz n GLU 124 Cb 0.88 -1.61 -0.05 0.00 -0.02 0.00 0.00 31.44 30.64 2qyz n GLU 124 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2qyz n ASN 125 N -1.81 2.76 0.30 1.62 4.13 -0.21 -4.88 115.26 117.16 2qyz n ASN 125 Ca 0.05 -3.32 0.15 0.00 1.68 0.00 0.00 54.58 53.15 2qyz n ASN 125 Cb 0.38 -0.61 0.91 0.00 -1.54 0.00 0.00 39.78 38.92 2qyz n ASN 125 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2qyz h PRO 126 N 3.37 0.00 0.00 3.52 0.13 -1.79 -1.06 132.00 136.16 2qyz h PRO 126 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 2qyz h PRO 126 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 2qyz h PRO 126 CO 0.69 0.01 0.00 0.93 -0.23 0.00 0.00 178.00 179.39 2qyz h GLU 127 N 0.00 0.00 0.00 0.86 3.07 -1.95 -0.46 114.58 116.10 2qyz h GLU 127 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2qyz h GLU 127 Cb 0.02 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.93 2qyz h GLU 127 CO 0.00 0.00 -0.41 1.28 -1.40 0.00 0.00 179.01 178.48 2qyz n LEU 128 N -2.85 0.41 -4.86 1.33 4.77 -0.40 -4.96 117.00 110.43 2qyz n LEU 128 Ca -0.01 0.10 -0.31 0.00 -0.03 0.00 0.00 56.01 55.76 2qyz n LEU 128 Cb 0.16 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.92 2qyz n LEU 128 CO 0.21 0.10 0.58 -0.76 -1.33 0.00 0.00 177.39 176.18 2qyz s LEU 129 N -3.02 3.68 0.00 2.23 1.43 -0.18 -5.00 118.68 117.81 2qyz s LEU 129 Ca 0.11 1.36 0.00 0.00 -1.03 0.00 0.00 54.13 54.58 2qyz s LEU 129 Cb 0.18 -4.29 0.00 0.00 0.03 0.00 0.00 46.19 42.11 2qyz s LEU 129 CO 0.67 -0.53 0.00 -1.84 0.23 0.00 0.00 176.35 174.88