#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qlf s GLN 59 N 0.00 0.09 0.14 -0.72 0.74 -1.26 -5.12 119.66 113.54 2qlf s GLN 59 Ca 0.00 0.16 -0.31 0.00 0.05 0.00 0.00 55.36 55.26 2qlf s GLN 59 Cb 0.00 0.00 -0.10 0.00 1.10 0.00 0.00 33.01 34.02 2qlf s GLN 59 CO 0.00 -0.04 1.56 0.71 -0.55 0.00 0.00 175.29 176.97 2qlf s TYR 60 N 0.26 2.97 -0.08 1.67 2.02 -1.26 -4.90 117.35 118.02 2qlf s TYR 60 Ca -0.02 0.61 -0.30 0.00 -0.37 0.00 0.00 57.07 56.99 2qlf s TYR 60 Cb -0.03 -3.91 -0.05 0.00 -0.40 0.00 0.00 41.96 37.57 2qlf s TYR 60 CO -0.01 -3.39 1.69 1.21 -1.57 0.00 0.00 175.55 173.48 2qlf s ASN 61 N 1.36 6.56 0.00 2.29 2.47 -1.26 -4.85 114.94 121.51 2qlf s ASN 61 Ca 0.70 2.15 0.21 0.00 0.42 0.00 0.00 52.86 56.34 2qlf s ASN 61 Cb -0.42 -2.53 0.44 0.00 -1.45 0.00 0.00 41.25 37.28 2qlf s ASN 61 CO 0.31 -1.03 1.38 0.23 -3.72 0.00 0.00 177.10 174.28 2qlf n MET 62 N 7.30 2.48 -2.31 0.43 2.81 -1.26 -4.83 117.12 121.74 2qlf n MET 62 Ca 0.18 -2.29 -0.40 0.00 -1.81 0.00 0.00 57.70 53.38 2qlf n MET 62 Cb 0.43 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.44 2qlf n MET 62 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 2qlf n ASN 63 N 1.39 4.35 -4.30 7.83 4.05 -1.26 -4.86 115.26 122.46 2qlf n ASN 63 Ca 0.19 -2.86 -0.16 0.00 0.45 0.00 0.00 54.58 52.20 2qlf n ASN 63 Cb 0.58 -1.71 -0.10 0.00 1.23 0.00 0.00 39.78 39.78 2qlf n ASN 63 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 177.26 173.85 2qlf s PHE 64 N 5.38 1.45 -0.43 1.20 0.08 -1.26 -5.04 117.98 119.37 2qlf s PHE 64 Ca 0.56 -1.13 0.23 0.00 0.12 0.00 0.00 56.93 56.71 2qlf s PHE 64 Cb 0.05 -0.84 0.33 0.00 -0.57 0.00 0.00 43.02 41.99 2qlf s PHE 64 CO 0.07 -0.29 1.60 1.05 -0.10 0.00 0.00 175.22 177.55 2qlf h GLU 65 N 2.47 0.00 -4.64 0.44 4.11 -1.89 -3.44 114.58 111.63 2qlf h GLU 65 Ca -0.38 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.51 2qlf h GLU 65 Cb 1.24 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 30.15 2qlf h GLU 65 CO 0.61 0.01 -0.82 0.21 0.07 0.00 0.00 179.01 179.09 2qlf s LYS 66 N -3.20 1.92 0.17 1.06 2.20 -0.60 -5.01 119.74 116.28 2qlf s LYS 66 Ca 0.07 -0.48 -0.12 0.00 -0.36 0.00 0.00 55.97 55.08 2qlf s LYS 66 Cb 0.05 -1.60 0.08 0.00 -1.51 0.00 0.00 37.83 34.85 2qlf s LYS 66 CO 0.67 0.00 1.73 1.25 -0.36 0.00 0.00 175.35 178.65 2qlf h LEU 67 N 7.12 0.82 0.00 5.43 5.85 -1.83 -0.85 115.31 131.84 2qlf h LEU 67 Ca -0.30 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.26 2qlf h LEU 67 Cb 1.19 -0.21 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2qlf h LEU 67 CO 0.47 0.76 0.00 0.61 -0.34 0.00 0.00 178.44 179.94 2qlf n GLY 68 N -0.84 1.77 3.89 3.75 0.00 -1.26 -1.08 105.19 111.42 2qlf n GLY 68 Ca 0.04 -1.60 -0.30 0.00 0.00 0.00 0.00 46.02 44.15 2qlf n GLY 68 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2qlf s LYS 69 N -1.73 3.72 -0.13 1.61 2.20 -1.26 -1.19 119.74 122.97 2qlf s LYS 69 Ca 0.00 0.20 -0.03 0.00 -0.36 0.00 0.00 55.97 55.78 2qlf s LYS 69 Cb 0.00 -2.58 0.05 0.00 -1.51 0.00 0.00 37.83 33.78 2qlf s LYS 69 CO 0.00 0.19 0.06 0.00 -0.36 0.00 0.00 175.35 175.24 2qlf s ILE 71 N 2.07 5.24 -0.28 0.00 1.01 -0.52 -1.59 121.20 127.12 2qlf s ILE 71 Ca 0.03 -0.03 -0.08 0.00 0.00 0.00 0.00 60.65 60.57 2qlf s ILE 71 Cb -0.15 -3.74 -0.01 0.00 0.01 0.00 0.00 42.46 38.57 2qlf s ILE 71 CO -0.07 -0.01 0.10 -0.63 0.00 0.00 0.00 174.94 174.34 2qlf s ILE 72 N 1.86 4.35 -0.32 2.92 1.01 -0.53 0.48 121.20 130.97 2qlf s ILE 72 Ca 0.09 -0.35 -0.10 0.00 0.00 0.00 0.00 60.65 60.29 2qlf s ILE 72 Cb -0.17 -3.14 -0.00 0.00 0.01 0.00 0.00 42.46 39.16 2qlf s ILE 72 CO 0.11 0.20 0.17 -0.63 0.00 0.00 0.00 174.94 174.79 2qlf s ILE 73 N 1.60 4.65 -0.60 2.92 1.01 0.15 -1.30 121.20 129.63 2qlf s ILE 73 Ca 0.05 -0.47 -0.04 0.00 0.00 0.00 0.00 60.65 60.18 2qlf s ILE 73 Cb -0.16 -3.41 0.15 0.00 0.01 0.00 0.00 42.46 39.06 2qlf s ILE 73 CO 0.04 0.01 0.42 0.21 0.00 0.00 0.00 174.94 175.63 2qlf s ASN 74 N 1.61 5.40 -0.39 3.58 2.47 0.41 -1.08 114.94 126.95 2qlf s ASN 74 Ca 0.04 -2.64 -0.20 0.00 0.42 0.00 0.00 52.86 50.48 2qlf s ASN 74 Cb -0.17 -1.89 0.01 0.00 -1.45 0.00 0.00 41.25 37.75 2qlf s ASN 74 CO 0.07 -0.44 0.62 0.20 -3.72 0.00 0.00 177.10 173.83 2qlf s ASN 75 N 1.14 6.36 -0.14 -4.21 0.01 -0.59 -1.90 114.94 115.61 2qlf s ASN 75 Ca 0.15 -0.09 -0.03 0.00 -0.71 0.00 0.00 52.86 52.18 2qlf s ASN 75 Cb -0.20 -2.31 -0.08 0.00 0.41 0.00 0.00 41.25 39.07 2qlf s ASN 75 CO -0.04 -0.65 -0.16 1.17 -1.51 0.00 0.00 177.10 175.91 2qlf n LYS 76 N 6.08 0.33 -4.28 -0.60 4.81 -1.26 -4.48 118.16 118.77 2qlf n LYS 76 Ca -0.02 0.11 -0.35 0.00 -0.87 0.00 0.00 58.31 57.18 2qlf n LYS 76 Cb 0.48 -1.15 -0.10 0.00 0.02 0.00 0.00 35.03 34.28 2qlf n LYS 76 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2qlf s ASN 77 N -5.84 5.30 0.21 3.14 0.01 -1.26 -1.69 114.94 114.80 2qlf s ASN 77 Ca -0.20 0.10 0.09 0.00 -0.71 0.00 0.00 52.86 52.14 2qlf s ASN 77 Cb 0.06 -1.67 -0.05 0.00 0.41 0.00 0.00 41.25 40.01 2qlf s ASN 77 CO 0.29 0.30 -0.17 -0.36 -1.51 0.00 0.00 177.10 175.65 2qlf s PHE 78 N -0.40 1.86 0.21 2.20 0.40 -1.26 -4.60 117.98 116.39 2qlf s PHE 78 Ca 0.08 -0.49 -0.31 0.00 -0.60 0.00 0.00 56.93 55.61 2qlf s PHE 78 Cb -0.12 -0.87 -0.10 0.00 0.51 0.00 0.00 43.02 42.44 2qlf s PHE 78 CO 0.02 0.42 1.46 -0.51 0.70 0.00 0.00 175.22 177.31 2qlf s ASP 79 N -3.13 6.67 0.50 1.36 1.01 0.16 -4.85 116.67 118.38 2qlf s ASP 79 Ca 0.22 2.60 0.18 0.00 0.71 0.00 0.00 52.55 56.26 2qlf s ASP 79 Cb -0.03 -2.61 0.97 0.00 1.01 0.00 0.00 42.92 42.26 2qlf s ASP 79 CO 0.08 -0.72 1.49 0.11 0.21 0.00 0.00 175.17 176.35 2qlf h LYS 80 N 5.68 0.00 -0.01 8.23 1.79 -1.89 0.17 116.57 130.54 2qlf h LYS 80 Ca -0.45 0.00 -0.23 0.00 -2.18 0.00 0.00 60.65 57.79 2qlf h LYS 80 Cb 1.21 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 31.87 2qlf h LYS 80 CO 0.82 0.00 -0.95 -0.24 -1.08 0.00 0.00 179.45 178.00 2qlf h VAL 81 N 0.00 1.37 0.00 0.50 3.04 -1.93 -3.16 116.25 116.07 2qlf h VAL 81 Ca 0.00 -2.38 -0.03 0.00 -1.01 0.00 0.00 66.70 63.29 2qlf h VAL 81 Cb 0.83 2.38 -0.00 0.00 -2.01 0.00 0.00 31.29 32.49 2qlf h VAL 81 CO 0.00 0.72 -0.13 0.71 -1.01 0.00 0.00 177.57 177.86 2qlf h THR 82 N 0.28 0.88 0.00 3.17 1.35 -0.96 -3.46 112.91 114.18 2qlf h THR 82 Ca -0.09 -0.47 0.00 0.00 -0.55 0.00 0.00 66.41 65.30 2qlf h THR 82 Cb 1.59 1.27 0.00 0.00 -1.73 0.00 0.00 68.15 69.28 2qlf h THR 82 CO 0.17 0.12 0.00 0.61 -0.25 0.00 0.00 175.52 176.17 2qlf n GLY 83 N -1.01 2.12 3.79 5.82 0.00 -1.20 -5.03 105.19 109.70 2qlf n GLY 83 Ca -0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.64 2qlf n GLY 83 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2qlf s MET 84 N -0.31 4.35 0.59 1.61 -1.94 -1.26 -5.07 119.30 117.26 2qlf s MET 84 Ca 0.00 1.30 0.04 0.00 -1.71 0.00 0.00 55.69 55.33 2qlf s MET 84 Cb 0.00 -2.52 0.07 0.00 2.01 0.00 0.00 34.83 34.40 2qlf s MET 84 CO 0.00 0.06 0.81 0.20 -0.01 0.00 0.00 175.02 176.08 2qlf s GLY 85 N -1.80 1.80 0.00 -0.03 0.00 -1.26 -4.62 107.32 101.42 2qlf s GLY 85 Ca 0.56 -1.74 -0.30 0.00 0.00 0.00 0.00 44.72 43.24 2qlf s GLY 85 CO 0.21 -1.34 1.61 0.14 0.00 0.00 0.00 173.10 173.72 2qlf s VAL 86 N -2.78 3.40 -1.28 1.40 1.01 -1.26 -4.74 120.40 116.16 2qlf s VAL 86 Ca 0.61 0.69 -0.16 0.00 0.00 0.00 0.00 61.98 63.12 2qlf s VAL 86 Cb -0.07 -3.45 0.10 0.00 0.00 0.00 0.00 36.38 32.97 2qlf s VAL 86 CO 0.39 -0.03 1.66 0.54 0.00 0.00 0.00 175.10 177.67 2qlf n ARG 87 N 6.26 3.25 -1.82 2.72 1.74 -0.68 -4.99 116.66 123.14 2qlf n ARG 87 Ca 0.16 -3.45 -0.36 0.00 -0.77 0.00 0.00 57.85 53.43 2qlf n ARG 87 Cb 0.42 -3.33 0.06 0.00 -1.02 0.00 0.00 32.46 28.59 2qlf n ARG 87 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 2qlf s ASN 88 N 3.65 4.81 0.00 0.55 0.01 -1.26 -2.48 114.94 120.23 2qlf s ASN 88 Ca 0.50 2.48 0.00 0.00 -0.71 0.00 0.00 52.86 55.13 2qlf s ASN 88 Cb 0.02 -2.61 0.00 0.00 0.41 0.00 0.00 41.25 39.08 2qlf s ASN 88 CO 0.05 -1.85 0.00 0.61 -1.51 0.00 0.00 177.10 174.39 2qlf n GLY 89 N 0.65 2.46 0.24 0.66 0.00 -1.26 -4.86 105.19 103.08 2qlf n GLY 89 Ca 0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.12 2qlf n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qlf h THR 90 N 0.00 1.28 0.00 2.61 1.03 -1.89 -2.12 112.91 113.81 2qlf h THR 90 Ca 0.00 -1.35 -0.05 0.00 -0.01 0.00 0.00 66.41 65.01 2qlf h THR 90 Cb 0.00 1.38 -0.01 0.00 -1.07 0.00 0.00 68.15 68.45 2qlf h THR 90 CO 0.00 0.43 -0.22 0.44 -0.01 0.00 0.00 175.52 176.16 2qlf h ASP 91 N 0.46 0.00 -0.22 0.00 3.32 -1.89 0.11 116.42 118.20 2qlf h ASP 91 Ca 0.06 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.97 2qlf h ASP 91 Cb 0.73 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.28 2qlf h ASP 91 CO 0.06 0.22 -0.42 0.50 -1.72 0.00 0.00 179.24 177.87 2qlf h LYS 92 N 0.00 0.68 -0.07 3.56 3.64 -1.80 -1.76 116.57 120.82 2qlf h LYS 92 Ca -0.00 -0.43 -0.00 0.00 -1.27 0.00 0.00 60.65 58.95 2qlf h LYS 92 Cb 0.45 0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.31 2qlf h LYS 92 CO 0.03 1.05 0.03 -0.44 -2.27 0.00 0.00 179.45 177.85 2qlf h ASP 93 N 0.39 0.08 0.25 4.20 3.32 -0.76 -0.66 116.42 123.25 2qlf h ASP 93 Ca 0.01 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.95 2qlf h ASP 93 Cb 1.02 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 40.51 2qlf h ASP 93 CO 0.09 0.17 -0.46 0.00 -1.72 0.00 0.00 179.24 177.33 2qlf h ALA 94 N 0.92 -1.02 -1.00 3.45 0.00 -0.78 0.33 119.26 121.15 2qlf h ALA 94 Ca 0.02 -0.13 0.12 0.00 0.00 0.00 0.00 54.91 54.92 2qlf h ALA 94 Cb 0.11 0.78 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 2qlf h ALA 94 CO -0.00 -1.09 0.63 1.49 0.00 0.00 0.00 179.25 180.28 2qlf h GLU 95 N -0.76 0.97 -0.82 0.00 4.81 -1.30 0.54 114.58 118.02 2qlf h GLU 95 Ca -0.03 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 2qlf h GLU 95 Cb 0.71 -0.22 -0.04 0.00 0.63 0.00 0.00 28.75 29.84 2qlf h GLU 95 CO -0.17 0.64 0.42 0.00 -0.73 0.00 0.00 179.01 179.17 2qlf h ALA 96 N 1.54 1.05 -0.15 2.92 0.00 -0.42 -2.55 119.26 121.65 2qlf h ALA 96 Ca 0.50 -0.14 -0.21 0.00 0.00 0.00 0.00 54.91 55.05 2qlf h ALA 96 Cb 0.49 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 17.96 2qlf h ALA 96 CO -0.26 0.58 -0.75 -0.07 0.00 0.00 0.00 179.25 178.75 2qlf h LEU 97 N 1.14 0.84 -1.76 0.00 3.38 0.18 -2.84 115.31 116.25 2qlf h LEU 97 Ca 0.28 -0.54 0.10 0.00 0.09 0.00 0.00 57.88 57.81 2qlf h LEU 97 Cb 0.07 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.55 2qlf h LEU 97 CO -0.04 1.32 0.35 0.15 0.09 0.00 0.00 178.44 180.32 2qlf h PHE 98 N 0.49 0.29 0.05 1.13 3.57 0.32 -1.25 116.94 121.54 2qlf h PHE 98 Ca -0.04 0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.38 2qlf h PHE 98 Cb 1.36 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 40.01 2qlf h PHE 98 CO 0.07 0.14 -0.41 0.87 -2.23 0.00 0.00 178.31 176.75 2qlf h LYS 99 N 0.27 0.11 0.36 1.11 1.57 -1.40 -2.92 116.57 115.67 2qlf h LYS 99 Ca 0.24 -0.19 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2qlf h LYS 99 Cb 0.59 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.94 2qlf h LYS 99 CO -0.05 1.09 -0.46 0.00 -0.57 0.00 0.00 179.45 179.45 2qlf h PHE 101 N -0.86 0.00 0.13 0.00 -1.00 -1.41 -0.37 116.94 113.42 2qlf h PHE 101 Ca -0.03 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.74 2qlf h PHE 101 Cb 0.79 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.35 2qlf h PHE 101 CO -0.29 0.05 -0.06 -0.09 -1.61 0.00 0.00 178.31 176.31 2qlf h ARG 102 N 0.00 -0.16 -0.77 1.51 9.65 -1.15 -0.49 114.38 122.97 2qlf h ARG 102 Ca -0.00 0.01 0.16 0.00 -1.10 0.00 0.00 59.98 59.05 2qlf h ARG 102 Cb 0.16 0.04 -0.05 0.00 -1.39 0.00 0.00 29.97 28.73 2qlf h ARG 102 CO 0.01 0.31 0.52 0.77 2.80 0.00 0.00 179.97 184.37 2qlf h SER 103 N -0.78 0.35 0.39 -3.80 0.02 0.45 0.27 113.55 110.46 2qlf h SER 103 Ca -0.02 0.02 -0.09 0.00 -0.84 0.00 0.00 61.79 60.87 2qlf h SER 103 Cb 0.55 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.03 2qlf h SER 103 CO 0.03 0.18 -0.40 -0.07 -1.14 0.00 0.00 176.83 175.42 2qlf h LEU 104 N 0.37 0.01 0.00 5.07 3.38 -1.05 -3.47 115.31 119.63 2qlf h LEU 104 Ca 0.38 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.34 2qlf h LEU 104 Cb 0.94 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2qlf h LEU 104 CO -0.12 0.42 0.00 0.61 0.09 0.00 0.00 178.44 179.44 2qlf n GLY 105 N -0.36 1.02 3.75 0.83 0.00 0.94 -5.04 105.19 106.34 2qlf n GLY 105 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 2qlf n GLY 105 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qlf s PHE 106 N -1.75 3.96 -0.95 1.61 0.08 -0.21 -4.22 117.98 116.51 2qlf s PHE 106 Ca 0.00 1.89 -0.18 0.00 0.12 0.00 0.00 56.93 58.76 2qlf s PHE 106 Cb 0.00 -2.96 0.13 0.00 -0.57 0.00 0.00 43.02 39.62 2qlf s PHE 106 CO 0.00 0.44 1.15 -0.51 -0.10 0.00 0.00 175.22 176.21 2qlf s ASP 107 N -1.22 6.67 0.24 1.36 1.01 -0.33 -4.37 116.67 120.02 2qlf s ASP 107 Ca 0.41 -2.13 -0.12 0.00 0.71 0.00 0.00 52.55 51.42 2qlf s ASP 107 Cb -0.25 -2.40 -0.08 0.00 1.01 0.00 0.00 42.92 41.20 2qlf s ASP 107 CO 0.31 -1.03 0.60 0.54 0.21 0.00 0.00 175.17 175.80 2qlf s VAL 108 N 2.58 4.84 -0.02 -1.27 0.11 -1.26 -2.37 120.40 123.01 2qlf s VAL 108 Ca 0.34 0.69 -0.01 0.00 -2.93 0.00 0.00 61.98 60.06 2qlf s VAL 108 Cb -0.05 -3.65 0.01 0.00 -1.53 0.00 0.00 36.38 31.16 2qlf s VAL 108 CO -0.09 -0.03 0.04 -0.63 -3.33 0.00 0.00 175.10 171.06 2qlf s ILE 109 N -1.78 -0.01 0.02 7.04 1.01 -0.62 -4.95 121.20 121.92 2qlf s ILE 109 Ca 0.47 0.02 0.03 0.00 0.00 0.00 0.00 60.65 61.17 2qlf s ILE 109 Cb -0.12 -0.07 -0.04 0.00 0.01 0.00 0.00 42.46 42.25 2qlf s ILE 109 CO 0.20 0.01 -0.02 -0.69 0.00 0.00 0.00 174.94 174.44 2qlf s VAL 110 N 0.14 3.98 -0.06 2.92 1.01 -1.26 -1.45 120.40 125.68 2qlf s VAL 110 Ca -0.01 -0.74 0.02 0.00 0.00 0.00 0.00 61.98 61.25 2qlf s VAL 110 Cb -0.02 -2.79 0.02 0.00 0.00 0.00 0.00 36.38 33.59 2qlf s VAL 110 CO -0.00 0.32 -0.10 -0.31 0.00 0.00 0.00 175.10 175.01 2qlf s TYR 111 N -1.11 1.24 0.00 5.22 2.02 -0.42 -4.97 117.35 119.33 2qlf s TYR 111 Ca 0.20 -0.43 0.02 0.00 -0.37 0.00 0.00 57.07 56.49 2qlf s TYR 111 Cb -0.11 -0.94 -0.04 0.00 -0.40 0.00 0.00 41.96 40.47 2qlf s TYR 111 CO 0.11 -0.24 -0.01 -0.80 -1.57 0.00 0.00 175.55 173.04 2qlf s ASN 112 N 0.70 5.07 -1.01 2.29 0.01 -1.26 -0.44 114.94 120.30 2qlf s ASN 112 Ca -0.13 -0.03 -0.16 0.00 -0.71 0.00 0.00 52.86 51.82 2qlf s ASN 112 Cb -0.15 -1.30 0.02 0.00 0.41 0.00 0.00 41.25 40.23 2qlf s ASN 112 CO 0.03 0.27 0.64 0.47 -1.51 0.00 0.00 177.10 177.00 2qlf n ASP 113 N 1.36 -4.52 -4.84 -1.22 8.00 -0.80 -4.90 116.55 109.63 2qlf n ASP 113 Ca -0.14 -1.13 -0.33 0.00 0.71 0.00 0.00 54.79 53.90 2qlf n ASP 113 Cb 0.53 -1.66 -0.06 0.00 -0.02 0.00 0.00 41.12 39.90 2qlf n ASP 113 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2qlf s SER 115 N -2.16 5.77 0.29 0.00 1.04 -1.26 -1.07 113.70 116.30 2qlf s SER 115 Ca 0.52 1.07 -0.01 0.00 0.48 0.00 0.00 55.95 58.02 2qlf s SER 115 Cb -0.11 -2.04 0.47 0.00 0.10 0.00 0.00 66.02 64.43 2qlf s SER 115 CO 0.18 -1.07 1.91 0.00 0.98 0.00 0.00 173.24 175.24 2qlf h ALA 117 N 1.48 0.11 -0.59 0.00 0.00 -1.99 -1.33 119.26 116.94 2qlf h ALA 117 Ca 0.40 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.39 2qlf h ALA 117 Cb 0.15 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.82 2qlf h ALA 117 CO -0.15 -0.37 0.07 -0.22 0.00 0.00 0.00 179.25 178.59 2qlf h LYS 118 N 0.06 0.19 -0.19 0.00 1.63 -1.61 0.33 116.57 116.98 2qlf h LYS 118 Ca 0.03 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.77 2qlf h LYS 118 Cb 0.05 -0.04 -0.01 0.00 -0.60 0.00 0.00 32.23 31.63 2qlf h LYS 118 CO -0.01 0.13 -0.12 0.52 -3.45 0.00 0.00 179.45 176.52 2qlf h MET 119 N 0.20 0.30 0.06 1.90 2.86 -0.88 0.16 114.93 119.52 2qlf h MET 119 Ca 0.31 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.87 2qlf h MET 119 Cb 0.47 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.09 2qlf h MET 119 CO -0.44 0.43 -0.03 1.96 1.06 0.00 0.00 176.91 179.89 2qlf h GLN 120 N 0.28 -0.07 -0.36 1.72 1.08 0.22 -2.68 115.11 115.30 2qlf h GLN 120 Ca 0.06 0.00 0.03 0.00 -1.45 0.00 0.00 58.65 57.29 2qlf h GLN 120 Cb 0.39 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.81 2qlf h GLN 120 CO 0.02 0.51 0.17 0.22 -0.95 0.00 0.00 178.83 178.80 2qlf h ASP 121 N -0.73 0.24 -0.38 1.46 3.58 -0.29 0.28 116.42 120.57 2qlf h ASP 121 Ca -0.01 0.02 0.07 0.00 0.42 0.00 0.00 57.03 57.54 2qlf h ASP 121 Cb 0.61 -0.02 -0.07 0.00 1.72 0.00 0.00 39.33 41.57 2qlf h ASP 121 CO 0.01 0.18 -0.04 -0.07 -2.88 0.00 0.00 179.24 176.44 2qlf h LEU 122 N 0.35 -0.25 -0.47 2.28 4.07 -0.75 0.35 115.31 120.89 2qlf h LEU 122 Ca 0.16 0.10 -0.14 0.00 0.08 0.00 0.00 57.88 58.07 2qlf h LEU 122 Cb 0.08 0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 2qlf h LEU 122 CO -0.12 -0.08 -0.68 -0.07 -1.08 0.00 0.00 178.44 176.41 2qlf h LEU 123 N 0.05 0.00 0.71 1.67 4.07 -1.15 -1.80 115.31 118.86 2qlf h LEU 123 Ca 0.19 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 58.11 2qlf h LEU 123 Cb 0.27 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.02 2qlf h LEU 123 CO -0.35 0.68 -0.34 0.50 -1.08 0.00 0.00 178.44 177.85 2qlf h LYS 124 N 0.00 -0.92 -0.60 1.13 3.64 0.26 -2.34 116.57 117.74 2qlf h LYS 124 Ca -0.01 0.06 0.12 0.00 -1.27 0.00 0.00 60.65 59.55 2qlf h LYS 124 Cb 1.31 0.21 -0.09 0.00 -0.41 0.00 0.00 32.23 33.24 2qlf h LYS 124 CO 0.09 -0.61 0.08 0.87 -2.27 0.00 0.00 179.45 177.61 2qlf h LYS 125 N -1.25 0.19 -0.54 1.90 1.79 -0.37 -0.82 116.57 117.47 2qlf h LYS 125 Ca -0.10 -0.01 0.08 0.00 -2.18 0.00 0.00 60.65 58.44 2qlf h LYS 125 Cb 0.73 -0.04 -0.06 0.00 -1.58 0.00 0.00 32.23 31.28 2qlf h LYS 125 CO 0.16 0.13 0.19 0.00 -1.08 0.00 0.00 179.45 178.85 2qlf h ALA 126 N 1.51 0.68 -0.09 3.86 0.00 -1.34 0.56 119.26 124.43 2qlf h ALA 126 Ca 0.31 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.28 2qlf h ALA 126 Cb 0.49 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 2qlf h ALA 126 CO -0.45 -0.21 -0.00 0.66 0.00 0.00 0.00 179.25 179.25 2qlf h SER 127 N 0.37 0.12 -0.02 0.00 4.64 -0.61 -0.63 113.55 117.42 2qlf h SER 127 Ca 0.27 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 2qlf h SER 127 Cb 0.30 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2qlf h SER 127 CO -0.27 0.15 0.00 -0.62 -0.87 0.00 0.00 176.83 175.21 2qlf n GLU 128 N -4.45 1.27 -1.86 4.77 1.02 0.11 -4.74 120.64 116.76 2qlf n GLU 128 Ca -0.02 -0.40 -0.30 0.00 -0.02 0.00 0.00 57.16 56.42 2qlf n GLU 128 Cb 0.14 -1.45 0.05 0.00 -0.02 0.00 0.00 31.44 30.16 2qlf n GLU 128 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2qlf s GLU 129 N -1.98 2.75 -0.48 3.49 2.02 -0.25 -5.01 118.70 119.24 2qlf s GLU 129 Ca 0.40 0.45 -0.19 0.00 0.02 0.00 0.00 54.97 55.65 2qlf s GLU 129 Cb 0.20 -2.01 0.05 0.00 0.10 0.00 0.00 34.13 32.47 2qlf s GLU 129 CO 0.33 -1.11 0.59 0.34 0.02 0.00 0.00 175.26 175.42 2qlf s ASP 130 N -4.34 6.23 -0.25 -0.19 -1.08 -1.26 -4.90 116.67 110.88 2qlf s ASP 130 Ca 0.59 -0.78 0.10 0.00 -0.52 0.00 0.00 52.55 51.93 2qlf s ASP 130 Cb -0.11 -2.28 0.68 0.00 -1.46 0.00 0.00 42.92 39.74 2qlf s ASP 130 CO 0.52 -0.81 1.64 1.41 0.52 0.00 0.00 175.17 178.44 2qlf n HIS 131 N 6.07 2.03 -0.23 -5.34 8.25 -1.26 -4.54 115.22 120.19 2qlf n HIS 131 Ca -0.06 -0.90 0.09 0.00 -0.26 0.00 0.00 57.72 56.59 2qlf n HIS 131 Cb 0.46 -0.56 0.36 0.00 1.12 0.00 0.00 29.99 31.37 2qlf n HIS 131 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 2qlf h THR 132 N 2.77 0.93 -0.58 1.59 2.02 -1.91 -1.77 112.91 115.97 2qlf h THR 132 Ca 0.15 -0.25 -0.08 0.00 0.77 0.00 0.00 66.41 66.99 2qlf h THR 132 Cb 2.01 0.14 -0.05 0.00 -1.74 0.00 0.00 68.15 68.50 2qlf h THR 132 CO 0.57 0.13 0.09 0.59 0.37 0.00 0.00 175.52 177.28 2qlf n ASN 133 N -4.51 5.07 -4.60 4.18 3.02 -1.26 -4.93 115.26 112.22 2qlf n ASN 133 Ca 0.14 -3.08 -0.31 0.00 -0.03 0.00 0.00 54.58 51.30 2qlf n ASN 133 Cb 0.35 -0.69 -0.10 0.00 -0.61 0.00 0.00 39.78 38.73 2qlf n ASN 133 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2qlf s ALA 134 N -2.88 3.03 -0.03 5.41 0.00 -0.67 -1.55 121.76 125.07 2qlf s ALA 134 Ca 0.53 -1.12 -0.20 0.00 0.00 0.00 0.00 51.96 51.17 2qlf s ALA 134 Cb 0.42 -1.04 -0.32 0.00 0.00 0.00 0.00 23.12 22.17 2qlf s ALA 134 CO 0.14 0.64 0.89 0.00 0.00 0.00 0.00 175.76 177.42 2qlf h ALA 135 N 4.00 -0.09 -2.51 0.00 0.00 -0.53 -3.48 119.26 116.65 2qlf h ALA 135 Ca -0.48 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 53.65 2qlf h ALA 135 Cb 1.17 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.11 2qlf h ALA 135 CO 0.54 0.50 0.00 0.00 0.00 0.00 0.00 179.25 180.29 2qlf s PHE 137 N -5.53 0.18 0.01 0.00 5.36 -0.84 -3.98 117.98 113.19 2qlf s PHE 137 Ca 0.00 -0.39 0.00 0.00 -0.96 0.00 0.00 56.93 55.58 2qlf s PHE 137 Cb 0.00 -0.14 -0.01 0.00 -0.34 0.00 0.00 43.02 42.53 2qlf s PHE 137 CO 0.00 -0.21 -0.02 0.00 -1.46 0.00 0.00 175.22 173.53 2qlf s ALA 138 N -1.37 0.10 -0.11 11.12 0.00 -0.02 -0.98 121.76 130.50 2qlf s ALA 138 Ca -0.15 -0.42 -0.05 0.00 0.00 0.00 0.00 51.96 51.34 2qlf s ALA 138 Cb -0.09 0.10 0.05 0.00 0.00 0.00 0.00 23.12 23.18 2qlf s ALA 138 CO -0.00 -0.11 0.25 0.00 0.00 0.00 0.00 175.76 175.90 2qlf s ILE 140 N 1.41 2.36 -0.19 0.00 1.01 0.18 -1.02 121.20 124.94 2qlf s ILE 140 Ca -0.08 -0.87 -0.02 0.00 0.00 0.00 0.00 60.65 59.68 2qlf s ILE 140 Cb -0.11 -1.97 -0.01 0.00 0.01 0.00 0.00 42.46 40.38 2qlf s ILE 140 CO -0.09 0.53 -0.09 -0.76 0.00 0.00 0.00 174.94 174.54 2qlf s LEU 141 N 0.86 2.76 -0.19 2.97 1.43 -0.45 0.32 118.68 126.39 2qlf s LEU 141 Ca -0.05 -0.39 0.01 0.00 -1.03 0.00 0.00 54.13 52.66 2qlf s LEU 141 Cb -0.15 -1.67 0.04 0.00 0.03 0.00 0.00 46.19 44.43 2qlf s LEU 141 CO -0.02 0.04 -0.13 -0.76 0.23 0.00 0.00 176.35 175.71 2qlf s LEU 142 N 1.09 2.26 0.00 1.79 1.43 -0.24 -1.64 118.68 123.37 2qlf s LEU 142 Ca 0.01 -0.81 -0.07 0.00 -1.03 0.00 0.00 54.13 52.23 2qlf s LEU 142 Cb -0.15 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 44.79 2qlf s LEU 142 CO -0.02 -0.10 0.30 -0.24 0.23 0.00 0.00 176.35 176.52 2qlf n SER 143 N 4.66 -0.27 -4.85 2.29 2.88 -1.06 -1.55 113.62 115.72 2qlf n SER 143 Ca -0.16 -1.05 -0.32 0.00 -1.33 0.00 0.00 58.87 56.00 2qlf n SER 143 Cb 0.47 0.42 -0.06 0.00 -0.75 0.00 0.00 64.21 64.30 2qlf n SER 143 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 2qlf s HIS 144 N -2.77 3.38 0.19 0.66 3.76 -1.26 -4.24 115.29 115.02 2qlf s HIS 144 Ca 0.07 1.28 -0.23 0.00 -0.15 0.00 0.00 55.06 56.03 2qlf s HIS 144 Cb -0.00 -2.59 0.05 0.00 1.11 0.00 0.00 32.58 31.14 2qlf s HIS 144 CO -0.00 -0.01 0.73 0.20 -0.85 0.00 0.00 174.74 174.80 2qlf s GLY 145 N -2.47 -0.33 0.36 -2.22 0.00 -1.26 0.50 107.32 101.90 2qlf s GLY 145 Ca 0.55 0.15 0.06 0.00 0.00 0.00 0.00 44.72 45.48 2qlf s GLY 145 CO 0.20 0.05 0.23 -0.54 0.00 0.00 0.00 173.10 173.04 2qlf s GLU 146 N -3.70 1.82 -0.27 2.90 2.02 -0.46 -3.76 118.70 117.26 2qlf s GLU 146 Ca 0.07 -2.08 -0.40 0.00 0.02 0.00 0.00 54.97 52.58 2qlf s GLU 146 Cb -0.03 0.02 -0.16 0.00 0.10 0.00 0.00 34.13 34.05 2qlf s GLU 146 CO -0.02 -0.60 1.72 -1.91 0.02 0.00 0.00 175.26 174.47 2qlf n GLU 147 N -0.72 1.10 -0.95 1.61 4.07 -0.97 -1.18 120.64 123.61 2qlf n GLU 147 Ca 0.03 0.40 0.00 0.00 -0.06 0.00 0.00 57.16 57.53 2qlf n GLU 147 Cb 0.63 -2.08 0.00 0.00 -0.06 0.00 0.00 31.44 29.93 2qlf n GLU 147 CO 0.00 0.00 0.00 0.09 -0.06 0.00 0.00 177.13 177.16 2qlf n ASN 148 N 5.16 -4.13 -3.74 4.31 5.03 -1.26 -4.97 115.26 115.66 2qlf n ASN 148 Ca 0.26 0.00 -0.11 0.00 0.87 0.00 0.00 54.58 55.60 2qlf n ASN 148 Cb 0.12 -2.32 -0.07 0.00 -1.02 0.00 0.00 39.78 36.50 2qlf n ASN 148 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 2qlf s VAL 149 N -1.46 0.09 0.25 2.41 0.11 -0.32 -1.96 120.40 119.52 2qlf s VAL 149 Ca 0.00 -0.73 0.11 0.00 -2.93 0.00 0.00 61.98 58.43 2qlf s VAL 149 Cb 0.00 -1.05 -0.05 0.00 -1.53 0.00 0.00 36.38 33.75 2qlf s VAL 149 CO 0.00 -0.40 -0.19 0.27 -3.33 0.00 0.00 175.10 171.44 2qlf s ILE 150 N -3.01 2.31 0.13 7.04 -4.36 -0.97 -1.35 121.20 120.99 2qlf s ILE 150 Ca -0.02 -2.31 -0.07 0.00 -0.26 0.00 0.00 60.65 57.99 2qlf s ILE 150 Cb 0.01 -2.22 -0.06 0.00 1.25 0.00 0.00 42.46 41.44 2qlf s ILE 150 CO -0.06 -0.39 0.40 -0.31 0.24 0.00 0.00 174.94 174.82 2qlf s TYR 151 N -2.46 3.51 0.34 1.37 1.51 0.18 -1.01 117.35 120.79 2qlf s TYR 151 Ca 0.27 0.68 0.08 0.00 -1.01 0.00 0.00 57.07 57.09 2qlf s TYR 151 Cb -0.05 -2.09 -0.04 0.00 -0.11 0.00 0.00 41.96 39.68 2qlf s TYR 151 CO 0.13 0.45 0.18 0.20 -1.11 0.00 0.00 175.55 175.40 2qlf s GLY 152 N -2.17 1.92 0.65 0.71 0.00 0.46 -4.63 107.32 104.25 2qlf s GLY 152 Ca 0.39 -1.80 0.39 0.00 0.00 0.00 0.00 44.72 43.70 2qlf s GLY 152 CO 0.22 -1.72 2.28 0.07 0.00 0.00 0.00 173.10 173.95 2qlf h LYS 153 N 1.47 0.00 -0.02 2.90 2.10 -1.35 -1.91 116.57 119.75 2qlf h LYS 153 Ca -0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.21 2qlf h LYS 153 Cb 1.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.58 2qlf h LYS 153 CO 0.62 0.00 -0.19 -0.40 -2.00 0.00 0.00 179.45 177.49 2qlf n ASP 154 N -3.29 2.41 0.00 7.07 5.75 -1.26 0.37 116.55 127.60 2qlf n ASP 154 Ca -0.03 -1.71 0.00 0.00 -0.01 0.00 0.00 54.79 53.05 2qlf n ASP 154 Cb 0.12 0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.42 2qlf n ASP 154 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qlf n GLY 155 N 1.27 -0.53 3.30 6.12 0.00 -0.72 -4.86 105.19 109.77 2qlf n GLY 155 Ca 0.11 -0.76 -0.27 0.00 0.00 0.00 0.00 46.02 45.09 2qlf n GLY 155 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qlf s VAL 156 N -3.84 1.89 -0.01 1.61 -7.23 -1.26 0.17 120.40 111.73 2qlf s VAL 156 Ca 0.00 -1.39 0.01 0.00 -1.81 0.00 0.00 61.98 58.79 2qlf s VAL 156 Cb 0.00 -1.65 0.00 0.00 0.56 0.00 0.00 36.38 35.29 2qlf s VAL 156 CO 0.00 0.19 -0.02 0.28 -0.31 0.00 0.00 175.10 175.24 2qlf s THR 157 N -0.90 0.20 0.10 5.32 -1.32 -0.18 -4.92 115.64 113.94 2qlf s THR 157 Ca 0.09 -0.07 -0.32 0.00 -1.21 0.00 0.00 61.69 60.19 2qlf s THR 157 Cb -0.09 -0.20 -0.11 0.00 -1.51 0.00 0.00 72.50 70.59 2qlf s THR 157 CO 0.03 0.08 1.83 -2.65 -2.21 0.00 0.00 174.62 171.69 2qlf n PRO 158 N 3.24 2.68 0.15 7.08 -0.02 -1.26 -2.30 135.00 144.57 2qlf n PRO 158 Ca -0.15 0.98 0.11 0.00 -2.02 0.00 0.00 63.50 62.41 2qlf n PRO 158 Cb 0.57 -2.86 0.63 0.00 -0.02 0.00 0.00 33.50 31.82 2qlf n PRO 158 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2qlf h ILE 159 N 4.71 0.93 -0.16 4.25 2.04 -1.74 -2.03 117.51 125.51 2qlf h ILE 159 Ca -0.47 -0.02 0.03 0.00 1.00 0.00 0.00 64.86 65.40 2qlf h ILE 159 Cb 1.23 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 38.14 2qlf h ILE 159 CO 0.94 0.01 -0.04 0.50 0.00 0.00 0.00 178.15 179.57 2qlf h LYS 160 N 0.07 0.00 -0.83 2.37 3.11 -1.90 -1.70 116.57 117.69 2qlf h LYS 160 Ca 0.10 -0.00 0.05 0.00 -2.81 0.00 0.00 60.65 57.99 2qlf h LYS 160 Cb 0.31 -0.00 -0.06 0.00 -1.00 0.00 0.00 32.23 31.48 2qlf h LYS 160 CO -0.01 0.00 0.51 -0.44 -2.81 0.00 0.00 179.45 176.71 2qlf h ASP 161 N 0.00 0.82 -0.31 4.20 3.32 -1.75 0.54 116.42 123.23 2qlf h ASP 161 Ca 0.08 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 2qlf h ASP 161 Cb 0.12 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2qlf h ASP 161 CO -0.16 0.54 0.19 -0.07 -1.72 0.00 0.00 179.24 178.01 2qlf h LEU 162 N 0.96 0.37 0.06 1.55 4.07 -1.38 -3.26 115.31 117.68 2qlf h LEU 162 Ca 0.35 -0.05 -0.25 0.00 0.08 0.00 0.00 57.88 58.01 2qlf h LEU 162 Cb 0.12 -0.09 -0.02 0.00 1.08 0.00 0.00 40.66 41.75 2qlf h LEU 162 CO -0.16 0.31 -1.22 0.71 -1.08 0.00 0.00 178.44 177.00 2qlf h THR 163 N 0.40 1.48 -1.00 0.22 1.35 -0.84 -3.34 112.91 111.18 2qlf h THR 163 Ca 0.11 -3.15 0.27 0.00 -0.55 0.00 0.00 66.41 63.09 2qlf h THR 163 Cb 0.00 2.83 -0.06 0.00 -1.73 0.00 0.00 68.15 69.19 2qlf h THR 163 CO -0.02 0.88 0.68 0.00 -0.25 0.00 0.00 175.52 176.81 2qlf h ALA 164 N 0.78 2.57 -0.06 6.62 0.00 0.03 -0.88 119.26 128.33 2qlf h ALA 164 Ca -0.11 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.82 2qlf h ALA 164 Cb 1.90 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.72 2qlf h ALA 164 CO 0.15 -0.89 0.42 0.45 0.00 0.00 0.00 179.25 179.39 2qlf h HIS 165 N 0.21 0.00 -0.57 0.00 3.86 -1.69 -1.05 115.15 115.91 2qlf h HIS 165 Ca 0.51 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.72 2qlf h HIS 165 Cb 1.63 0.00 0.00 0.00 1.06 0.00 0.00 27.41 30.10 2qlf h HIS 165 CO -0.00 0.00 0.00 1.19 0.86 0.00 0.00 177.93 179.98 2qlf n PHE 166 N -2.94 1.10 -1.48 2.45 3.01 -0.33 -4.31 117.46 114.96 2qlf n PHE 166 Ca -0.00 -0.59 -0.35 0.00 1.01 0.00 0.00 57.45 57.52 2qlf n PHE 166 Cb 0.48 -0.15 0.09 0.00 -0.01 0.00 0.00 39.48 39.90 2qlf n PHE 166 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 2qlf s ARG 167 N -1.56 2.18 0.41 -1.08 0.52 -0.40 -4.69 118.95 114.33 2qlf s ARG 167 Ca 0.44 1.84 0.19 0.00 -0.52 0.00 0.00 55.73 57.68 2qlf s ARG 167 Cb 0.27 -1.83 1.11 0.00 0.52 0.00 0.00 34.95 35.02 2qlf s ARG 167 CO 0.23 -1.83 1.80 0.78 0.02 0.00 0.00 175.30 176.31 2qlf h GLY 168 N -0.14 1.05 -1.50 -3.53 0.00 -1.91 0.34 103.07 97.37 2qlf h GLY 168 Ca -0.48 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.65 2qlf h GLY 168 CO 0.50 -0.08 0.00 2.09 0.00 0.00 0.00 176.54 179.05 2qlf n ASP 169 N -4.57 2.19 -0.07 0.19 5.75 -1.26 -3.79 116.55 115.00 2qlf n ASP 169 Ca 0.23 -2.08 0.00 0.00 -0.01 0.00 0.00 54.79 52.94 2qlf n ASP 169 Cb 0.83 -0.30 0.01 0.00 -1.03 0.00 0.00 41.12 40.62 2qlf n ASP 169 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2qlf n ARG 170 N 0.53 0.70 -2.74 0.11 1.74 0.12 -4.93 116.66 112.18 2qlf n ARG 170 Ca 0.13 -0.88 -0.01 0.00 -0.77 0.00 0.00 57.85 56.32 2qlf n ARG 170 Cb 0.38 -0.65 0.02 0.00 -1.02 0.00 0.00 32.46 31.18 2qlf n ARG 170 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2qlf h LYS 172 N 4.95 0.59 0.00 0.00 1.79 -1.85 -2.85 116.57 119.19 2qlf h LYS 172 Ca -0.02 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.40 2qlf h LYS 172 Cb 1.20 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.73 2qlf h LYS 172 CO -0.08 0.43 0.02 0.25 -1.08 0.00 0.00 179.45 178.98 2qlf n THR 173 N -4.75 1.86 -0.09 -0.16 -2.24 -1.26 -0.56 114.28 107.08 2qlf n THR 173 Ca 0.01 0.48 0.03 0.00 -2.27 0.00 0.00 64.05 62.30 2qlf n THR 173 Cb 0.05 -1.48 0.08 0.00 -2.10 0.00 0.00 70.33 66.88 2qlf n THR 173 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2qlf n LEU 174 N -1.46 2.50 -4.70 3.22 4.77 -1.08 -4.24 117.00 116.01 2qlf n LEU 174 Ca 0.00 -1.98 -0.42 0.00 -0.03 0.00 0.00 56.01 53.58 2qlf n LEU 174 Cb 0.02 -0.13 -0.03 0.00 -2.33 0.00 0.00 43.42 40.95 2qlf n LEU 174 CO 0.00 0.62 1.14 -0.22 -1.33 0.00 0.00 177.39 177.61 2qlf s LEU 175 N -0.99 4.35 -0.14 2.23 2.96 0.28 -2.10 118.68 125.26 2qlf s LEU 175 Ca 0.13 2.30 0.00 0.00 -0.22 0.00 0.00 54.13 56.34 2qlf s LEU 175 Cb 0.07 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.18 2qlf s LEU 175 CO 0.09 -0.73 0.00 -0.62 -1.32 0.00 0.00 176.35 173.77 2qlf n GLU 176 N 4.76 -0.56 -5.12 1.98 1.02 -1.26 -5.01 120.64 116.44 2qlf n GLU 176 Ca 0.13 0.27 -0.32 0.00 -0.02 0.00 0.00 57.16 57.22 2qlf n GLU 176 Cb 0.42 -3.79 -0.15 0.00 -0.02 0.00 0.00 31.44 27.90 2qlf n GLU 176 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 2qlf s LYS 177 N -1.02 2.61 0.24 3.49 1.02 -0.89 -4.92 119.74 120.28 2qlf s LYS 177 Ca 0.00 -0.83 -0.31 0.00 0.02 0.00 0.00 55.97 54.84 2qlf s LYS 177 Cb 0.00 -2.26 -0.13 0.00 -0.52 0.00 0.00 37.83 34.92 2qlf s LYS 177 CO 0.00 0.43 1.51 -0.35 -0.92 0.00 0.00 175.35 176.02 2qlf n PRO 178 N 2.84 2.31 -3.94 -1.68 -0.04 -1.26 -4.87 135.00 128.35 2qlf n PRO 178 Ca -0.17 0.82 -0.34 0.00 -0.04 0.00 0.00 63.50 63.77 2qlf n PRO 178 Cb 0.52 -2.55 -0.14 0.00 -0.04 0.00 0.00 33.50 31.30 2qlf n PRO 178 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2qlf s LYS 179 N -0.15 2.05 -0.20 0.54 1.02 -1.26 -1.99 119.74 119.75 2qlf s LYS 179 Ca 0.69 -1.57 -0.09 0.00 0.02 0.00 0.00 55.97 55.02 2qlf s LYS 179 Cb -0.60 -3.23 -0.05 0.00 -0.52 0.00 0.00 37.83 33.44 2qlf s LYS 179 CO 0.46 -0.80 0.11 -0.51 -0.92 0.00 0.00 175.35 173.69 2qlf s LEU 180 N 1.11 4.03 -0.16 3.17 1.43 -0.15 -5.01 118.68 123.10 2qlf s LEU 180 Ca 0.01 0.15 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 2qlf s LEU 180 Cb -0.20 -2.04 0.03 0.00 0.03 0.00 0.00 46.19 44.01 2qlf s LEU 180 CO -0.04 0.16 -0.12 -0.36 0.23 0.00 0.00 176.35 176.22 2qlf s PHE 181 N 0.45 2.17 -0.24 0.29 0.40 -1.26 -0.05 117.98 119.75 2qlf s PHE 181 Ca 0.06 -1.29 -0.06 0.00 -0.60 0.00 0.00 56.93 55.04 2qlf s PHE 181 Cb -0.12 -1.57 -0.02 0.00 0.51 0.00 0.00 43.02 41.81 2qlf s PHE 181 CO -0.00 -0.68 0.04 -0.06 0.70 0.00 0.00 175.22 175.22 2qlf s PHE 182 N 1.48 3.06 -0.27 0.36 0.40 -0.19 -5.00 117.98 117.83 2qlf s PHE 182 Ca 0.03 -0.50 0.02 0.00 -0.60 0.00 0.00 56.93 55.89 2qlf s PHE 182 Cb -0.14 -2.19 0.07 0.00 0.51 0.00 0.00 43.02 41.27 2qlf s PHE 182 CO -0.10 -0.36 -0.05 0.42 0.70 0.00 0.00 175.22 175.84 2qlf s ILE 183 N 1.48 1.90 -0.44 0.64 1.01 -1.26 -1.34 121.20 123.18 2qlf s ILE 183 Ca 0.06 -1.63 -0.15 0.00 0.00 0.00 0.00 60.65 58.92 2qlf s ILE 183 Cb -0.15 -2.16 0.05 0.00 0.01 0.00 0.00 42.46 40.20 2qlf s ILE 183 CO 0.02 -0.21 0.36 -1.58 0.00 0.00 0.00 174.94 173.54 2qlf s GLN 184 N 1.19 2.98 -0.26 2.79 2.00 -0.65 -4.99 119.66 122.72 2qlf s GLN 184 Ca -0.03 -1.16 -0.38 0.00 -2.00 0.00 0.00 55.36 51.80 2qlf s GLN 184 Cb -0.19 -4.05 0.16 0.00 0.80 0.00 0.00 33.01 29.72 2qlf s GLN 184 CO -0.07 -0.90 1.39 0.00 -0.50 0.00 0.00 175.29 175.21 2qlf s ALA 185 N 1.71 -2.24 0.87 1.58 0.00 -1.26 -2.57 121.76 119.85 2qlf s ALA 185 Ca 0.05 1.79 -0.11 0.00 0.00 0.00 0.00 51.96 53.69 2qlf s ALA 185 Cb -0.21 -0.32 0.11 0.00 0.00 0.00 0.00 23.12 22.70 2qlf s ALA 185 CO 0.09 -0.61 1.09 0.00 0.00 0.00 0.00 175.76 176.33 2qlf n ARG 187 N -3.78 0.35 -2.31 0.00 1.74 -1.26 -2.88 116.66 108.51 2qlf n ARG 187 Ca 0.07 -0.70 0.00 0.00 -0.77 0.00 0.00 57.85 56.45 2qlf n ARG 187 Cb 0.55 -0.57 0.00 0.00 -1.02 0.00 0.00 32.46 31.42 2qlf n ARG 187 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2qlf n GLY 188 N -0.08 -0.54 0.11 -0.13 0.00 -1.26 -2.29 105.19 100.99 2qlf n GLY 188 Ca 0.00 -0.83 0.03 0.00 0.00 0.00 0.00 46.02 45.21 2qlf n GLY 188 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2qlf n THR 189 N 6.31 0.81 -2.54 2.61 -2.24 -1.26 -4.93 114.28 113.04 2qlf n THR 189 Ca 0.00 -0.91 -0.32 0.00 -2.27 0.00 0.00 64.05 60.55 2qlf n THR 189 Cb 0.00 0.43 -0.04 0.00 -2.10 0.00 0.00 70.33 68.62 2qlf n THR 189 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2qlf s GLU 190 N -1.06 4.01 0.10 -0.78 2.02 -1.26 -5.09 118.70 116.65 2qlf s GLU 190 Ca 0.08 0.96 0.10 0.00 0.02 0.00 0.00 54.97 56.13 2qlf s GLU 190 Cb 0.07 -2.17 -0.04 0.00 0.10 0.00 0.00 34.13 32.10 2qlf s GLU 190 CO 0.01 -0.19 -0.25 -0.51 0.02 0.00 0.00 175.26 174.34 2qlf s LEU 191 N -3.82 2.28 -0.35 1.80 1.43 -1.26 -5.10 118.68 113.66 2qlf s LEU 191 Ca 0.59 -0.69 -0.09 0.00 -1.03 0.00 0.00 54.13 52.91 2qlf s LEU 191 Cb -0.10 -1.13 0.03 0.00 0.03 0.00 0.00 46.19 45.02 2qlf s LEU 191 CO 0.26 0.16 0.16 -0.62 0.23 0.00 0.00 176.35 176.55 2qlf s ASP 192 N -1.83 5.54 0.00 2.29 -1.08 -1.26 -4.97 116.67 115.36 2qlf s ASP 192 Ca 0.11 -1.01 0.32 0.00 -0.52 0.00 0.00 52.55 51.45 2qlf s ASP 192 Cb -0.10 -1.96 1.83 0.00 -1.46 0.00 0.00 42.92 41.23 2qlf s ASP 192 CO 0.05 -0.34 2.19 0.47 0.52 0.00 0.00 175.17 178.05 2qlf n ASP 193 N 4.92 0.12 -1.18 -0.34 9.92 -1.26 -5.03 116.55 123.70 2qlf n ASP 193 Ca -0.12 -1.01 0.14 0.00 -0.53 0.00 0.00 54.79 53.26 2qlf n ASP 193 Cb 0.46 -0.01 -0.04 0.00 -0.64 0.00 0.00 41.12 40.89 2qlf n ASP 193 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2qlf n GLY 194 N 1.02 -1.81 3.39 0.44 0.00 -1.26 -5.01 105.19 101.97 2qlf n GLY 194 Ca 0.23 -1.18 -0.15 0.00 0.00 0.00 0.00 46.02 44.92 2qlf n GLY 194 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qlf s ILE 195 N -1.70 0.03 0.00 -0.61 1.10 -1.26 -5.31 121.20 113.44 2qlf s ILE 195 Ca 0.00 -0.24 0.00 0.00 -0.51 0.00 0.00 60.65 59.90 2qlf s ILE 195 Cb 0.00 -0.92 0.00 0.00 0.15 0.00 0.00 42.46 41.69 2qlf s ILE 195 CO 0.00 -0.13 0.00 0.00 -2.11 0.00 0.00 174.94 172.70