#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qbj n LEU 9 N 0.00 0.00 0.00 4.03 7.94 -1.26 -0.48 117.00 127.23 2qbj n LEU 9 Ca 0.00 0.00 0.01 0.00 -1.11 0.00 0.00 56.01 54.91 2qbj n LEU 9 Cb 0.00 0.00 0.04 0.00 0.53 0.00 0.00 43.42 43.99 2qbj n LEU 9 CO 0.00 0.00 0.45 0.29 -1.11 0.00 0.00 177.39 177.02 2qbj n LYS 10 N 0.00 0.02 -0.23 1.96 5.02 -1.26 -2.02 118.16 121.64 2qbj n LYS 10 Ca 0.00 0.31 -0.07 0.00 -2.02 0.00 0.00 58.31 56.54 2qbj n LYS 10 Cb 0.00 -1.50 0.04 0.00 -0.02 0.00 0.00 35.03 33.55 2qbj n LYS 10 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qbj h ALA 11 N 2.07 0.84 0.00 7.82 0.00 -1.28 -2.13 119.26 126.58 2qbj h ALA 11 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2qbj h ALA 11 Cb 0.02 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2qbj h ALA 11 CO 0.00 0.40 0.00 0.41 0.00 0.00 0.00 179.25 180.06 2qbj n GLY 12 N -0.95 1.47 2.42 0.00 0.00 -0.86 -3.68 105.19 103.58 2qbj n GLY 12 Ca 0.05 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 2qbj n GLY 12 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qbj n VAL 13 N 0.47 2.01 0.00 1.61 0.31 -0.80 -4.81 118.33 117.12 2qbj n VAL 13 Ca 0.00 -4.06 0.00 0.00 -0.01 0.00 0.00 64.34 60.27 2qbj n VAL 13 Cb 0.34 -0.48 0.00 0.00 -0.91 0.00 0.00 33.84 32.79 2qbj n VAL 13 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2qbj n HIS 14 N -0.50 0.00 0.00 3.52 -0.00 -1.24 -4.24 115.22 112.76 2qbj n HIS 14 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 58.02 2qbj n HIS 14 Cb 0.81 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.80 2qbj n HIS 14 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.34 178.31 2qbj n PHE 15 N -0.34 0.00 0.00 -1.40 1.16 -1.26 -4.71 117.46 110.91 2qbj n PHE 15 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.58 2qbj n PHE 15 Cb 0.00 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 37.87 2qbj n PHE 15 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2qbj n GLY 16 N 0.00 -1.93 0.00 4.97 0.00 -1.26 -3.67 105.19 103.30 2qbj n GLY 16 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.67 2qbj n GLY 16 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2qbj n HIS 17 N -0.39 0.00 -2.06 1.61 -0.00 -1.23 -4.64 115.22 108.51 2qbj n HIS 17 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2qbj n HIS 17 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2qbj n HIS 17 CO 0.00 0.00 0.00 1.04 0.46 0.00 0.00 176.34 177.84 2qbj n GLN 18 N -0.09 -5.69 0.00 1.57 3.00 -1.26 -4.32 117.38 110.59 2qbj n GLN 18 Ca 0.00 4.05 0.00 0.00 -0.01 0.00 0.00 57.00 61.04 2qbj n GLN 18 Cb 0.00 -4.40 0.00 0.00 0.00 0.00 0.00 30.24 25.84 2qbj n GLN 18 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 2qbj n THR 19 N 1.43 0.00 -1.93 5.09 5.66 -1.26 -3.64 114.28 119.63 2qbj n THR 19 Ca 0.00 0.31 0.02 0.00 -3.05 0.00 0.00 64.05 61.34 2qbj n THR 19 Cb 0.00 -1.12 0.03 0.00 -1.55 0.00 0.00 70.33 67.68 2qbj n THR 19 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2qbj n ARG 20 N 0.00 0.22 0.09 1.09 5.12 -1.25 -3.07 116.66 118.86 2qbj n ARG 20 Ca 0.00 -1.41 -0.20 0.00 -1.93 0.00 0.00 57.85 54.31 2qbj n ARG 20 Cb 0.00 -0.60 -0.15 0.00 -1.16 0.00 0.00 32.46 30.55 2qbj n ARG 20 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 2qbj h TYR 21 N 0.16 0.65 0.00 -1.55 0.05 -1.95 -3.48 116.97 110.85 2qbj h TYR 21 Ca -0.03 -0.47 0.00 0.00 0.05 0.00 0.00 58.73 58.28 2qbj h TYR 21 Cb 1.40 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 39.12 2qbj h TYR 21 CO 0.11 1.48 0.00 -2.67 -1.05 0.00 0.00 178.16 176.03 2qbj n TRP 22 N -3.56 0.00 -3.28 4.88 4.27 -1.26 -4.86 117.44 113.62 2qbj n TRP 22 Ca -0.17 0.00 0.03 0.00 -3.89 0.00 0.00 57.50 53.47 2qbj n TRP 22 Cb 1.06 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.98 2qbj n TRP 22 CO 0.00 0.00 0.00 1.21 -2.29 0.00 0.00 177.69 176.61 2qbj s ASN 23 N -0.70 -0.38 0.43 -0.67 3.04 -0.73 -4.11 114.94 111.82 2qbj s ASN 23 Ca 0.00 0.46 0.08 0.00 0.04 0.00 0.00 52.86 53.45 2qbj s ASN 23 Cb 0.00 1.41 0.46 0.00 -1.54 0.00 0.00 41.25 41.58 2qbj s ASN 23 CO 0.00 -0.07 1.13 -0.65 -3.04 0.00 0.00 177.10 174.47 2qbj h PRO 24 N 7.43 0.00 -0.00 0.43 0.11 -1.90 0.30 132.00 138.37 2qbj h PRO 24 Ca -0.14 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.80 2qbj h PRO 24 Cb 1.13 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 2qbj h PRO 24 CO 0.04 0.00 -0.78 0.87 -0.21 0.00 0.00 178.00 177.93 2qbj h LYS 25 N 0.00 0.01 0.00 1.05 1.57 -1.91 -3.16 116.57 114.13 2qbj h LYS 25 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2qbj h LYS 25 Cb 1.17 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2qbj h LYS 25 CO 0.00 0.78 -0.55 0.52 -0.57 0.00 0.00 179.45 179.63 2qbj h MET 26 N 0.00 0.00 -0.78 3.15 2.86 -0.65 -3.38 114.93 116.13 2qbj h MET 26 Ca -0.01 0.00 0.17 0.00 -2.06 0.00 0.00 59.70 57.80 2qbj h MET 26 Cb 1.38 0.00 -0.15 0.00 0.06 0.00 0.00 31.60 32.89 2qbj h MET 26 CO 0.10 0.00 -0.16 1.17 1.06 0.00 0.00 176.91 179.08 2qbj n LYS 27 N -2.57 -0.07 0.29 1.72 4.81 -1.20 0.15 118.16 121.29 2qbj n LYS 27 Ca 0.02 1.21 0.19 0.00 -0.87 0.00 0.00 58.31 58.87 2qbj n LYS 27 Cb 0.50 -1.83 1.01 0.00 0.02 0.00 0.00 35.03 34.73 2qbj n LYS 27 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 2qbj h PRO 28 N 0.00 0.00 -0.33 1.64 0.11 -1.81 -1.06 132.00 130.55 2qbj h PRO 28 Ca 0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.50 2qbj h PRO 28 Cb 0.64 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.75 2qbj h PRO 28 CO -0.79 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 178.19 2qbj n PHE 29 N -2.82 0.43 -3.96 0.65 3.72 0.39 -4.95 117.46 110.91 2qbj n PHE 29 Ca -0.02 -0.29 -0.35 0.00 -0.05 0.00 0.00 57.45 56.73 2qbj n PHE 29 Cb 0.08 -0.01 -0.09 0.00 -0.94 0.00 0.00 39.48 38.53 2qbj n PHE 29 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2qbj s ILE 30 N -1.19 4.94 0.00 4.37 1.01 -0.40 -0.58 121.20 129.34 2qbj s ILE 30 Ca 0.30 0.02 0.00 0.00 0.00 0.00 0.00 60.65 60.97 2qbj s ILE 30 Cb 0.17 -3.22 0.00 0.00 0.01 0.00 0.00 42.46 39.42 2qbj s ILE 30 CO 0.24 0.47 0.39 0.33 0.00 0.00 0.00 174.94 176.37 2qbj n PHE 31 N 3.38 0.00 -3.56 3.97 7.35 0.32 -4.50 117.46 124.42 2qbj n PHE 31 Ca -0.17 0.00 -0.01 0.00 -0.76 0.00 0.00 57.45 56.51 2qbj n PHE 31 Cb 0.52 -0.11 -0.05 0.00 0.35 0.00 0.00 39.48 40.19 2qbj n PHE 31 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2qbj s GLY 32 N -0.59 -0.28 0.63 7.13 0.00 -1.15 -4.92 107.32 108.14 2qbj s GLY 32 Ca 0.00 2.88 -0.18 0.00 0.00 0.00 0.00 44.72 47.42 2qbj s GLY 32 CO 0.00 2.88 1.21 0.00 0.00 0.00 0.00 173.10 177.20 2qbj s ALA 33 N 2.04 2.45 -0.25 3.20 0.00 -1.26 -3.44 121.76 124.50 2qbj s ALA 33 Ca -0.06 0.99 -0.22 0.00 0.00 0.00 0.00 51.96 52.66 2qbj s ALA 33 Cb -0.06 -3.46 0.07 0.00 0.00 0.00 0.00 23.12 19.66 2qbj s ALA 33 CO -0.17 -1.35 0.66 -0.98 0.00 0.00 0.00 175.76 173.92 2qbj s ARG 34 N -3.48 0.77 -1.16 0.00 1.70 0.12 -4.87 118.95 112.02 2qbj s ARG 34 Ca 0.77 0.94 -0.10 0.00 -0.47 0.00 0.00 55.73 56.87 2qbj s ARG 34 Cb -0.31 0.36 -0.02 0.00 -0.57 0.00 0.00 34.95 34.41 2qbj s ARG 34 CO 0.36 -0.10 0.80 -1.71 -1.08 0.00 0.00 175.30 173.58 2qbj n ASN 35 N 2.85 -4.45 -1.56 -2.89 4.05 -1.26 -2.40 115.26 109.60 2qbj n ASN 35 Ca -0.14 -0.87 -0.18 0.00 0.45 0.00 0.00 54.58 53.84 2qbj n ASN 35 Cb 0.56 -4.12 -0.06 0.00 1.23 0.00 0.00 39.78 37.39 2qbj n ASN 35 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2qbj n LYS 36 N -3.94 -1.31 -3.66 1.20 5.02 -1.26 -4.97 118.16 109.25 2qbj n LYS 36 Ca -0.15 1.07 -0.09 0.00 -2.02 0.00 0.00 58.31 57.13 2qbj n LYS 36 Cb 0.63 -5.40 -0.08 0.00 -0.02 0.00 0.00 35.03 30.15 2qbj n LYS 36 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qbj s VAL 37 N -2.73 -0.01 0.89 -0.18 0.11 -1.01 -3.85 120.40 113.62 2qbj s VAL 37 Ca 0.00 0.02 -0.11 0.00 -2.93 0.00 0.00 61.98 58.97 2qbj s VAL 37 Cb 0.00 -0.88 0.12 0.00 -1.53 0.00 0.00 36.38 34.09 2qbj s VAL 37 CO 0.00 0.01 1.10 -1.00 -3.33 0.00 0.00 175.10 171.88 2qbj s HIS 38 N 1.42 2.09 -0.12 1.54 3.76 -1.17 0.15 115.29 122.95 2qbj s HIS 38 Ca -0.09 1.53 0.00 0.00 -0.15 0.00 0.00 55.06 56.35 2qbj s HIS 38 Cb -0.06 -3.17 0.02 0.00 1.11 0.00 0.00 32.58 30.48 2qbj s HIS 38 CO -0.16 -2.47 -0.10 0.42 -0.85 0.00 0.00 174.74 171.59 2qbj s ILE 39 N -2.79 1.21 0.16 0.60 -1.09 -1.22 -3.56 121.20 114.51 2qbj s ILE 39 Ca 0.64 -0.42 -0.32 0.00 -2.23 0.00 0.00 60.65 58.32 2qbj s ILE 39 Cb -0.20 -1.17 -0.12 0.00 -1.58 0.00 0.00 42.46 39.39 2qbj s ILE 39 CO 0.58 0.39 1.74 -0.38 -1.23 0.00 0.00 174.94 176.04 2qbj n ILE 40 N 4.74 0.14 -1.92 2.92 5.41 -1.26 0.12 119.36 129.50 2qbj n ILE 40 Ca -0.15 -0.02 -0.38 0.00 1.00 0.00 0.00 62.75 63.19 2qbj n ILE 40 Cb 0.50 -1.94 -0.03 0.00 -0.71 0.00 0.00 39.64 37.46 2qbj n ILE 40 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2qbj n ASN 41 N 4.49 3.57 0.20 4.38 5.15 0.26 -4.29 115.26 129.02 2qbj n ASN 41 Ca 0.17 -2.78 0.16 0.00 -0.60 0.00 0.00 54.58 51.53 2qbj n ASN 41 Cb 0.34 -1.57 0.62 0.00 -0.53 0.00 0.00 39.78 38.64 2qbj n ASN 41 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 2qbj h LEU 42 N 14.06 0.00 -1.51 1.20 3.38 -1.89 0.21 115.31 130.76 2qbj h LEU 42 Ca 0.39 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.43 2qbj h LEU 42 Cb 0.80 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 2qbj h LEU 42 CO 1.59 0.00 0.41 -0.33 0.09 0.00 0.00 178.44 180.20 2qbj h GLU 43 N 0.00 0.58 -0.09 1.13 5.08 -1.95 -0.02 114.58 119.30 2qbj h GLU 43 Ca 0.11 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 2qbj h GLU 43 Cb 1.26 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.38 2qbj h GLU 43 CO -0.00 0.38 0.00 1.17 -1.00 0.00 0.00 179.01 179.56 2qbj n LYS 44 N -4.48 1.32 0.02 2.33 3.00 0.68 -4.33 118.16 116.71 2qbj n LYS 44 Ca 0.09 -1.51 -0.09 0.00 -0.00 0.00 0.00 58.31 56.80 2qbj n LYS 44 Cb 0.25 -1.29 -0.13 0.00 0.00 0.00 0.00 35.03 33.86 2qbj n LYS 44 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.40 178.55 2qbj h THR 45 N 2.80 1.27 -0.73 3.15 2.02 -0.53 -3.34 112.91 117.55 2qbj h THR 45 Ca 0.00 -3.04 0.10 0.00 0.77 0.00 0.00 66.41 64.24 2qbj h THR 45 Cb 0.64 2.65 -0.07 0.00 -1.74 0.00 0.00 68.15 69.62 2qbj h THR 45 CO 0.00 0.74 0.37 1.62 0.37 0.00 0.00 175.52 178.63 2qbj h VAL 46 N 0.01 0.85 -0.18 3.16 3.04 -1.44 0.37 116.25 122.04 2qbj h VAL 46 Ca -0.16 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.32 2qbj h VAL 46 Cb 1.90 0.17 -0.01 0.00 -2.01 0.00 0.00 31.29 31.34 2qbj h VAL 46 CO 0.11 0.11 0.12 -0.65 -1.01 0.00 0.00 177.57 176.26 2qbj h PRO 47 N 0.63 0.24 -0.59 4.17 0.11 -1.84 -1.87 132.00 132.85 2qbj h PRO 47 Ca 0.36 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.44 2qbj h PRO 47 Cb 0.38 -0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.41 2qbj h PRO 47 CO -0.27 0.16 0.32 0.52 -0.21 0.00 0.00 178.00 178.52 2qbj h MET 48 N 0.25 0.81 -0.22 1.05 2.86 -1.50 0.36 114.93 118.53 2qbj h MET 48 Ca 0.07 -0.08 0.06 0.00 -2.06 0.00 0.00 59.70 57.68 2qbj h MET 48 Cb -0.02 -0.16 -0.07 0.00 0.06 0.00 0.00 31.60 31.40 2qbj h MET 48 CO -0.01 0.60 -0.26 0.74 1.06 0.00 0.00 176.91 179.04 2qbj h PHE 49 N 0.82 -0.71 0.00 -0.22 0.04 0.54 -2.73 116.94 114.68 2qbj h PHE 49 Ca 0.21 0.04 0.00 0.00 2.80 0.00 0.00 57.97 61.02 2qbj h PHE 49 Cb 0.03 0.34 0.00 0.00 2.20 0.00 0.00 35.95 38.53 2qbj h PHE 49 CO 0.01 -0.34 -0.28 -0.91 -0.60 0.00 0.00 178.31 176.18 2qbj h ASN 50 N -0.28 0.00 -0.78 2.17 2.35 -1.26 -3.35 115.58 114.43 2qbj h ASN 50 Ca 0.13 0.00 0.31 0.00 -0.55 0.00 0.00 56.30 56.19 2qbj h ASN 50 Cb 0.48 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.71 2qbj h ASN 50 CO -0.39 0.61 0.36 1.21 -1.65 0.00 0.00 177.43 177.58 2qbj n GLU 51 N -4.51 -0.05 0.06 0.81 0.00 0.10 -0.59 120.64 116.46 2qbj n GLU 51 Ca -0.04 1.09 -0.02 0.00 0.00 0.00 0.00 57.16 58.19 2qbj n GLU 51 Cb 0.15 -1.93 -0.01 0.00 0.00 0.00 0.00 31.44 29.65 2qbj n GLU 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2qbj h ALA 52 N 1.56 -0.89 -0.85 4.31 0.00 -1.66 -3.02 119.26 118.71 2qbj h ALA 52 Ca 0.64 -0.04 0.25 0.00 0.00 0.00 0.00 54.91 55.76 2qbj h ALA 52 Cb 1.65 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.46 2qbj h ALA 52 CO -0.62 -0.88 0.68 -0.07 0.00 0.00 0.00 179.25 178.36 2qbj h LEU 53 N -0.18 0.00 -1.77 0.00 4.07 -1.12 0.27 115.31 116.57 2qbj h LEU 53 Ca -0.02 0.00 0.04 0.00 0.08 0.00 0.00 57.88 57.98 2qbj h LEU 53 Cb 0.12 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.85 2qbj h LEU 53 CO 0.03 0.00 0.22 0.00 -1.08 0.00 0.00 178.44 177.61 2qbj h ALA 54 N 1.44 1.93 0.00 1.53 0.00 -0.72 -0.44 119.26 123.00 2qbj h ALA 54 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2qbj h ALA 54 Cb 1.76 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.47 2qbj h ALA 54 CO -0.00 0.02 -0.55 0.93 0.00 0.00 0.00 179.25 179.64 2qbj h GLU 55 N 0.30 0.00 0.14 0.00 4.39 -0.43 -3.30 114.58 115.68 2qbj h GLU 55 Ca 0.14 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.83 2qbj h GLU 55 Cb 0.18 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.83 2qbj h GLU 55 CO -0.03 0.00 -0.07 -0.07 -1.16 0.00 0.00 179.01 177.68 2qbj h LEU 56 N 0.00 -0.16 -1.94 1.33 4.07 -0.97 -3.08 115.31 114.57 2qbj h LEU 56 Ca 0.00 0.01 0.31 0.00 0.08 0.00 0.00 57.88 58.28 2qbj h LEU 56 Cb 0.97 0.04 -0.05 0.00 1.08 0.00 0.00 40.66 42.70 2qbj h LEU 56 CO 0.00 -0.05 0.77 -0.55 -1.08 0.00 0.00 178.44 177.53 2qbj h ASN 57 N -0.31 0.05 0.36 -0.43 -1.07 -1.56 0.94 115.58 113.56 2qbj h ASN 57 Ca -0.02 0.01 -0.01 0.00 0.07 0.00 0.00 56.30 56.35 2qbj h ASN 57 Cb 0.14 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.38 2qbj h ASN 57 CO 0.03 0.01 -0.35 0.50 0.07 0.00 0.00 177.43 177.69 2qbj h LYS 58 N 0.04 -0.68 0.00 4.14 3.11 -1.63 0.60 116.57 122.16 2qbj h LYS 58 Ca 0.52 0.05 0.00 0.00 -2.81 0.00 0.00 60.65 58.41 2qbj h LYS 58 Cb 2.02 0.15 0.00 0.00 -1.00 0.00 0.00 32.23 33.40 2qbj h LYS 58 CO -0.03 -0.45 -0.33 0.44 -2.81 0.00 0.00 179.45 176.27 2qbj n ILE 59 N -4.48 0.48 0.18 2.00 -6.64 -0.62 -3.37 119.36 106.91 2qbj n ILE 59 Ca -0.08 -0.29 0.05 0.00 -1.77 0.00 0.00 62.75 60.66 2qbj n ILE 59 Cb 0.32 -0.35 0.29 0.00 -1.44 0.00 0.00 39.64 38.46 2qbj n ILE 59 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2qbj h ALA 60 N 2.50 0.95 -1.01 -1.28 0.00 0.11 -3.13 119.26 117.39 2qbj h ALA 60 Ca 0.00 -0.37 0.25 0.00 0.00 0.00 0.00 54.91 54.79 2qbj h ALA 60 Cb 0.75 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.38 2qbj h ALA 60 CO 0.00 0.51 0.65 0.66 0.00 0.00 0.00 179.25 181.07 2qbj h SER 61 N 0.00 0.49 -3.25 0.00 4.64 -0.88 -0.95 113.55 113.60 2qbj h SER 61 Ca -0.00 0.08 -0.77 0.00 -0.47 0.00 0.00 61.79 60.62 2qbj h SER 61 Cb 0.97 -0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.76 2qbj h SER 61 CO 0.05 0.12 0.38 0.54 -0.87 0.00 0.00 176.83 177.05 2qbj n ARG 62 N -4.63 3.57 -4.53 4.77 3.00 -1.20 -4.45 116.66 113.19 2qbj n ARG 62 Ca 0.24 -4.51 -0.43 0.00 -0.01 0.00 0.00 57.85 53.15 2qbj n ARG 62 Cb 0.81 -2.49 -0.08 0.00 0.00 0.00 0.00 32.46 30.70 2qbj n ARG 62 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2qbj n LYS 63 N 2.10 -0.80 -1.36 5.56 5.02 -1.09 -4.64 118.16 122.95 2qbj n LYS 63 Ca 0.24 0.15 -0.53 0.00 -2.02 0.00 0.00 58.31 56.15 2qbj n LYS 63 Cb 0.37 -4.73 -0.10 0.00 -0.02 0.00 0.00 35.03 30.55 2qbj n LYS 63 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qbj n GLY 64 N -1.07 0.05 3.56 0.72 0.00 -0.38 -4.79 105.19 103.29 2qbj n GLY 64 Ca 0.12 1.04 -0.26 0.00 0.00 0.00 0.00 46.02 46.92 2qbj n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qbj s LYS 65 N 6.55 2.44 -0.52 1.61 1.02 -1.26 -4.72 119.74 124.86 2qbj s LYS 65 Ca 1.17 -0.37 -0.16 0.00 0.02 0.00 0.00 55.97 56.63 2qbj s LYS 65 Cb -1.19 -5.07 0.10 0.00 -0.52 0.00 0.00 37.83 31.16 2qbj s LYS 65 CO 0.56 -3.61 0.50 0.42 -0.92 0.00 0.00 175.35 172.30 2qbj s ILE 66 N 10.75 5.15 -0.57 2.17 -1.09 -1.26 -1.21 121.20 135.14 2qbj s ILE 66 Ca 0.72 -1.25 -0.23 0.00 -2.23 0.00 0.00 60.65 57.66 2qbj s ILE 66 Cb -0.06 -4.29 0.05 0.00 -1.58 0.00 0.00 42.46 36.58 2qbj s ILE 66 CO 0.03 -0.80 0.93 -0.22 -1.23 0.00 0.00 174.94 173.64 2qbj s LEU 67 N 1.80 4.21 0.24 2.97 0.20 -1.18 0.38 118.68 127.30 2qbj s LEU 67 Ca 0.05 -0.53 -0.30 0.00 0.69 0.00 0.00 54.13 54.04 2qbj s LEU 67 Cb -0.27 -2.71 -0.09 0.00 -0.43 0.00 0.00 46.19 42.69 2qbj s LEU 67 CO 0.05 -1.26 1.12 -0.36 -0.29 0.00 0.00 176.35 175.62 2qbj s PHE 68 N 3.90 3.54 -0.15 5.38 0.40 0.83 -2.16 117.98 129.73 2qbj s PHE 68 Ca 0.27 1.62 0.00 0.00 -0.60 0.00 0.00 56.93 58.23 2qbj s PHE 68 Cb -0.14 -3.32 0.03 0.00 0.51 0.00 0.00 43.02 40.10 2qbj s PHE 68 CO 0.17 -0.71 -0.12 0.08 0.70 0.00 0.00 175.22 175.34 2qbj s VAL 69 N -0.77 1.42 -0.30 -0.44 1.01 0.38 -0.89 120.40 120.81 2qbj s VAL 69 Ca 0.47 -0.59 -0.06 0.00 0.00 0.00 0.00 61.98 61.79 2qbj s VAL 69 Cb -0.32 -1.39 0.19 0.00 0.00 0.00 0.00 36.38 34.86 2qbj s VAL 69 CO 0.39 0.38 0.84 -0.83 0.00 0.00 0.00 175.10 175.89 2qbj s GLY 70 N 1.54 -0.76 -0.18 4.51 0.00 -1.06 -0.12 107.32 111.25 2qbj s GLY 70 Ca 0.04 2.15 0.03 0.00 0.00 0.00 0.00 44.72 46.94 2qbj s GLY 70 CO -0.10 3.70 -0.13 2.41 0.00 0.00 0.00 173.10 178.98 2qbj n THR 71 N 5.40 1.03 -1.29 0.90 -1.04 -1.26 -3.76 114.28 114.27 2qbj n THR 71 Ca -0.01 -0.42 -0.58 0.00 -2.04 0.00 0.00 64.05 61.00 2qbj n THR 71 Cb 0.53 -1.08 -0.11 0.00 -1.82 0.00 0.00 70.33 67.85 2qbj n THR 71 CO 0.00 0.00 0.00 2.29 -0.64 0.00 0.00 175.07 176.72 2qbj n LYS 72 N -2.97 0.15 0.00 -2.82 2.85 -1.26 -4.22 118.16 109.89 2qbj n LYS 72 Ca -0.31 0.04 0.00 0.00 -1.05 0.00 0.00 58.31 56.99 2qbj n LYS 72 Cb 0.86 -1.63 0.00 0.00 -0.65 0.00 0.00 35.03 33.60 2qbj n LYS 72 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 177.40 175.22 2qbj n ARG 73 N 7.65 0.00 -0.01 -1.58 3.00 -1.26 -1.21 116.66 123.24 2qbj n ARG 73 Ca 0.54 0.00 -0.01 0.00 -0.00 0.00 0.00 57.85 58.38 2qbj n ARG 73 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 32.46 2qbj n ARG 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2qbj h ALA 74 N 0.00 -0.16 -0.81 5.13 0.00 -1.99 -2.49 119.26 118.93 2qbj h ALA 74 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.08 2qbj h ALA 74 Cb 0.00 0.88 -0.11 0.00 0.00 0.00 0.00 17.79 18.56 2qbj h ALA 74 CO 0.00 -0.18 0.34 0.00 0.00 0.00 0.00 179.25 179.41 2qbj h ALA 75 N -1.08 1.19 -1.16 0.00 0.00 -1.48 -3.28 119.26 113.46 2qbj h ALA 75 Ca 0.01 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2qbj h ALA 75 Cb 0.02 0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2qbj h ALA 75 CO -0.03 -0.24 0.00 0.45 0.00 0.00 0.00 179.25 179.43 2qbj n SER 76 N -5.01 0.00 0.26 0.00 2.88 -0.94 0.53 113.62 111.35 2qbj n SER 76 Ca 0.17 0.45 0.15 0.00 -1.33 0.00 0.00 58.87 58.31 2qbj n SER 76 Cb 0.49 -0.13 0.79 0.00 -0.75 0.00 0.00 64.21 64.61 2qbj n SER 76 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2qbj h GLU 77 N 0.00 0.00 0.00 -1.46 4.81 -1.67 -2.82 114.58 113.44 2qbj h GLU 77 Ca 0.00 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.07 2qbj h GLU 77 Cb 0.00 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2qbj h GLU 77 CO 0.00 0.00 -0.95 0.00 -0.73 0.00 0.00 179.01 177.33 2qbj h ALA 78 N 1.69 0.19 -0.70 2.92 0.00 -0.01 -3.40 119.26 119.94 2qbj h ALA 78 Ca 0.00 -0.99 0.15 0.00 0.00 0.00 0.00 54.91 54.07 2qbj h ALA 78 Cb 0.28 0.59 -0.13 0.00 0.00 0.00 0.00 17.79 18.53 2qbj h ALA 78 CO 0.00 0.56 -0.06 0.28 0.00 0.00 0.00 179.25 180.03 2qbj h VAL 79 N -1.00 0.36 -0.71 0.00 2.07 0.35 -2.41 116.25 114.92 2qbj h VAL 79 Ca -0.25 -0.02 0.07 0.00 0.82 0.00 0.00 66.70 67.32 2qbj h VAL 79 Cb 1.12 0.29 -0.10 0.00 -1.52 0.00 0.00 31.29 31.08 2qbj h VAL 79 CO -0.15 0.01 -0.56 0.07 0.02 0.00 0.00 177.57 176.96 2qbj h LYS 80 N 0.07 -0.17 0.00 1.57 2.10 -1.76 0.57 116.57 118.96 2qbj h LYS 80 Ca 0.36 0.01 0.00 0.00 -2.00 0.00 0.00 60.65 59.03 2qbj h LYS 80 Cb 0.60 0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.97 2qbj h LYS 80 CO -0.65 -0.11 -0.01 -0.44 -2.00 0.00 0.00 179.45 176.23 2qbj h ASP 81 N -0.18 -0.04 0.02 7.07 3.32 -1.64 -0.91 116.42 124.06 2qbj h ASP 81 Ca 0.12 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.18 2qbj h ASP 81 Cb 0.48 0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.00 2qbj h ASP 81 CO -0.76 -0.01 -0.40 0.00 -1.72 0.00 0.00 179.24 176.35 2qbj h ALA 82 N -1.49 -0.84 0.00 3.45 0.00 -1.47 0.60 119.26 119.51 2qbj h ALA 82 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2qbj h ALA 82 Cb 0.02 0.83 0.00 0.00 0.00 0.00 0.00 17.79 18.64 2qbj h ALA 82 CO -0.01 -0.96 0.24 0.00 0.00 0.00 0.00 179.25 178.52 2qbj h ALA 83 N -0.73 1.21 0.00 0.00 0.00 -0.92 0.14 119.26 118.96 2qbj h ALA 83 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.79 2qbj h ALA 83 Cb 0.54 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2qbj h ALA 83 CO -0.26 -0.21 -2.08 -0.11 0.00 0.00 0.00 179.25 176.60 2qbj n LEU 84 N -2.57 0.00 -1.22 0.00 0.00 -0.35 -3.60 117.00 109.26 2qbj n LEU 84 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 56.01 55.99 2qbj n LEU 84 Cb 0.28 0.17 0.00 0.00 0.00 0.00 0.00 43.42 43.86 2qbj n LEU 84 CO 0.11 0.17 0.49 -1.20 0.00 0.00 0.00 177.39 176.96 2qbj n SER 85 N -2.39 2.75 0.00 1.96 7.64 0.20 -4.69 113.62 119.09 2qbj n SER 85 Ca -0.13 -1.64 0.00 0.00 1.01 0.00 0.00 58.87 58.10 2qbj n SER 85 Cb 0.74 -0.52 0.00 0.00 -1.01 0.00 0.00 64.21 63.43 2qbj n SER 85 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qbj n ASP 87 N 0.00 1.49 -2.81 0.00 2.03 -1.26 -4.73 116.55 111.27 2qbj n ASP 87 Ca 0.00 -2.56 -0.15 0.00 0.52 0.00 0.00 54.79 52.60 2qbj n ASP 87 Cb 0.00 -0.73 -0.05 0.00 -0.72 0.00 0.00 41.12 39.63 2qbj n ASP 87 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qbj n GLN 88 N 7.70 0.52 -4.14 -0.67 6.02 -1.24 -4.54 117.38 121.03 2qbj n GLN 88 Ca 0.48 -2.23 -0.09 0.00 -0.01 0.00 0.00 57.00 55.14 2qbj n GLN 88 Cb 0.42 1.46 -0.10 0.00 1.02 0.00 0.00 30.24 33.03 2qbj n GLN 88 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2qbj s PHE 89 N -2.69 0.80 0.23 1.08 0.40 0.16 -4.76 117.98 113.20 2qbj s PHE 89 Ca 0.19 -1.18 -0.20 0.00 -0.60 0.00 0.00 56.93 55.13 2qbj s PHE 89 Cb 0.01 -0.47 0.03 0.00 0.51 0.00 0.00 43.02 43.10 2qbj s PHE 89 CO 0.13 -0.47 0.63 -0.59 0.70 0.00 0.00 175.22 175.62 2qbj s PHE 90 N -4.00 -0.21 -0.26 0.36 -0.12 -0.97 0.29 117.98 113.07 2qbj s PHE 90 Ca 0.20 -0.16 -0.01 0.00 -0.05 0.00 0.00 56.93 56.91 2qbj s PHE 90 Cb 0.08 0.56 0.13 0.00 -0.63 0.00 0.00 43.02 43.16 2qbj s PHE 90 CO -0.01 -1.06 0.32 0.08 -0.05 0.00 0.00 175.22 174.51 2qbj s VAL 91 N -3.88 -0.48 -2.23 -2.49 1.01 -0.07 -3.75 120.40 108.52 2qbj s VAL 91 Ca 0.09 -0.29 0.18 0.00 0.00 0.00 0.00 61.98 61.96 2qbj s VAL 91 Cb -0.03 -0.90 0.15 0.00 0.00 0.00 0.00 36.38 35.60 2qbj s VAL 91 CO 0.00 -0.31 1.08 -0.46 0.00 0.00 0.00 175.10 175.41 2qbj n ASN 92 N 5.33 2.53 -4.10 3.32 0.23 -1.25 -2.55 115.26 118.77 2qbj n ASN 92 Ca -0.02 -1.76 -0.32 0.00 -0.53 0.00 0.00 54.58 51.95 2qbj n ASN 92 Cb 0.48 -0.01 -0.16 0.00 -2.08 0.00 0.00 39.78 38.01 2qbj n ASN 92 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 2qbj s HIS 93 N -1.49 2.53 0.00 -2.53 3.76 -1.25 -4.39 115.29 111.92 2qbj s HIS 93 Ca 0.21 -1.42 0.00 0.00 -0.15 0.00 0.00 55.06 53.70 2qbj s HIS 93 Cb 0.15 -1.77 0.00 0.00 1.11 0.00 0.00 32.58 32.07 2qbj s HIS 93 CO 0.23 -0.71 0.00 2.89 -0.85 0.00 0.00 174.74 176.29 2qbj n ARG 94 N 4.54 0.00 -1.54 1.40 0.00 -1.26 -4.47 116.66 115.33 2qbj n ARG 94 Ca -0.20 0.00 -0.31 0.00 -0.00 0.00 0.00 57.85 57.35 2qbj n ARG 94 Cb 0.50 0.00 -0.07 0.00 -0.00 0.00 0.00 32.46 32.90 2qbj n ARG 94 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.63 179.50 2qbj n TRP 95 N 0.80 1.17 -1.36 2.89 -0.00 -1.26 -4.86 117.44 114.82 2qbj n TRP 95 Ca 0.00 0.12 -0.42 0.00 -0.00 0.00 0.00 57.50 57.19 2qbj n TRP 95 Cb 0.00 -2.48 -0.00 0.00 -0.00 0.00 0.00 31.31 28.82 2qbj n TRP 95 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 177.69 178.97 2qbj n LEU 96 N 15.32 -1.80 -4.52 5.87 7.99 -1.26 -4.81 117.00 133.78 2qbj n LEU 96 Ca 0.45 0.87 -0.42 0.00 -0.01 0.00 0.00 56.01 56.90 2qbj n LEU 96 Cb 0.43 -0.96 -0.03 0.00 -0.11 0.00 0.00 43.42 42.74 2qbj n LEU 96 CO 0.72 -3.68 1.07 -0.83 -1.51 0.00 0.00 177.39 173.17 2qbj s GLY 97 N -0.99 1.06 0.00 -0.72 0.00 -1.26 -3.66 107.32 101.75 2qbj s GLY 97 Ca 0.61 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.75 2qbj s GLY 97 CO 0.61 2.48 0.00 0.61 0.00 0.00 0.00 173.10 176.79 2qbj n GLY 98 N 5.46 0.64 0.36 0.20 0.00 -1.26 -4.89 105.19 105.70 2qbj n GLY 98 Ca 0.03 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.21 2qbj n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qbj h MET 99 N 3.30 0.00 0.00 1.61 -0.00 -1.82 1.30 114.93 119.32 2qbj h MET 99 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.67 2qbj h MET 99 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 31.60 2qbj h MET 99 CO 0.00 0.00 -1.05 1.28 -0.00 0.00 0.00 176.91 177.14 2qbj n LEU 100 N -3.07 1.92 0.02 -0.10 4.32 -1.26 -4.01 117.00 114.83 2qbj n LEU 100 Ca 0.03 0.37 -0.13 0.00 -0.02 0.00 0.00 56.01 56.26 2qbj n LEU 100 Cb 0.64 -0.76 -0.09 0.00 -1.62 0.00 0.00 43.42 41.59 2qbj n LEU 100 CO 0.16 -0.23 0.70 0.00 -1.22 0.00 0.00 177.39 176.79 2qbj h THR 101 N -1.00 1.19 -1.07 -5.08 1.03 -1.77 -3.09 112.91 103.12 2qbj h THR 101 Ca -0.05 -0.73 -0.54 0.00 -0.01 0.00 0.00 66.41 65.07 2qbj h THR 101 Cb 0.98 1.67 -0.21 0.00 -1.07 0.00 0.00 68.15 69.53 2qbj h THR 101 CO -0.03 0.19 0.64 -3.20 -0.01 0.00 0.00 175.52 173.10 2qbj n ASN 102 N -4.96 6.95 -0.06 0.00 5.15 0.44 -4.65 115.26 118.13 2qbj n ASN 102 Ca -0.08 -3.42 -0.08 0.00 -0.60 0.00 0.00 54.58 50.40 2qbj n ASN 102 Cb 0.19 -1.10 -0.01 0.00 -0.53 0.00 0.00 39.78 38.32 2qbj n ASN 102 CO 0.00 0.00 0.00 -0.25 1.40 0.00 0.00 177.26 178.41 2qbj h TRP 103 N 2.37 0.07 -0.98 1.20 7.01 -1.43 -0.49 115.95 123.71 2qbj h TRP 103 Ca 0.45 0.02 0.32 0.00 2.11 0.00 0.00 58.89 61.78 2qbj h TRP 103 Cb 0.66 0.00 -0.15 0.00 -2.10 0.00 0.00 29.16 27.56 2qbj h TRP 103 CO 1.23 0.02 0.47 1.57 -2.79 0.00 0.00 178.44 178.93 2qbj h LYS 104 N 0.14 0.23 0.11 2.65 2.10 -1.88 0.66 116.57 120.57 2qbj h LYS 104 Ca 0.11 -0.01 -0.28 0.00 -2.00 0.00 0.00 60.65 58.47 2qbj h LYS 104 Cb 0.12 -0.05 -0.01 0.00 -0.90 0.00 0.00 32.23 31.39 2qbj h LYS 104 CO -0.15 0.15 -1.46 1.15 -2.00 0.00 0.00 179.45 177.14 2qbj h THR 105 N 0.23 0.98 -0.30 0.07 2.02 -1.85 -3.38 112.91 110.68 2qbj h THR 105 Ca 0.71 -2.38 -0.07 0.00 0.77 0.00 0.00 66.41 65.45 2qbj h THR 105 Cb 1.63 2.66 -0.02 0.00 -1.74 0.00 0.00 68.15 70.68 2qbj h THR 105 CO -0.66 0.69 -0.10 0.58 0.37 0.00 0.00 175.52 176.40 2qbj h VAL 106 N -0.32 1.23 -0.27 3.16 2.07 -0.13 -2.78 116.25 119.20 2qbj h VAL 106 Ca -0.32 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.24 2qbj h VAL 106 Cb 1.75 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 32.62 2qbj h VAL 106 CO 0.04 0.33 0.18 0.08 0.02 0.00 0.00 177.57 178.22 2qbj h ARG 107 N 0.48 0.25 -0.83 1.57 0.11 0.12 -1.80 114.38 114.29 2qbj h ARG 107 Ca 0.09 -0.02 0.11 0.00 0.10 0.00 0.00 59.98 60.26 2qbj h ARG 107 Cb 0.47 -0.06 -0.08 0.00 1.11 0.00 0.00 29.97 31.42 2qbj h ARG 107 CO 0.03 0.17 0.46 1.96 0.10 0.00 0.00 179.97 182.69 2qbj h GLN 108 N 0.26 0.73 -0.04 0.08 1.08 -1.66 -1.25 115.11 114.31 2qbj h GLN 108 Ca 0.11 -0.04 0.02 0.00 -1.45 0.00 0.00 58.65 57.28 2qbj h GLN 108 Cb 0.13 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.38 2qbj h GLN 108 CO -0.02 0.48 -0.06 0.77 -0.95 0.00 0.00 178.83 179.05 2qbj h SER 109 N 0.75 -0.17 -0.57 1.46 0.02 -1.47 -2.44 113.55 111.13 2qbj h SER 109 Ca 0.41 0.03 0.11 0.00 -0.84 0.00 0.00 61.79 61.51 2qbj h SER 109 Cb 0.44 0.08 -0.11 0.00 0.14 0.00 0.00 62.40 62.95 2qbj h SER 109 CO -0.28 -0.08 -0.14 0.40 -1.14 0.00 0.00 176.83 175.59 2qbj h ILE 110 N -0.08 0.43 -0.58 3.27 2.04 -1.25 0.11 117.51 121.45 2qbj h ILE 110 Ca 0.04 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.01 2qbj h ILE 110 Cb 0.13 0.43 -0.09 0.00 -0.74 0.00 0.00 36.82 36.55 2qbj h ILE 110 CO -0.09 0.00 0.03 0.50 0.00 0.00 0.00 178.15 178.59 2qbj h LYS 111 N -0.00 0.14 -0.50 2.37 3.64 -0.94 0.13 116.57 121.42 2qbj h LYS 111 Ca 0.27 -0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.74 2qbj h LYS 111 Cb 0.42 -0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.12 2qbj h LYS 111 CO -0.59 0.10 0.01 -0.09 -2.27 0.00 0.00 179.45 176.61 2qbj h ARG 112 N 0.15 0.12 -0.90 1.90 9.65 -0.42 0.40 114.38 125.29 2qbj h ARG 112 Ca 0.30 -0.01 0.03 0.00 -1.10 0.00 0.00 59.98 59.20 2qbj h ARG 112 Cb 0.47 -0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.97 2qbj h ARG 112 CO -0.46 0.08 0.58 1.25 2.80 0.00 0.00 179.97 184.22 2qbj h LEU 113 N 0.13 0.97 0.00 3.80 6.46 -0.01 -1.50 115.31 125.16 2qbj h LEU 113 Ca 0.25 -0.01 0.00 0.00 -0.12 0.00 0.00 57.88 58.00 2qbj h LEU 113 Cb 0.37 -0.22 0.00 0.00 -0.73 0.00 0.00 40.66 40.08 2qbj h LEU 113 CO -0.40 0.67 0.00 0.29 -0.62 0.00 0.00 178.44 178.37 2qbj n LYS 114 N -4.52 0.00 -0.26 1.25 4.76 0.18 -0.50 118.16 119.07 2qbj n LYS 114 Ca 0.11 0.20 0.33 0.00 -2.87 0.00 0.00 58.31 56.08 2qbj n LYS 114 Cb 0.09 -1.07 0.67 0.00 -1.84 0.00 0.00 35.03 32.88 2qbj n LYS 114 CO 0.00 0.00 0.00 0.38 -1.37 0.00 0.00 177.40 176.41 2qbj h ASP 115 N 0.00 0.00 -0.16 4.39 3.04 -1.41 0.56 116.42 122.84 2qbj h ASP 115 Ca 0.00 0.00 -0.11 0.00 -3.24 0.00 0.00 57.03 53.68 2qbj h ASP 115 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 2qbj h ASP 115 CO 0.00 0.00 -0.33 -0.07 -2.04 0.00 0.00 179.24 176.80 2qbj h LEU 116 N 0.00 0.57 -1.62 0.15 3.38 -0.89 -3.03 115.31 113.87 2qbj h LEU 116 Ca 0.52 -0.56 0.06 0.00 0.09 0.00 0.00 57.88 58.00 2qbj h LEU 116 Cb 2.44 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.99 2qbj h LEU 116 CO -0.01 1.02 0.35 -0.33 0.09 0.00 0.00 178.44 179.57 2qbj h GLU 117 N 0.14 0.46 -0.22 1.13 5.08 0.28 0.92 114.58 122.36 2qbj h GLU 117 Ca 0.00 -0.03 -0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2qbj h GLU 117 Cb 0.92 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 30.06 2qbj h GLU 117 CO 0.07 0.30 -0.10 1.79 -1.00 0.00 0.00 179.01 180.08 2qbj h THR 118 N 0.47 1.19 0.50 1.13 1.35 -1.37 -3.13 112.91 113.05 2qbj h THR 118 Ca 0.23 -0.83 -0.02 0.00 -0.55 0.00 0.00 66.41 65.24 2qbj h THR 118 Cb 0.31 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 2qbj h THR 118 CO -0.06 0.27 -0.24 1.56 -0.25 0.00 0.00 175.52 176.79 2qbj h GLN 119 N 0.33 -0.65 -0.80 4.72 1.08 -0.72 0.40 115.11 119.47 2qbj h GLN 119 Ca 0.07 0.04 0.25 0.00 -1.45 0.00 0.00 58.65 57.57 2qbj h GLN 119 Cb 0.39 0.15 -0.15 0.00 -0.05 0.00 0.00 27.48 27.82 2qbj h GLN 119 CO 0.02 -0.43 0.14 -1.13 -0.95 0.00 0.00 178.83 176.48 2qbj n SER 120 N -4.09 0.02 0.01 1.46 3.41 -1.06 0.44 113.62 113.81 2qbj n SER 120 Ca -0.08 1.35 -0.19 0.00 -0.26 0.00 0.00 58.87 59.68 2qbj n SER 120 Cb 0.27 -0.54 -0.14 0.00 -0.26 0.00 0.00 64.21 63.54 2qbj n SER 120 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2qbj h GLN 121 N 0.00 0.22 -7.21 4.33 -0.00 -1.54 -3.47 115.11 107.44 2qbj h GLN 121 Ca 0.54 -0.37 -0.46 0.00 -0.00 0.00 0.00 58.65 58.36 2qbj h GLN 121 Cb 1.24 0.14 0.20 0.00 0.00 0.00 0.00 27.48 29.05 2qbj h GLN 121 CO -0.71 1.18 0.09 0.34 0.00 0.00 0.00 178.83 179.73 2qbj s ASP 122 N -6.84 1.75 -0.03 -0.69 2.15 0.17 -4.99 116.67 108.19 2qbj s ASP 122 Ca -0.17 1.64 -0.21 0.00 0.43 0.00 0.00 52.55 54.24 2qbj s ASP 122 Cb 0.01 -2.32 -0.26 0.00 -0.30 0.00 0.00 42.92 40.05 2qbj s ASP 122 CO 0.78 -3.74 1.01 1.23 -0.17 0.00 0.00 175.17 174.27 2qbj h GLY 123 N -2.31 0.37 -6.07 2.66 0.00 -1.86 -3.38 103.07 92.48 2qbj h GLY 123 Ca -0.56 -0.74 -0.48 0.00 0.00 0.00 0.00 47.33 45.54 2qbj h GLY 123 CO 0.49 0.66 2.24 -0.37 0.00 0.00 0.00 176.54 179.56 2qbj n THR 124 N -4.23 1.76 0.00 4.70 5.66 -1.26 -2.31 114.28 118.59 2qbj n THR 124 Ca -0.11 -1.28 0.00 0.00 -3.05 0.00 0.00 64.05 59.61 2qbj n THR 124 Cb 0.70 -2.15 0.00 0.00 -1.55 0.00 0.00 70.33 67.33 2qbj n THR 124 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 2qbj n PHE 125 N 6.11 0.00 0.47 1.09 7.35 -1.26 -4.87 117.46 126.35 2qbj n PHE 125 Ca 0.43 0.00 0.12 0.00 -0.76 0.00 0.00 57.45 57.24 2qbj n PHE 125 Cb 0.26 0.00 0.14 0.00 0.35 0.00 0.00 39.48 40.24 2qbj n PHE 125 CO 0.00 0.00 0.00 0.38 -0.76 0.00 0.00 176.76 176.38 2qbj h ASP 126 N 0.00 0.00 -3.28 -2.13 3.04 -1.72 -3.47 116.42 108.86 2qbj h ASP 126 Ca 0.00 -0.17 -0.45 0.00 -3.24 0.00 0.00 57.03 53.17 2qbj h ASP 126 Cb 0.00 0.00 0.22 0.00 -1.04 0.00 0.00 39.33 38.51 2qbj h ASP 126 CO 0.00 0.08 -0.10 2.29 -2.04 0.00 0.00 179.24 179.48 2qbj n LYS 127 N -2.25 -2.10 -1.27 4.15 -0.00 -1.26 -4.85 118.16 110.58 2qbj n LYS 127 Ca 0.03 -0.58 0.10 0.00 -0.00 0.00 0.00 58.31 57.85 2qbj n LYS 127 Cb 0.46 -2.15 -0.05 0.00 -0.00 0.00 0.00 35.03 33.29 2qbj n LYS 127 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 2qbj n LEU 128 N -4.49 -1.09 -4.51 -5.58 7.94 -1.26 -4.75 117.00 103.26 2qbj n LEU 128 Ca 0.04 2.21 -0.34 0.00 -1.11 0.00 0.00 56.01 56.82 2qbj n LEU 128 Cb 0.54 -2.58 0.11 0.00 0.53 0.00 0.00 43.42 42.03 2qbj n LEU 128 CO 0.55 -1.42 0.20 0.35 -1.11 0.00 0.00 177.39 175.97 2qbj n THR 129 N -3.45 0.94 0.16 1.96 -2.24 -1.26 -4.74 114.28 105.65 2qbj n THR 129 Ca -0.05 -0.24 0.08 0.00 -2.27 0.00 0.00 64.05 61.57 2qbj n THR 129 Cb 0.53 -0.81 0.42 0.00 -2.10 0.00 0.00 70.33 68.36 2qbj n THR 129 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2qbj n LYS 130 N -1.99 0.10 0.00 -0.78 4.76 -1.26 -2.83 118.16 116.16 2qbj n LYS 130 Ca 0.10 0.58 0.00 0.00 -2.87 0.00 0.00 58.31 56.12 2qbj n LYS 130 Cb 0.52 -2.04 0.00 0.00 -1.84 0.00 0.00 35.03 31.67 2qbj n LYS 130 CO 0.00 0.00 0.00 1.17 -1.37 0.00 0.00 177.40 177.20 2qbj n LYS 131 N -2.10 0.00 0.19 1.97 3.00 -1.26 0.22 118.16 120.18 2qbj n LYS 131 Ca -0.01 0.16 0.03 0.00 -0.00 0.00 0.00 58.31 58.50 2qbj n LYS 131 Cb 0.23 -0.74 0.42 0.00 0.00 0.00 0.00 35.03 34.94 2qbj n LYS 131 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.40 178.89 2qbj h GLU 132 N 0.00 0.05 -0.16 1.64 4.22 -1.93 -2.82 114.58 115.59 2qbj h GLU 132 Ca 0.00 -0.01 0.05 0.00 0.08 0.00 0.00 59.36 59.47 2qbj h GLU 132 Cb 0.00 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.18 2qbj h GLU 132 CO 0.00 0.30 -0.34 0.00 -2.18 0.00 0.00 179.01 176.79 2qbj h ALA 133 N 1.70 -0.39 -0.29 2.92 0.00 -1.37 0.45 119.26 122.28 2qbj h ALA 133 Ca 0.01 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2qbj h ALA 133 Cb 0.47 0.65 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2qbj h ALA 133 CO 0.03 -0.81 0.10 1.25 0.00 0.00 0.00 179.25 179.82 2qbj h LEU 134 N -0.40 0.42 -0.56 0.00 5.85 -0.08 -1.18 115.31 119.36 2qbj h LEU 134 Ca 0.10 -0.19 0.11 0.00 0.84 0.00 0.00 57.88 58.74 2qbj h LEU 134 Cb 0.56 -0.11 -0.11 0.00 0.37 0.00 0.00 40.66 41.37 2qbj h LEU 134 CO -0.38 0.49 -0.17 0.24 -0.34 0.00 0.00 178.44 178.28 2qbj h MET 135 N 0.32 -0.04 -0.48 1.25 2.86 -1.14 0.68 114.93 118.39 2qbj h MET 135 Ca 0.10 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.68 2qbj h MET 135 Cb 0.22 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2qbj h MET 135 CO -0.01 -0.02 0.06 -0.09 1.06 0.00 0.00 176.91 177.91 2qbj h ARG 136 N -0.04 0.80 0.43 1.72 2.43 -0.80 -2.65 114.38 116.27 2qbj h ARG 136 Ca 0.26 -0.22 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 2qbj h ARG 136 Cb 0.44 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2qbj h ARG 136 CO -0.59 0.82 -0.38 1.15 -1.51 0.00 0.00 179.97 179.45 2qbj h THR 137 N 0.67 0.00 -0.87 0.20 2.02 0.42 -2.74 112.91 112.60 2qbj h THR 137 Ca 0.14 0.00 0.23 0.00 0.77 0.00 0.00 66.41 67.55 2qbj h THR 137 Cb 0.41 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 66.68 2qbj h THR 137 CO 0.01 0.00 0.22 -0.09 0.37 0.00 0.00 175.52 176.03 2qbj h ARG 138 N -0.80 0.19 -0.66 6.66 2.43 0.23 -0.54 114.38 121.90 2qbj h ARG 138 Ca -0.06 -0.01 0.13 0.00 -0.81 0.00 0.00 59.98 59.23 2qbj h ARG 138 Cb 0.68 -0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 30.06 2qbj h ARG 138 CO -0.02 0.13 -0.18 1.49 -1.51 0.00 0.00 179.97 179.88 2qbj h GLU 139 N 0.20 -0.02 -0.53 0.20 4.81 -1.16 0.53 114.58 118.61 2qbj h GLU 139 Ca 0.54 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.85 2qbj h GLU 139 Cb 1.09 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.41 2qbj h GLU 139 CO -0.66 -0.01 0.19 -0.07 -0.73 0.00 0.00 179.01 177.73 2qbj h LEU 140 N -0.02 0.18 -0.15 1.64 4.07 -1.04 -0.70 115.31 119.29 2qbj h LEU 140 Ca 0.31 0.07 0.02 0.00 0.08 0.00 0.00 57.88 58.36 2qbj h LEU 140 Cb 0.50 0.05 -0.03 0.00 1.08 0.00 0.00 40.66 42.26 2qbj h LEU 140 CO -0.69 0.13 -0.21 -0.33 -1.08 0.00 0.00 178.44 176.26 2qbj h GLU 141 N 0.36 -0.14 0.18 1.13 5.08 -0.86 0.13 114.58 120.46 2qbj h GLU 141 Ca 0.26 0.01 0.01 0.00 -1.00 0.00 0.00 59.36 58.64 2qbj h GLU 141 Cb 0.29 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 2qbj h GLU 141 CO -0.27 -0.09 -0.26 -0.22 -1.00 0.00 0.00 179.01 177.17 2qbj h LYS 142 N -0.15 -0.49 -0.72 2.33 3.11 -1.32 -2.88 116.57 116.45 2qbj h LYS 142 Ca 0.03 0.03 0.16 0.00 -2.81 0.00 0.00 60.65 58.06 2qbj h LYS 142 Cb 0.22 0.11 -0.11 0.00 -1.00 0.00 0.00 32.23 31.45 2qbj h LYS 142 CO -0.22 -0.33 0.16 -0.07 -2.81 0.00 0.00 179.45 176.19 2qbj h LEU 143 N -0.51 -0.00 -1.94 5.20 3.38 -0.84 0.19 115.31 120.79 2qbj h LEU 143 Ca 0.01 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.11 2qbj h LEU 143 Cb 0.50 0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2qbj h LEU 143 CO -0.11 -0.04 -0.07 -0.33 0.09 0.00 0.00 178.44 177.98 2qbj h GLU 144 N 0.26 0.00 -0.15 1.13 3.07 -0.55 1.20 114.58 119.55 2qbj h GLU 144 Ca 0.40 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 59.10 2qbj h GLU 144 Cb 0.68 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.60 2qbj h GLU 144 CO -0.51 0.07 -0.55 -0.91 -1.40 0.00 0.00 179.01 175.71 2qbj h ASN 145 N 0.00 0.74 0.36 1.42 -0.26 -0.45 -0.11 115.58 117.27 2qbj h ASN 145 Ca -0.00 -0.61 0.00 0.00 -0.56 0.00 0.00 56.30 55.13 2qbj h ASN 145 Cb 0.13 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 37.17 2qbj h ASN 145 CO 0.01 1.23 -0.98 -1.54 -1.06 0.00 0.00 177.43 175.09 2qbj n SER 146 N -4.15 0.64 0.01 5.81 3.41 -0.71 -3.97 113.62 114.65 2qbj n SER 146 Ca -0.07 -0.33 0.00 0.00 -0.26 0.00 0.00 58.87 58.21 2qbj n SER 146 Cb 0.62 0.79 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 2qbj n SER 146 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qbj n LEU 147 N -1.84 0.07 -0.19 1.04 4.77 0.41 -4.81 117.00 116.46 2qbj n LEU 147 Ca 0.03 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 2qbj n LEU 147 Cb 0.41 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.52 2qbj n LEU 147 CO 0.40 -0.18 0.30 0.61 -1.33 0.00 0.00 177.39 177.19 2qbj n GLY 148 N 2.67 -0.97 0.19 -0.72 0.00 -0.06 0.23 105.19 106.53 2qbj n GLY 148 Ca 0.00 0.55 0.11 0.00 0.00 0.00 0.00 46.02 46.67 2qbj n GLY 148 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2qbj h GLY 149 N 0.00 0.00 0.00 -0.02 0.00 -1.74 -2.32 103.07 98.99 2qbj h GLY 149 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.52 2qbj h GLY 149 CO -0.49 0.00 0.00 4.51 0.00 0.00 0.00 176.54 180.56 2qbj n ILE 150 N -2.29 0.00 -0.22 2.60 3.06 0.63 -2.29 119.36 120.85 2qbj n ILE 150 Ca -0.01 -0.17 0.09 0.00 -2.50 0.00 0.00 62.75 60.15 2qbj n ILE 150 Cb 0.15 1.12 0.17 0.00 0.54 0.00 0.00 39.64 41.62 2qbj n ILE 150 CO 0.00 0.00 0.00 2.29 -2.50 0.00 0.00 176.55 176.34 2qbj n LYS 151 N -0.28 -0.05 -3.06 9.51 2.85 0.56 -3.23 118.16 124.45 2qbj n LYS 151 Ca 0.00 0.96 -0.45 0.00 -1.05 0.00 0.00 58.31 57.77 2qbj n LYS 151 Cb 0.03 -1.51 -0.04 0.00 -0.65 0.00 0.00 35.03 32.87 2qbj n LYS 151 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 2qbj s ASP 152 N -5.03 6.32 0.00 -5.58 1.01 -1.26 -4.78 116.67 107.35 2qbj s ASP 152 Ca -0.08 -1.61 0.00 0.00 0.71 0.00 0.00 52.55 51.57 2qbj s ASP 152 Cb 0.18 -2.33 0.00 0.00 1.01 0.00 0.00 42.92 41.79 2qbj s ASP 152 CO 0.49 -1.10 0.00 0.80 0.21 0.00 0.00 175.17 175.57 2qbj n MET 153 N 6.34 0.00 -0.94 8.23 1.56 -1.20 -5.06 117.12 126.05 2qbj n MET 153 Ca -0.00 0.00 -0.35 0.00 -0.27 0.00 0.00 57.70 57.08 2qbj n MET 153 Cb 0.45 0.00 -0.05 0.00 2.15 0.00 0.00 33.22 35.77 2qbj n MET 153 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2qbj n GLY 154 N 0.00 2.59 0.00 -5.12 0.00 -1.26 -4.70 105.19 96.70 2qbj n GLY 154 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.95 2qbj n GLY 154 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qbj n GLY 155 N 4.29 3.85 3.62 -0.02 0.00 -1.26 -5.13 105.19 110.55 2qbj n GLY 155 Ca 0.46 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.98 2qbj n GLY 155 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2qbj n LEU 156 N 0.00 3.56 -4.77 0.99 4.32 -1.26 -4.96 117.00 114.88 2qbj n LEU 156 Ca 0.00 0.88 -0.32 0.00 -0.02 0.00 0.00 56.01 56.55 2qbj n LEU 156 Cb 0.00 -1.40 0.08 0.00 -1.62 0.00 0.00 43.42 40.48 2qbj n LEU 156 CO 0.00 -1.66 0.71 -2.16 -1.22 0.00 0.00 177.39 173.06 2qbj s PRO 157 N -2.57 2.41 -0.08 3.23 0.04 -1.26 -4.99 135.00 131.77 2qbj s PRO 157 Ca 0.72 1.23 -0.27 0.00 0.04 0.00 0.00 61.00 62.72 2qbj s PRO 157 Cb -0.45 -1.91 -0.24 0.00 0.04 0.00 0.00 34.50 31.94 2qbj s PRO 157 CO 0.50 -1.53 0.99 -0.44 0.04 0.00 0.00 177.00 176.55 2qbj h ASP 158 N -0.82 0.07 -4.19 6.66 3.45 -1.52 -3.48 116.42 116.60 2qbj h ASP 158 Ca -0.44 -0.79 -0.54 0.00 0.43 0.00 0.00 57.03 55.69 2qbj h ASP 158 Cb 1.23 -0.02 -0.13 0.00 -0.56 0.00 0.00 39.33 39.85 2qbj h ASP 158 CO 0.52 0.85 -0.49 0.00 -1.57 0.00 0.00 179.24 178.55 2qbj s ALA 159 N -3.07 2.61 -0.13 3.45 0.00 -0.58 -4.43 121.76 119.61 2qbj s ALA 159 Ca -0.17 -1.49 -0.05 0.00 0.00 0.00 0.00 51.96 50.25 2qbj s ALA 159 Cb -0.01 1.04 0.06 0.00 0.00 0.00 0.00 23.12 24.22 2qbj s ALA 159 CO 0.70 -0.47 0.27 -1.17 0.00 0.00 0.00 175.76 175.09 2qbj s LEU 160 N -3.54 -0.16 -0.27 0.00 2.96 -0.26 -3.11 118.68 114.30 2qbj s LEU 160 Ca 0.29 0.60 0.02 0.00 -0.22 0.00 0.00 54.13 54.82 2qbj s LEU 160 Cb 0.02 0.74 0.07 0.00 0.50 0.00 0.00 46.19 47.51 2qbj s LEU 160 CO 0.20 -0.22 -0.05 0.12 -1.32 0.00 0.00 176.35 175.08 2qbj s PHE 161 N 2.16 3.01 0.06 5.38 2.19 -0.92 0.75 117.98 130.62 2qbj s PHE 161 Ca -0.01 -2.25 0.04 0.00 0.33 0.00 0.00 56.93 55.04 2qbj s PHE 161 Cb -0.12 -2.01 -0.04 0.00 -1.31 0.00 0.00 43.02 39.55 2qbj s PHE 161 CO -0.09 -0.86 -0.02 0.54 1.83 0.00 0.00 175.22 176.62 2qbj s VAL 162 N 1.18 3.93 0.00 3.12 0.11 0.12 -0.47 120.40 128.39 2qbj s VAL 162 Ca -0.03 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.11 2qbj s VAL 162 Cb -0.19 -2.82 0.00 0.00 -1.53 0.00 0.00 36.38 31.84 2qbj s VAL 162 CO -0.07 0.21 0.67 0.00 -3.33 0.00 0.00 175.10 172.58 2qbj n ILE 163 N 0.89 0.00 -4.57 7.04 0.13 0.82 -3.33 119.36 120.34 2qbj n ILE 163 Ca -0.12 1.15 -0.34 0.00 -1.10 0.00 0.00 62.75 62.34 2qbj n ILE 163 Cb 0.52 -2.10 -0.12 0.00 -0.84 0.00 0.00 39.64 37.10 2qbj n ILE 163 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 2qbj s ASP 164 N -2.17 4.60 0.00 9.51 2.15 -1.26 -1.11 116.67 128.38 2qbj s ASP 164 Ca 0.00 -0.11 0.24 0.00 0.43 0.00 0.00 52.55 53.12 2qbj s ASP 164 Cb 0.00 -1.45 1.40 0.00 -0.30 0.00 0.00 42.92 42.57 2qbj s ASP 164 CO 0.00 0.27 1.91 0.00 -0.17 0.00 0.00 175.17 177.17 2qbj n ALA 165 N 2.88 2.63 -0.05 3.66 0.00 -1.26 -3.38 120.51 125.00 2qbj n ALA 165 Ca -0.18 -0.19 -0.04 0.00 0.00 0.00 0.00 53.44 53.04 2qbj n ALA 165 Cb 0.53 -1.37 -0.01 0.00 0.00 0.00 0.00 19.45 18.60 2qbj n ALA 165 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2qbj n ASP 166 N -0.77 1.05 0.27 0.00 8.00 -1.26 -3.54 116.55 120.30 2qbj n ASP 166 Ca 0.18 0.29 0.12 0.00 0.71 0.00 0.00 54.79 56.08 2qbj n ASP 166 Cb 0.11 -0.66 0.75 0.00 -0.02 0.00 0.00 41.12 41.29 2qbj n ASP 166 CO 0.00 0.00 0.00 -0.74 -0.39 0.00 0.00 177.20 176.07 2qbj h HIS 167 N -0.55 0.00 -0.59 1.24 2.76 -1.98 -1.48 115.15 114.55 2qbj h HIS 167 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2qbj h HIS 167 Cb 0.45 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.41 2qbj h HIS 167 CO -0.19 0.07 0.00 0.39 -1.30 0.00 0.00 177.93 176.90 2qbj n GLU 168 N -3.97 3.05 -0.27 5.26 -0.58 -1.22 -4.70 120.64 118.21 2qbj n GLU 168 Ca -0.03 -2.58 0.10 0.00 -0.42 0.00 0.00 57.16 54.23 2qbj n GLU 168 Cb 0.16 -1.60 0.20 0.00 -0.57 0.00 0.00 31.44 29.63 2qbj n GLU 168 CO 0.00 0.00 0.00 -2.39 -0.48 0.00 0.00 177.13 174.26 2qbj n HIS 169 N 1.10 0.44 -0.15 -0.32 1.44 -0.56 -0.05 115.22 117.13 2qbj n HIS 169 Ca 0.21 0.94 -0.04 0.00 -2.01 0.00 0.00 57.72 56.82 2qbj n HIS 169 Cb 0.66 -1.05 0.02 0.00 0.12 0.00 0.00 29.99 29.74 2qbj n HIS 169 CO 0.00 0.00 0.00 0.82 -2.81 0.00 0.00 176.34 174.35 2qbj h ILE 170 N 0.00 0.35 -0.03 0.61 1.08 -1.84 -2.06 117.51 115.62 2qbj h ILE 170 Ca 0.45 0.00 0.03 0.00 -0.39 0.00 0.00 64.86 64.95 2qbj h ILE 170 Cb 0.87 0.35 -0.04 0.00 -3.07 0.00 0.00 36.82 34.93 2qbj h ILE 170 CO -0.75 0.00 -0.21 0.00 -0.69 0.00 0.00 178.15 176.51 2qbj h ALA 171 N 1.20 -0.24 -0.72 1.87 0.00 -0.83 -2.48 119.26 118.05 2qbj h ALA 171 Ca 0.22 0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.29 2qbj h ALA 171 Cb 0.47 0.37 -0.10 0.00 0.00 0.00 0.00 17.79 18.53 2qbj h ALA 171 CO -0.55 -0.69 0.23 0.82 0.00 0.00 0.00 179.25 179.06 2qbj h ILE 172 N -0.31 0.60 -0.25 0.00 5.03 -1.32 -1.63 117.51 119.64 2qbj h ILE 172 Ca 0.07 -0.12 0.05 0.00 -0.12 0.00 0.00 64.86 64.74 2qbj h ILE 172 Cb 0.41 0.22 -0.05 0.00 -3.03 0.00 0.00 36.82 34.37 2qbj h ILE 172 CO -0.21 0.06 -0.05 0.50 -0.68 0.00 0.00 178.15 177.77 2qbj h LYS 173 N 0.35 0.01 -0.74 2.37 3.11 -0.94 -2.34 116.57 118.40 2qbj h LYS 173 Ca 0.40 -0.00 -0.03 0.00 -2.81 0.00 0.00 60.65 58.21 2qbj h LYS 173 Cb 0.64 -0.00 -0.03 0.00 -1.00 0.00 0.00 32.23 31.83 2qbj h LYS 173 CO -0.44 0.01 0.32 0.93 -2.81 0.00 0.00 179.45 177.46 2qbj h GLU 174 N 0.01 1.08 0.00 1.90 5.08 -1.16 -2.74 114.58 118.76 2qbj h GLU 174 Ca 0.12 -0.18 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 2qbj h GLU 174 Cb 0.18 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.24 2qbj h GLU 174 CO -0.24 0.87 0.00 0.00 -1.00 0.00 0.00 179.01 178.63 2qbj n ALA 175 N -2.40 -0.27 0.21 3.43 0.00 -0.68 -1.70 120.51 119.10 2qbj n ALA 175 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.61 2qbj n ALA 175 Cb 0.16 0.17 0.59 0.00 0.00 0.00 0.00 19.45 20.37 2qbj n ALA 175 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 2qbj h ASN 176 N 0.00 0.00 1.56 0.00 7.08 -1.55 0.64 115.58 123.32 2qbj h ASN 176 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 2qbj h ASN 176 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.24 2qbj h ASN 176 CO 0.00 0.00 -0.22 -1.13 -2.08 0.00 0.00 177.43 174.00 2qbj h ASN 177 N 0.00 0.00 -0.01 6.14 -0.73 -1.04 -3.21 115.58 116.73 2qbj h ASN 177 Ca 0.00 -0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.14 2qbj h ASN 177 Cb 0.33 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.92 2qbj h ASN 177 CO 0.00 0.01 -0.22 0.18 -0.37 0.00 0.00 177.43 177.03 2qbj n LEU 178 N -2.67 1.31 -0.15 0.34 4.77 0.21 -4.98 117.00 115.82 2qbj n LEU 178 Ca 0.04 -0.78 0.00 0.00 -0.03 0.00 0.00 56.01 55.24 2qbj n LEU 178 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2qbj n LEU 178 CO 0.34 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 2qbj n GLY 179 N 0.92 0.74 3.50 -0.72 0.00 -0.15 -5.04 105.19 104.43 2qbj n GLY 179 Ca 0.05 -0.70 -0.40 0.00 0.00 0.00 0.00 46.02 44.97 2qbj n GLY 179 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qbj s ILE 180 N -2.31 5.14 0.21 -0.61 -1.09 -0.52 -4.97 121.20 117.05 2qbj s ILE 180 Ca 0.00 -0.33 -0.32 0.00 -2.23 0.00 0.00 60.65 57.78 2qbj s ILE 180 Cb 0.00 -3.67 -0.15 0.00 -1.58 0.00 0.00 42.46 37.06 2qbj s ILE 180 CO 0.00 -0.04 1.17 -2.65 -1.23 0.00 0.00 174.94 172.19 2qbj n PRO 181 N 5.09 1.34 -4.91 2.79 -0.02 -1.26 -3.94 135.00 134.08 2qbj n PRO 181 Ca -0.13 0.47 -0.33 0.00 -2.02 0.00 0.00 63.50 61.50 2qbj n PRO 181 Cb 0.49 -1.97 -0.15 0.00 -0.02 0.00 0.00 33.50 31.85 2qbj n PRO 181 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2qbj s VAL 182 N -0.35 2.71 -0.21 -1.45 1.01 -1.26 -1.10 120.40 119.74 2qbj s VAL 182 Ca 0.69 -0.78 0.01 0.00 0.00 0.00 0.00 61.98 61.90 2qbj s VAL 182 Cb -0.79 -2.11 0.04 0.00 0.00 0.00 0.00 36.38 33.53 2qbj s VAL 182 CO 0.53 0.54 -0.12 -0.36 0.00 0.00 0.00 175.10 175.69 2qbj s PHE 183 N 0.37 2.70 0.03 5.22 0.40 0.23 -2.50 117.98 124.43 2qbj s PHE 183 Ca -0.13 -1.81 -0.04 0.00 -0.60 0.00 0.00 56.93 54.35 2qbj s PHE 183 Cb -0.17 -1.76 -0.01 0.00 0.51 0.00 0.00 43.02 41.59 2qbj s PHE 183 CO 0.06 -0.79 0.06 0.00 0.70 0.00 0.00 175.22 175.25 2qbj s ALA 184 N 1.30 0.00 -0.92 5.36 0.00 -1.22 0.14 121.76 126.42 2qbj s ALA 184 Ca -0.03 -0.57 -0.15 0.00 0.00 0.00 0.00 51.96 51.21 2qbj s ALA 184 Cb -0.17 0.21 0.20 0.00 0.00 0.00 0.00 23.12 23.36 2qbj s ALA 184 CO -0.08 -0.27 0.97 0.42 0.00 0.00 0.00 175.76 176.80 2qbj s ILE 185 N -2.33 5.36 0.46 0.00 1.01 -0.27 -2.23 121.20 123.19 2qbj s ILE 185 Ca -0.07 -2.35 -0.11 0.00 0.00 0.00 0.00 60.65 58.12 2qbj s ILE 185 Cb -0.03 -4.61 -0.06 0.00 0.01 0.00 0.00 42.46 37.76 2qbj s ILE 185 CO -0.04 -1.24 0.84 0.68 0.00 0.00 0.00 174.94 175.19 2qbj s VAL 186 N 0.83 4.74 -0.23 2.92 -7.23 -0.85 -4.47 120.40 116.10 2qbj s VAL 186 Ca 0.26 0.73 -0.20 0.00 -1.81 0.00 0.00 61.98 60.96 2qbj s VAL 186 Cb -0.08 -3.76 0.06 0.00 0.56 0.00 0.00 36.38 33.17 2qbj s VAL 186 CO -0.08 -0.65 0.62 1.51 -0.31 0.00 0.00 175.10 176.18 2qbj s ASP 187 N -3.33 -0.67 0.00 4.85 -4.77 -1.25 -0.41 116.67 111.08 2qbj s ASP 187 Ca 0.53 1.26 0.00 0.00 -3.30 0.00 0.00 52.55 51.04 2qbj s ASP 187 Cb -0.10 1.25 0.00 0.00 -1.09 0.00 0.00 42.92 42.98 2qbj s ASP 187 CO 0.35 -0.22 0.00 0.35 0.70 0.00 0.00 175.17 176.35 2qbj n THR 188 N 2.99 0.00 0.61 2.11 -2.24 -1.26 0.02 114.28 116.51 2qbj n THR 188 Ca -0.15 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2qbj n THR 188 Cb 0.56 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.79 2qbj n THR 188 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 2qbj n ASN 189 N 0.01 1.48 -4.39 3.42 6.94 -1.26 -1.78 115.26 119.68 2qbj n ASN 189 Ca 0.00 -1.22 -0.24 0.00 -0.02 0.00 0.00 54.58 53.11 2qbj n ASN 189 Cb 0.00 -0.30 -0.01 0.00 -2.36 0.00 0.00 39.78 37.10 2qbj n ASN 189 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 2qbj n SER 190 N 0.56 2.66 -3.86 0.53 7.64 0.10 -4.90 113.62 116.34 2qbj n SER 190 Ca 0.00 -2.68 -0.30 0.00 1.01 0.00 0.00 58.87 56.90 2qbj n SER 190 Cb 0.26 0.04 -0.15 0.00 -1.01 0.00 0.00 64.21 63.35 2qbj n SER 190 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2qbj s ASP 191 N -3.67 4.03 0.36 6.43 -1.08 -1.26 -4.76 116.67 116.73 2qbj s ASP 191 Ca 0.20 -1.53 0.18 0.00 -0.52 0.00 0.00 52.55 50.88 2qbj s ASP 191 Cb -0.02 -1.11 0.59 0.00 -1.46 0.00 0.00 42.92 40.92 2qbj s ASP 191 CO 0.13 -0.34 1.69 1.55 0.52 0.00 0.00 175.17 178.72 2qbj h PRO 192 N 7.96 0.00 -0.97 4.34 0.13 -1.92 -3.29 132.00 138.25 2qbj h PRO 192 Ca -0.13 0.00 0.11 0.00 -0.87 0.00 0.00 66.00 65.11 2qbj h PRO 192 Cb 1.04 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.10 2qbj h PRO 192 CO 0.45 0.41 0.62 -0.44 -0.23 0.00 0.00 178.00 178.81 2qbj h ASP 193 N 0.00 0.88 0.00 1.44 3.32 -1.94 -3.26 116.42 116.86 2qbj h ASP 193 Ca -0.00 0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2qbj h ASP 193 Cb 0.97 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.38 2qbj h ASP 193 CO 0.05 0.48 0.00 0.61 -1.72 0.00 0.00 179.24 178.67 2qbj n GLY 194 N -1.37 -2.97 3.59 2.75 0.00 -1.24 -4.73 105.19 101.22 2qbj n GLY 194 Ca 0.18 0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 2qbj n GLY 194 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2qbj n VAL 195 N -0.50 2.38 0.54 1.61 0.31 -1.23 -4.91 118.33 116.53 2qbj n VAL 195 Ca 0.00 -0.50 0.11 0.00 -0.01 0.00 0.00 64.34 63.94 2qbj n VAL 195 Cb 0.00 -1.08 0.03 0.00 -0.91 0.00 0.00 33.84 31.88 2qbj n VAL 195 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 2qbj n ASP 196 N 0.60 0.62 -3.91 4.52 5.68 -1.23 -4.65 116.55 118.18 2qbj n ASP 196 Ca 0.10 -0.15 -0.30 0.00 -0.50 0.00 0.00 54.79 53.93 2qbj n ASP 196 Cb 0.39 0.74 -0.14 0.00 -1.14 0.00 0.00 41.12 40.97 2qbj n ASP 196 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 2qbj s PHE 197 N -3.21 3.00 0.39 2.11 0.08 -1.04 -5.03 117.98 114.28 2qbj s PHE 197 Ca 0.04 -2.91 -0.26 0.00 0.12 0.00 0.00 56.93 53.91 2qbj s PHE 197 Cb 0.14 -2.60 -0.09 0.00 -0.57 0.00 0.00 43.02 39.90 2qbj s PHE 197 CO 0.80 -0.80 1.28 0.08 -0.10 0.00 0.00 175.22 176.47 2qbj s VAL 198 N 0.21 2.72 -0.40 -0.44 1.01 -1.26 -3.39 120.40 118.85 2qbj s VAL 198 Ca 0.15 0.66 0.08 0.00 0.00 0.00 0.00 61.98 62.87 2qbj s VAL 198 Cb -0.24 -3.39 0.24 0.00 0.00 0.00 0.00 36.38 32.99 2qbj s VAL 198 CO -0.03 0.11 0.56 -0.38 0.00 0.00 0.00 175.10 175.35 2qbj n ILE 199 N 0.28 -0.63 -1.54 2.22 5.41 -0.95 -4.74 119.36 119.40 2qbj n ILE 199 Ca 0.03 -3.64 -0.26 0.00 1.00 0.00 0.00 62.75 59.89 2qbj n ILE 199 Cb 0.44 -1.48 -0.08 0.00 -0.71 0.00 0.00 39.64 37.80 2qbj n ILE 199 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 2qbj n PRO 200 N 1.53 0.60 -3.70 0.38 -0.04 -1.23 -2.00 135.00 130.53 2qbj n PRO 200 Ca 0.20 -0.35 -0.10 0.00 -0.04 0.00 0.00 63.50 63.21 2qbj n PRO 200 Cb 0.54 -3.04 -0.05 0.00 -0.04 0.00 0.00 33.50 30.92 2qbj n PRO 200 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2qbj s GLY 201 N 9.86 -0.14 -0.36 0.55 0.00 0.46 -4.88 107.32 112.81 2qbj s GLY 201 Ca 1.04 -0.21 -0.42 0.00 0.00 0.00 0.00 44.72 45.14 2qbj s GLY 201 CO 0.25 -0.39 1.78 -2.01 0.00 0.00 0.00 173.10 172.73 2qbj n ASN 202 N -0.24 1.97 0.33 1.64 4.05 -1.24 -3.92 115.26 117.85 2qbj n ASN 202 Ca -0.14 1.02 0.21 0.00 0.45 0.00 0.00 54.58 56.12 2qbj n ASN 202 Cb 0.63 -1.07 1.15 0.00 1.23 0.00 0.00 39.78 41.72 2qbj n ASN 202 CO 0.00 0.00 0.00 -2.24 -3.05 0.00 0.00 177.26 171.97 2qbj h ASP 203 N 7.23 0.00 0.00 1.20 2.03 -1.88 -3.44 116.42 121.56 2qbj h ASP 203 Ca -0.42 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.88 2qbj h ASP 203 Cb 1.34 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.84 2qbj h ASP 203 CO 0.98 0.00 0.00 -0.67 -1.03 0.00 0.00 179.24 178.52 2qbj n ASP 204 N -3.26 0.00 -1.36 4.15 2.03 -1.26 -4.60 116.55 112.25 2qbj n ASP 204 Ca -0.03 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.28 2qbj n ASP 204 Cb 0.08 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.48 2qbj n ASP 204 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2qbj n ALA 205 N -3.00 -2.38 0.11 -1.67 0.00 -1.26 -3.90 120.51 108.41 2qbj n ALA 205 Ca 0.00 0.31 0.18 0.00 0.00 0.00 0.00 53.44 53.93 2qbj n ALA 205 Cb 0.00 -1.12 0.75 0.00 0.00 0.00 0.00 19.45 19.08 2qbj n ALA 205 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2qbj h ILE 206 N 2.39 0.59 0.00 0.00 1.08 -1.99 -2.68 117.51 116.90 2qbj h ILE 206 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2qbj h ILE 206 Cb 0.00 0.78 0.00 0.00 -3.07 0.00 0.00 36.82 34.53 2qbj h ILE 206 CO 0.00 0.00 -0.01 -0.09 -0.69 0.00 0.00 178.15 177.36 2qbj h ARG 207 N 0.00 0.00 -1.04 2.37 9.65 -1.85 -3.25 114.38 120.27 2qbj h ARG 207 Ca 0.16 0.00 0.37 0.00 -1.10 0.00 0.00 59.98 59.41 2qbj h ARG 207 Cb 0.74 0.00 -0.16 0.00 -1.39 0.00 0.00 29.97 29.17 2qbj h ARG 207 CO -0.00 0.00 0.59 0.00 2.80 0.00 0.00 179.97 183.36 2qbj h ALA 208 N -1.22 2.13 0.16 2.80 0.00 -1.70 0.33 119.26 121.76 2qbj h ALA 208 Ca 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2qbj h ALA 208 Cb 0.01 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2qbj h ALA 208 CO 0.00 -0.81 -0.08 -0.39 0.00 0.00 0.00 179.25 177.98 2qbj h VAL 209 N 0.17 0.00 -0.67 0.00 -1.51 -1.60 -2.93 116.25 109.73 2qbj h VAL 209 Ca 0.79 -0.08 0.08 0.00 -1.23 0.00 0.00 66.70 66.26 2qbj h VAL 209 Cb 1.99 0.00 -0.06 0.00 -2.13 0.00 0.00 31.29 31.09 2qbj h VAL 209 CO -0.65 0.00 0.33 0.71 -1.23 0.00 0.00 177.57 176.74 2qbj h THR 210 N -0.29 0.88 -0.16 7.19 1.35 -1.47 0.13 112.91 120.53 2qbj h THR 210 Ca -0.02 -0.20 0.02 0.00 -0.55 0.00 0.00 66.41 65.66 2qbj h THR 210 Cb 0.16 0.24 -0.03 0.00 -1.73 0.00 0.00 68.15 66.79 2qbj h THR 210 CO 0.04 0.11 -0.24 0.25 -0.25 0.00 0.00 175.52 175.43 2qbj h LEU 211 N 0.59 -0.79 -0.86 3.87 7.12 -0.45 -1.51 115.31 123.28 2qbj h LEU 211 Ca 0.32 0.10 -0.12 0.00 0.13 0.00 0.00 57.88 58.31 2qbj h LEU 211 Cb 0.30 0.32 -0.01 0.00 -0.53 0.00 0.00 40.66 40.74 2qbj h LEU 211 CO -0.24 -0.17 -0.50 0.22 -0.13 0.00 0.00 178.44 177.62 2qbj h TYR 212 N -0.18 0.21 0.04 1.25 3.20 -1.39 -1.88 116.97 118.23 2qbj h TYR 212 Ca 0.03 -0.07 0.02 0.00 3.14 0.00 0.00 58.73 61.86 2qbj h TYR 212 Cb 0.26 -0.04 -0.05 0.00 1.54 0.00 0.00 36.73 38.43 2qbj h TYR 212 CO -0.64 0.64 -0.46 -0.07 -1.64 0.00 0.00 178.16 175.99 2qbj h LEU 213 N 0.14 -1.40 -0.76 2.82 3.38 -0.17 0.33 115.31 119.65 2qbj h LEU 213 Ca 0.01 0.16 -0.13 0.00 0.09 0.00 0.00 57.88 58.01 2qbj h LEU 213 Cb 0.93 0.53 -0.01 0.00 0.09 0.00 0.00 40.66 42.20 2qbj h LEU 213 CO 0.07 -0.49 -0.45 1.23 0.09 0.00 0.00 178.44 178.89 2qbj h GLY 214 N -0.64 0.42 0.54 0.83 0.00 -1.33 -1.21 103.07 101.69 2qbj h GLY 214 Ca 0.03 -0.43 0.10 0.00 0.00 0.00 0.00 47.33 47.03 2qbj h GLY 214 CO -0.31 0.39 0.63 0.00 0.00 0.00 0.00 176.54 177.24 2qbj h ALA 215 N 1.21 1.46 0.16 3.60 0.00 -0.44 0.85 119.26 126.11 2qbj h ALA 215 Ca 0.02 0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.63 2qbj h ALA 215 Cb 0.92 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 18.49 2qbj h ALA 215 CO 0.08 0.27 -1.46 -0.39 0.00 0.00 0.00 179.25 177.75 2qbj h VAL 216 N 1.03 1.26 -0.03 0.00 -1.51 -0.21 -3.17 116.25 113.62 2qbj h VAL 216 Ca 0.47 -2.82 0.03 0.00 -1.23 0.00 0.00 66.70 63.15 2qbj h VAL 216 Cb 0.40 2.88 -0.03 0.00 -2.13 0.00 0.00 31.29 32.41 2qbj h VAL 216 CO -0.24 0.84 -0.13 0.00 -1.23 0.00 0.00 177.57 176.81 2qbj h ALA 217 N 0.39 -0.13 0.52 5.19 0.00 -0.42 -1.17 119.26 123.64 2qbj h ALA 217 Ca -0.23 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2qbj h ALA 217 Cb 2.05 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 20.08 2qbj h ALA 217 CO 0.20 -0.62 -0.37 0.00 0.00 0.00 0.00 179.25 178.47 2qbj h ALA 218 N 0.77 -1.14 -0.03 0.00 0.00 -0.99 0.17 119.26 118.04 2qbj h ALA 218 Ca 0.06 -0.17 0.01 0.00 0.00 0.00 0.00 54.91 54.80 2qbj h ALA 218 Cb 0.29 0.52 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 2qbj h ALA 218 CO -0.15 -1.12 0.56 1.79 0.00 0.00 0.00 179.25 180.32 2qbj h THR 219 N -0.85 0.01 0.02 0.00 1.35 -1.51 0.45 112.91 112.38 2qbj h THR 219 Ca -0.07 0.00 -0.19 0.00 -0.55 0.00 0.00 66.41 65.60 2qbj h THR 219 Cb 0.70 0.45 -0.02 0.00 -1.73 0.00 0.00 68.15 67.54 2qbj h THR 219 CO 0.04 0.00 -1.00 0.58 -0.25 0.00 0.00 175.52 174.88 2qbj h VAL 220 N 0.00 1.12 -0.10 6.82 2.07 -0.02 -2.76 116.25 123.38 2qbj h VAL 220 Ca 0.02 -2.24 -0.08 0.00 0.82 0.00 0.00 66.70 65.21 2qbj h VAL 220 Cb 1.13 2.55 -0.01 0.00 -1.52 0.00 0.00 31.29 33.44 2qbj h VAL 220 CO -0.00 0.44 -0.30 0.08 0.02 0.00 0.00 177.57 177.80 2qbj h ARG 221 N -0.90 0.20 0.00 1.57 0.11 0.15 -2.35 114.38 113.16 2qbj h ARG 221 Ca -0.27 -0.07 -0.13 0.00 0.10 0.00 0.00 59.98 59.61 2qbj h ARG 221 Cb 1.30 -0.01 -0.02 0.00 1.11 0.00 0.00 29.97 32.35 2qbj h ARG 221 CO -0.13 0.49 -0.63 0.93 0.10 0.00 0.00 179.97 180.73 2qbj h GLU 222 N 0.17 0.00 0.00 0.08 4.39 -0.38 -3.16 114.58 115.68 2qbj h GLU 222 Ca 0.02 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.68 2qbj h GLU 222 Cb 0.63 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.27 2qbj h GLU 222 CO 0.05 0.63 -0.20 0.78 -1.16 0.00 0.00 179.01 179.11 2qbj h GLY 223 N 2.72 0.00 -3.20 -3.84 0.00 -1.11 -3.08 103.07 94.57 2qbj h GLY 223 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.23 2qbj h GLY 223 CO 0.08 0.00 0.07 0.54 0.00 0.00 0.00 176.54 177.23 2qbj n ARG 224 N -3.57 1.26 -0.32 4.80 1.74 -1.16 -3.79 116.66 115.62 2qbj n ARG 224 Ca -0.01 -0.44 0.00 0.00 -0.77 0.00 0.00 57.85 56.63 2qbj n ARG 224 Cb 0.34 -1.22 0.00 0.00 -1.02 0.00 0.00 32.46 30.56 2qbj n ARG 224 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54