#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qgx h VAL 3 N 0.00 1.31 -0.03 2.46 2.07 -2.05 -3.09 116.25 116.92 2qgx h VAL 3 Ca 0.00 -2.92 -0.01 0.00 0.82 0.00 0.00 66.70 64.59 2qgx h VAL 3 Cb 0.00 2.84 -0.00 0.00 -1.52 0.00 0.00 31.29 32.61 2qgx h VAL 3 CO 0.00 0.85 -0.02 1.56 0.02 0.00 0.00 177.57 179.98 2qgx h GLN 4 N 0.07 0.08 -0.65 1.57 4.20 -2.02 -0.07 115.11 118.28 2qgx h GLN 4 Ca -0.19 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.46 2qgx h GLN 4 Cb 2.00 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.74 2qgx h GLN 4 CO 0.18 0.49 0.33 0.00 -0.67 0.00 0.00 178.83 179.16 2qgx h ALA 5 N 0.59 1.35 -0.15 3.87 0.00 -1.89 0.14 119.26 123.17 2qgx h ALA 5 Ca 0.01 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 2qgx h ALA 5 Cb 0.47 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 2qgx h ALA 5 CO 0.01 0.52 -0.08 1.15 0.00 0.00 0.00 179.25 180.84 2qgx h THR 6 N 0.92 1.32 -0.19 0.00 2.02 -1.49 -2.03 112.91 113.46 2qgx h THR 6 Ca 0.23 -1.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.25 2qgx h THR 6 Cb 0.07 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.22 2qgx h THR 6 CO -0.03 0.33 0.03 -0.78 0.37 0.00 0.00 175.52 175.44 2qgx h ASP 7 N -0.02 0.30 -0.63 4.18 -0.00 -0.74 -1.78 116.42 117.74 2qgx h ASP 7 Ca 0.03 -0.26 0.10 0.00 -0.00 0.00 0.00 57.03 56.90 2qgx h ASP 7 Cb 0.55 -0.08 -0.07 0.00 -0.00 0.00 0.00 39.33 39.73 2qgx h ASP 7 CO 0.02 0.49 0.24 -0.09 -0.00 0.00 0.00 179.24 179.90 2qgx h ARG 8 N 0.10 0.41 -0.71 0.28 9.65 -0.78 -0.25 114.38 123.10 2qgx h ARG 8 Ca 0.06 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 58.88 2qgx h ARG 8 Cb 0.32 -0.09 -0.03 0.00 -1.39 0.00 0.00 29.97 28.77 2qgx h ARG 8 CO 0.00 0.27 0.30 -0.07 2.80 0.00 0.00 179.97 183.27 2qgx h LEU 9 N 0.43 0.96 -0.86 3.80 3.38 -1.18 -2.02 115.31 119.82 2qgx h LEU 9 Ca 0.32 -0.16 -0.08 0.00 0.09 0.00 0.00 57.88 58.04 2qgx h LEU 9 Cb 0.40 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 2qgx h LEU 9 CO -0.31 0.86 -0.06 0.24 0.09 0.00 0.00 178.44 179.26 2qgx h MET 10 N 1.00 0.78 -0.37 1.13 2.86 -0.58 -2.45 114.93 117.31 2qgx h MET 10 Ca 0.24 -0.24 0.01 0.00 -2.06 0.00 0.00 59.70 57.65 2qgx h MET 10 Cb 0.19 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.75 2qgx h MET 10 CO -0.02 0.83 0.22 -0.22 1.06 0.00 0.00 176.91 178.78 2qgx h LYS 11 N 0.71 0.44 0.23 1.72 3.64 -0.71 -2.04 116.57 120.57 2qgx h LYS 11 Ca 0.13 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2qgx h LYS 11 Cb 0.53 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 2qgx h LYS 11 CO 0.03 0.29 -0.20 0.93 -2.27 0.00 0.00 179.45 178.23 2qgx h GLU 12 N 0.45 -0.44 -0.48 1.90 4.39 -1.06 -0.62 114.58 118.73 2qgx h GLU 12 Ca 0.14 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.87 2qgx h GLU 12 Cb -0.02 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.71 2qgx h GLU 12 CO -0.05 -0.29 0.31 1.25 -1.16 0.00 0.00 179.01 179.06 2qgx h LEU 13 N -0.45 0.56 -0.97 1.33 6.46 -1.40 0.88 115.31 121.71 2qgx h LEU 13 Ca -0.01 -0.02 -0.11 0.00 -0.12 0.00 0.00 57.88 57.63 2qgx h LEU 13 Cb 0.42 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.19 2qgx h LEU 13 CO -0.04 0.42 -0.43 0.03 -0.62 0.00 0.00 178.44 177.81 2qgx h ARG 14 N 0.66 0.18 0.35 1.25 2.47 -0.99 -1.67 114.38 116.63 2qgx h ARG 14 Ca 0.18 -0.09 -0.02 0.00 -1.26 0.00 0.00 59.98 58.79 2qgx h ARG 14 Cb -0.05 -0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.27 2qgx h ARG 14 CO -0.04 0.58 -0.17 -0.44 0.56 0.00 0.00 179.97 180.47 2qgx h ASP 15 N 0.15 -0.40 -1.00 7.04 3.32 0.56 -3.10 116.42 123.00 2qgx h ASP 15 Ca 0.01 -0.16 0.26 0.00 0.02 0.00 0.00 57.03 57.16 2qgx h ASP 15 Cb 0.82 0.10 -0.13 0.00 0.22 0.00 0.00 39.33 40.34 2qgx h ASP 15 CO 0.06 0.01 0.57 0.40 -1.72 0.00 0.00 179.24 178.56 2qgx h ILE 16 N -0.89 0.49 0.00 0.35 5.03 -0.83 0.61 117.51 122.27 2qgx h ILE 16 Ca -0.05 -0.18 -0.05 0.00 -0.12 0.00 0.00 64.86 64.46 2qgx h ILE 16 Cb 0.53 -0.08 -0.01 0.00 -3.03 0.00 0.00 36.82 34.24 2qgx h ILE 16 CO 0.08 0.10 -0.26 1.88 -0.68 0.00 0.00 178.15 179.27 2qgx h TYR 17 N 0.52 0.00 -0.41 1.37 0.05 -1.28 -2.78 116.97 114.44 2qgx h TYR 17 Ca 0.65 0.00 -0.12 0.00 0.05 0.00 0.00 58.73 59.31 2qgx h TYR 17 Cb 1.29 0.00 -0.07 0.00 1.01 0.00 0.00 36.73 38.96 2qgx h TYR 17 CO -0.02 0.26 0.05 0.54 -1.05 0.00 0.00 178.16 177.94 2qgx n ARG 18 N -4.17 2.63 -3.84 4.88 1.74 0.15 -4.77 116.66 113.28 2qgx n ARG 18 Ca -0.02 -3.01 -0.37 0.00 -0.77 0.00 0.00 57.85 53.68 2qgx n ARG 18 Cb 0.31 -1.91 -0.06 0.00 -1.02 0.00 0.00 32.46 29.78 2qgx n ARG 18 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2qgx s SER 19 N -1.97 6.43 0.62 0.55 1.04 -0.85 -4.97 113.70 114.54 2qgx s SER 19 Ca 0.46 0.51 0.39 0.00 0.48 0.00 0.00 55.95 57.79 2qgx s SER 19 Cb 0.39 -2.09 2.06 0.00 0.10 0.00 0.00 66.02 66.48 2qgx s SER 19 CO 0.07 0.40 2.26 1.56 0.98 0.00 0.00 173.24 178.51 2qgx h GLN 20 N 4.97 0.00 -0.49 4.02 1.08 -1.92 -0.58 115.11 122.18 2qgx h GLN 20 Ca -0.55 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 56.60 2qgx h GLN 20 Cb 1.23 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.64 2qgx h GLN 20 CO 0.58 0.02 0.10 0.77 -0.95 0.00 0.00 178.83 179.35 2qgx h SER 21 N 0.00 0.77 1.14 1.46 0.02 -1.93 -0.63 113.55 114.38 2qgx h SER 21 Ca -0.00 -0.25 -0.15 0.00 -0.84 0.00 0.00 61.79 60.56 2qgx h SER 21 Cb 0.12 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 2qgx h SER 21 CO 0.00 0.82 -0.90 0.15 -1.14 0.00 0.00 176.83 175.76 2qgx h PHE 22 N 0.69 0.00 -0.01 3.45 3.57 -1.45 -2.52 116.94 120.67 2qgx h PHE 22 Ca 0.15 0.00 -0.18 0.00 3.53 0.00 0.00 57.97 61.47 2qgx h PHE 22 Cb 0.37 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.09 2qgx h PHE 22 CO 0.03 0.61 -0.80 0.87 -2.23 0.00 0.00 178.31 176.78 2qgx h LYS 23 N 0.00 0.15 0.00 1.11 1.57 -1.08 -3.17 116.57 115.14 2qgx h LYS 23 Ca -0.07 -0.14 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2qgx h LYS 23 Cb 1.52 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.87 2qgx h LYS 23 CO 0.07 0.87 0.00 0.41 -0.57 0.00 0.00 179.45 180.22 2qgx n GLY 24 N 0.71 -1.14 1.79 3.86 0.00 -0.25 -4.88 105.19 105.28 2qgx n GLY 24 Ca -0.03 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2qgx n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qgx n GLY 25 N 1.10 0.46 0.22 -0.02 0.00 -1.20 -4.94 105.19 100.81 2qgx n GLY 25 Ca 0.18 -0.96 0.07 0.00 0.00 0.00 0.00 46.02 45.31 2qgx n GLY 25 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2qgx h ASN 26 N 0.00 0.00 -1.27 1.61 -0.26 -1.69 -3.14 115.58 110.83 2qgx h ASN 26 Ca 0.00 0.00 0.02 0.00 -0.56 0.00 0.00 56.30 55.76 2qgx h ASN 26 Cb 0.14 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.39 2qgx h ASN 26 CO 0.00 0.26 0.12 0.00 -1.06 0.00 0.00 177.43 176.76 2qgx n TYR 27 N -3.89 -1.02 -3.83 1.19 0.18 -1.26 -0.37 117.16 108.16 2qgx n TYR 27 Ca -0.02 -0.40 -0.09 0.00 1.88 0.00 0.00 57.90 59.27 2qgx n TYR 27 Cb 0.34 0.20 -0.07 0.00 -0.38 0.00 0.00 39.34 39.43 2qgx n TYR 27 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2qgx s ALA 28 N -1.28 -0.32 -0.10 -3.48 0.00 -0.16 -4.80 121.76 111.62 2qgx s ALA 28 Ca 0.05 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.49 2qgx s ALA 28 Cb -0.01 0.50 0.02 0.00 0.00 0.00 0.00 23.12 23.64 2qgx s ALA 28 CO 0.02 -0.52 -0.08 0.08 0.00 0.00 0.00 175.76 175.26 2qgx s VAL 29 N -3.80 1.05 -0.21 0.00 1.01 -1.26 -2.29 120.40 114.89 2qgx s VAL 29 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 61.98 61.70 2qgx s VAL 29 Cb 0.04 -1.04 0.05 0.00 0.00 0.00 0.00 36.38 35.43 2qgx s VAL 29 CO -0.11 0.37 -0.06 -1.61 0.00 0.00 0.00 175.10 173.68 2qgx s GLU 30 N 1.52 1.67 -1.01 2.72 0.41 -0.32 -4.95 118.70 118.74 2qgx s GLU 30 Ca 0.01 -0.87 -0.24 0.00 -0.41 0.00 0.00 54.97 53.47 2qgx s GLU 30 Cb -0.13 -2.45 -0.07 0.00 -1.78 0.00 0.00 34.13 29.71 2qgx s GLU 30 CO -0.06 -0.53 1.96 -0.51 -0.49 0.00 0.00 175.26 175.62 2qgx s LEU 31 N 1.44 3.10 -0.16 1.80 1.43 -1.26 -0.22 118.68 124.81 2qgx s LEU 31 Ca -0.04 -1.03 -0.38 0.00 -1.03 0.00 0.00 54.13 51.66 2qgx s LEU 31 Cb -0.18 -2.57 -0.15 0.00 0.03 0.00 0.00 46.19 43.33 2qgx s LEU 31 CO -0.07 -2.93 1.72 0.55 0.23 0.00 0.00 176.35 175.85 2qgx n VAL 32 N 7.89 0.32 -2.73 -1.59 3.14 -0.79 -0.01 118.33 124.57 2qgx n VAL 32 Ca 0.42 -0.06 -0.18 0.00 -2.96 0.00 0.00 64.34 61.56 2qgx n VAL 32 Cb 0.47 -1.35 0.02 0.00 -1.06 0.00 0.00 33.84 31.91 2qgx n VAL 32 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 2qgx n ASN 33 N 5.23 -5.29 0.00 6.55 3.02 -1.26 -2.21 115.26 121.31 2qgx n ASN 33 Ca 0.24 -0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.61 2qgx n ASN 33 Cb 0.19 -4.19 0.00 0.00 -0.61 0.00 0.00 39.78 35.16 2qgx n ASN 33 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2qgx n ASP 34 N -1.65 -1.47 -4.70 6.41 10.43 0.99 -4.90 116.55 121.66 2qgx n ASP 34 Ca -0.13 0.00 -0.42 0.00 2.57 0.00 0.00 54.79 56.81 2qgx n ASP 34 Cb 0.62 -2.52 -0.03 0.00 1.84 0.00 0.00 41.12 41.03 2qgx n ASP 34 CO 0.00 0.00 0.00 -0.55 -1.07 0.00 0.00 177.20 175.58 2qgx s SER 35 N -2.07 6.75 0.00 -2.24 0.15 -0.94 -4.87 113.70 110.48 2qgx s SER 35 Ca 0.00 2.36 0.30 0.00 0.70 0.00 0.00 55.95 59.31 2qgx s SER 35 Cb 0.00 -2.58 1.44 0.00 -1.71 0.00 0.00 66.02 63.17 2qgx s SER 35 CO 0.00 -0.74 2.02 -0.11 1.20 0.00 0.00 173.24 175.61 2qgx n LEU 36 N 4.59 0.00 -0.51 3.45 -0.00 -1.26 -3.21 117.00 120.06 2qgx n LEU 36 Ca 0.13 0.35 0.05 0.00 -0.00 0.00 0.00 56.01 56.54 2qgx n LEU 36 Cb 0.42 -0.35 0.08 0.00 -0.00 0.00 0.00 43.42 43.57 2qgx n LEU 36 CO 0.60 0.00 0.50 -1.22 -0.00 0.00 0.00 177.39 177.27 2qgx n TYR 37 N -1.35 0.17 -3.65 1.96 4.01 -1.26 -4.88 117.16 112.15 2qgx n TYR 37 Ca 0.12 -0.18 -0.28 0.00 -0.16 0.00 0.00 57.90 57.40 2qgx n TYR 37 Cb 0.27 -0.01 -0.16 0.00 -0.31 0.00 0.00 39.34 39.13 2qgx n TYR 37 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 2qgx s ASP 38 N -0.94 3.10 -0.12 7.72 2.15 -1.20 -1.90 116.67 125.49 2qgx s ASP 38 Ca 0.16 -1.02 -0.03 0.00 0.43 0.00 0.00 52.55 52.10 2qgx s ASP 38 Cb 0.10 -0.48 -0.03 0.00 -0.30 0.00 0.00 42.92 42.21 2qgx s ASP 38 CO 0.14 -0.37 -0.01 0.26 -0.17 0.00 0.00 175.17 175.03 2qgx s TRP 39 N 1.96 3.12 -0.48 -5.34 0.52 -0.54 -1.88 118.94 116.31 2qgx s TRP 39 Ca 0.04 0.03 -0.12 0.00 0.02 0.00 0.00 56.10 56.08 2qgx s TRP 39 Cb -0.17 -1.87 0.11 0.00 -1.15 0.00 0.00 33.47 30.39 2qgx s TRP 39 CO -0.19 0.28 0.37 -0.80 0.02 0.00 0.00 176.95 176.63 2qgx s ASN 40 N -0.37 5.86 -0.43 2.95 -0.87 0.69 -0.81 114.94 121.97 2qgx s ASN 40 Ca 0.07 -1.73 -0.14 0.00 -1.57 0.00 0.00 52.86 49.49 2qgx s ASN 40 Cb -0.12 -2.07 0.05 0.00 -0.02 0.00 0.00 41.25 39.08 2qgx s ASN 40 CO 0.02 -0.70 0.32 -0.69 -2.57 0.00 0.00 177.10 173.48 2qgx s VAL 41 N 1.46 5.04 -0.20 1.60 1.01 -0.32 -1.18 120.40 127.81 2qgx s VAL 41 Ca 0.04 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 60.99 2qgx s VAL 41 Cb -0.26 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.16 2qgx s VAL 41 CO 0.02 -0.42 0.20 -1.59 0.00 0.00 0.00 175.10 173.31 2qgx s LYS 42 N 1.62 4.17 -0.43 2.72 -2.85 -0.97 -0.07 119.74 123.92 2qgx s LYS 42 Ca 0.04 -0.13 -0.26 0.00 -1.00 0.00 0.00 55.97 54.62 2qgx s LYS 42 Cb -0.21 -3.47 0.02 0.00 -2.06 0.00 0.00 37.83 32.11 2qgx s LYS 42 CO 0.07 0.18 0.95 -0.51 0.10 0.00 0.00 175.35 176.15 2qgx s LEU 43 N 0.68 3.96 -0.18 2.77 1.43 0.37 -0.99 118.68 126.72 2qgx s LEU 43 Ca 0.11 0.31 -0.16 0.00 -1.03 0.00 0.00 54.13 53.36 2qgx s LEU 43 Cb -0.12 -3.26 -0.21 0.00 0.03 0.00 0.00 46.19 42.62 2qgx s LEU 43 CO 0.02 -1.01 0.25 0.18 0.23 0.00 0.00 176.35 176.02 2qgx n LEU 44 N 7.12 2.13 -4.31 1.79 4.77 0.50 -2.50 117.00 126.50 2qgx n LEU 44 Ca 0.07 0.35 -0.41 0.00 -0.03 0.00 0.00 56.01 55.99 2qgx n LEU 44 Cb 0.48 -1.02 -0.10 0.00 -2.33 0.00 0.00 43.42 40.45 2qgx n LEU 44 CO 0.63 0.48 -0.12 -0.54 -1.33 0.00 0.00 177.39 176.52 2qgx s LYS 45 N -2.43 2.70 0.00 3.23 1.02 -0.48 -4.84 119.74 118.94 2qgx s LYS 45 Ca -0.27 -1.32 0.00 0.00 0.02 0.00 0.00 55.97 54.40 2qgx s LYS 45 Cb 0.06 -3.78 0.00 0.00 -0.52 0.00 0.00 37.83 33.59 2qgx s LYS 45 CO 0.65 -0.87 0.06 1.55 -0.92 0.00 0.00 175.35 175.83 2qgx n VAL 46 N 4.96 0.00 -0.87 3.17 3.14 -1.26 -4.79 118.33 122.68 2qgx n VAL 46 Ca -0.11 0.30 0.00 0.00 -2.96 0.00 0.00 64.34 61.57 2qgx n VAL 46 Cb 0.44 -0.78 0.00 0.00 -1.06 0.00 0.00 33.84 32.44 2qgx n VAL 46 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2qgx n ASP 49 N -1.14 -0.66 -4.19 6.55 4.64 -1.26 -4.95 116.55 115.54 2qgx n ASP 49 Ca 0.00 0.00 -0.16 0.00 -1.38 0.00 0.00 54.79 53.25 2qgx n ASP 49 Cb 0.00 -0.88 -0.10 0.00 -1.04 0.00 0.00 41.12 39.10 2qgx n ASP 49 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 2qgx s SER 50 N -2.57 1.00 0.19 1.67 1.04 -1.26 -5.03 113.70 108.73 2qgx s SER 50 Ca 0.00 -1.43 -0.09 0.00 0.48 0.00 0.00 55.95 54.91 2qgx s SER 50 Cb 0.00 0.28 0.09 0.00 0.10 0.00 0.00 66.02 66.50 2qgx s SER 50 CO 0.00 -0.80 1.68 0.00 0.98 0.00 0.00 173.24 175.10 2qgx h ALA 51 N 2.40 0.89 -0.37 5.32 0.00 -1.95 -2.23 119.26 123.33 2qgx h ALA 51 Ca -0.36 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 2qgx h ALA 51 Cb 1.25 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 2qgx h ALA 51 CO 0.56 0.67 0.18 1.25 0.00 0.00 0.00 179.25 181.91 2qgx h LEU 52 N 1.04 0.47 -1.84 0.00 5.85 -1.93 -0.95 115.31 117.94 2qgx h LEU 52 Ca 0.20 -0.12 0.27 0.00 0.84 0.00 0.00 57.88 59.07 2qgx h LEU 52 Cb 0.46 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 2qgx h LEU 52 CO 0.02 0.46 0.68 -0.74 -0.34 0.00 0.00 178.44 178.51 2qgx h HIS 53 N 0.46 0.17 0.07 1.25 2.76 -1.82 -0.28 115.15 117.76 2qgx h HIS 53 Ca 0.13 0.01 -0.00 0.00 -2.20 0.00 0.00 60.37 58.30 2qgx h HIS 53 Cb 0.11 -0.05 0.00 0.00 1.55 0.00 0.00 27.41 29.02 2qgx h HIS 53 CO -0.02 0.03 -0.03 -0.97 -1.30 0.00 0.00 177.93 175.64 2qgx h ASN 54 N 0.11 -0.07 -0.02 3.26 -1.24 -0.62 -3.29 115.58 113.71 2qgx h ASN 54 Ca 0.48 -0.51 0.01 0.00 0.71 0.00 0.00 56.30 56.98 2qgx h ASN 54 Cb 1.69 0.02 -0.00 0.00 0.73 0.00 0.00 38.32 40.76 2qgx h ASN 54 CO -0.07 0.52 0.05 0.44 -1.29 0.00 0.00 177.43 177.07 2qgx h ASP 55 N -0.71 0.00 1.45 1.15 3.32 -0.07 -0.78 116.42 120.79 2qgx h ASP 55 Ca -0.01 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 56.93 2qgx h ASP 55 Cb 0.58 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 2qgx h ASP 55 CO 0.01 0.00 -0.55 -0.07 -1.72 0.00 0.00 179.24 176.92 2qgx h LEU 56 N 0.00 0.00 -0.20 1.55 3.38 -1.45 -2.81 115.31 115.78 2qgx h LEU 56 Ca 0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2qgx h LEU 56 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 2qgx h LEU 56 CO -0.00 0.54 0.01 1.56 0.09 0.00 0.00 178.44 180.64 2qgx h GLN 57 N 0.00 0.34 -0.59 1.13 1.08 -1.20 -2.32 115.11 113.55 2qgx h GLN 57 Ca -0.01 -0.10 0.00 0.00 -1.45 0.00 0.00 58.65 57.09 2qgx h GLN 57 Cb 1.42 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.81 2qgx h GLN 57 CO 0.07 0.53 0.00 0.44 -0.95 0.00 0.00 178.83 178.92 2qgx n ILE 58 N -4.71 0.82 -0.09 2.54 -5.35 -1.22 -3.69 119.36 107.66 2qgx n ILE 58 Ca -0.04 -0.51 -0.23 0.00 -0.27 0.00 0.00 62.75 61.69 2qgx n ILE 58 Cb 0.21 -0.12 -0.12 0.00 -1.74 0.00 0.00 39.64 37.87 2qgx n ILE 58 CO 0.00 0.00 0.00 -0.11 -1.76 0.00 0.00 176.55 174.68 2qgx n LEU 59 N 0.33 2.07 -0.26 7.28 0.00 -0.89 -3.59 117.00 121.95 2qgx n LEU 59 Ca 0.11 0.34 0.04 0.00 0.00 0.00 0.00 56.01 56.50 2qgx n LEU 59 Cb 0.47 -0.96 0.17 0.00 0.00 0.00 0.00 43.42 43.10 2qgx n LEU 59 CO 0.11 0.47 1.06 0.50 0.00 0.00 0.00 177.39 179.53 2qgx h LYS 60 N -0.76 0.55 0.08 1.96 3.64 -1.45 -2.67 116.57 117.93 2qgx h LYS 60 Ca -0.45 -0.03 -0.00 0.00 -1.27 0.00 0.00 60.65 58.89 2qgx h LYS 60 Cb 1.53 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 33.22 2qgx h LYS 60 CO -0.20 0.36 -0.04 1.05 -2.27 0.00 0.00 179.45 178.36 2qgx h GLU 61 N 0.57 -0.11 0.08 1.90 4.11 -1.76 -3.39 114.58 115.97 2qgx h GLU 61 Ca 0.40 0.01 0.02 0.00 0.07 0.00 0.00 59.36 59.86 2qgx h GLU 61 Cb 0.51 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.74 2qgx h GLU 61 CO -0.33 -0.07 -0.31 -0.22 0.07 0.00 0.00 179.01 178.15 2qgx h LYS 62 N -0.42 -0.49 -2.99 1.06 3.64 -1.62 -3.42 116.57 112.32 2qgx h LYS 62 Ca -0.01 0.03 -0.41 0.00 -1.27 0.00 0.00 60.65 58.99 2qgx h LYS 62 Cb 0.09 0.11 -0.39 0.00 -0.41 0.00 0.00 32.23 31.62 2qgx h LYS 62 CO 0.02 -0.33 -0.72 -2.00 -2.27 0.00 0.00 179.45 174.15 2qgx s GLU 63 N -6.01 0.06 4.74 1.90 2.12 -1.01 -5.10 118.70 115.40 2qgx s GLU 63 Ca -0.16 0.08 0.00 0.00 0.36 0.00 0.00 54.97 55.25 2qgx s GLU 63 Cb 0.08 -1.42 0.00 0.00 0.26 0.00 0.00 34.13 33.05 2qgx s GLU 63 CO 0.65 -0.59 0.00 0.41 -0.54 0.00 0.00 175.26 175.18 2qgx n GLY 64 N 5.29 1.37 0.00 -1.50 0.00 -1.26 -4.52 105.19 104.58 2qgx n GLY 64 Ca -0.06 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2qgx n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qgx n ALA 65 N 8.20 0.00 -3.80 4.61 0.00 -1.26 -4.44 120.51 123.82 2qgx n ALA 65 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 2qgx n ALA 65 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 2qgx n ALA 65 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2qgx s ASP 66 N -0.55 3.90 -0.19 0.00 -4.77 -1.26 -3.12 116.67 110.68 2qgx s ASP 66 Ca 0.00 -2.95 -0.30 0.00 -3.30 0.00 0.00 52.55 46.00 2qgx s ASP 66 Cb 0.00 -1.28 0.14 0.00 -1.09 0.00 0.00 42.92 40.70 2qgx s ASP 66 CO 0.00 -0.22 1.10 0.72 0.70 0.00 0.00 175.17 177.47 2qgx s PHE 67 N -0.13 -0.26 -0.28 2.11 -0.12 -1.26 -4.74 117.98 113.29 2qgx s PHE 67 Ca 0.19 0.42 -0.18 0.00 -0.05 0.00 0.00 56.93 57.32 2qgx s PHE 67 Cb -0.20 0.47 -0.02 0.00 -0.63 0.00 0.00 43.02 42.63 2qgx s PHE 67 CO -0.03 -0.26 0.50 0.42 -0.05 0.00 0.00 175.22 175.80 2qgx s ILE 68 N -1.26 5.06 -0.38 -4.49 1.09 -1.04 -4.31 121.20 115.87 2qgx s ILE 68 Ca 0.02 0.74 -0.19 0.00 -1.10 0.00 0.00 60.65 60.12 2qgx s ILE 68 Cb -0.01 -3.85 0.01 0.00 -1.06 0.00 0.00 42.46 37.55 2qgx s ILE 68 CO -0.02 0.02 0.54 -0.22 -0.10 0.00 0.00 174.94 175.16 2qgx s LEU 69 N 2.32 4.47 0.14 2.97 2.96 0.22 -0.48 118.68 131.27 2qgx s LEU 69 Ca 0.20 -0.21 0.03 0.00 -0.22 0.00 0.00 54.13 53.93 2qgx s LEU 69 Cb -0.16 -2.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.90 2qgx s LEU 69 CO 0.10 -0.57 0.24 -0.76 -1.32 0.00 0.00 176.35 174.03 2qgx s LEU 70 N 2.47 4.21 -0.16 -0.68 1.43 0.90 0.40 118.68 127.24 2qgx s LEU 70 Ca 0.19 0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.40 2qgx s LEU 70 Cb -0.15 -2.79 0.03 0.00 0.03 0.00 0.00 46.19 43.30 2qgx s LEU 70 CO 0.15 0.07 -0.11 0.21 0.23 0.00 0.00 176.35 176.90 2qgx s ASN 71 N -3.09 2.84 -0.28 2.29 3.84 -0.31 -1.17 114.94 119.05 2qgx s ASN 71 Ca 0.34 -0.60 -0.11 0.00 0.21 0.00 0.00 52.86 52.70 2qgx s ASN 71 Cb -0.11 -1.11 -0.05 0.00 -0.55 0.00 0.00 41.25 39.43 2qgx s ASN 71 CO 0.27 -0.11 0.18 -0.36 -2.79 0.00 0.00 177.10 174.30 2qgx s PHE 72 N 1.51 3.21 -0.24 0.43 0.40 0.01 -2.29 117.98 121.02 2qgx s PHE 72 Ca 0.03 0.10 -0.06 0.00 -0.60 0.00 0.00 56.93 56.40 2qgx s PHE 72 Cb -0.14 -2.37 -0.02 0.00 0.51 0.00 0.00 43.02 41.00 2qgx s PHE 72 CO -0.09 -0.17 0.02 0.45 0.70 0.00 0.00 175.22 176.13 2qgx s SER 73 N 1.75 4.77 -0.35 1.36 0.15 0.07 -1.47 113.70 119.98 2qgx s SER 73 Ca 0.07 -0.28 0.07 0.00 0.70 0.00 0.00 55.95 56.50 2qgx s SER 73 Cb -0.16 -1.84 0.58 0.00 -1.71 0.00 0.00 66.02 62.89 2qgx s SER 73 CO 0.11 -0.03 1.65 0.49 1.20 0.00 0.00 173.24 176.66 2qgx n PHE 74 N 4.85 1.90 0.05 3.44 3.72 -0.80 -1.34 117.46 129.28 2qgx n PHE 74 Ca -0.17 -1.69 0.00 0.00 -0.05 0.00 0.00 57.45 55.55 2qgx n PHE 74 Cb 0.51 -0.68 -0.07 0.00 -0.94 0.00 0.00 39.48 38.31 2qgx n PHE 74 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2qgx h LYS 75 N 1.05 0.00 -4.00 -1.08 1.57 -1.95 -3.40 116.57 108.77 2qgx h LYS 75 Ca 0.38 0.00 -0.73 0.00 -1.87 0.00 0.00 60.65 58.44 2qgx h LYS 75 Cb 2.15 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 34.37 2qgx h LYS 75 CO 0.68 0.32 2.55 -0.25 -0.57 0.00 0.00 179.45 182.17 2qgx n ASP 76 N -2.93 4.49 -1.79 0.86 8.00 -1.26 -4.65 116.55 119.26 2qgx n ASP 76 Ca -0.08 -2.96 -0.19 0.00 0.71 0.00 0.00 54.79 52.27 2qgx n ASP 76 Cb 0.82 -1.59 -0.06 0.00 -0.02 0.00 0.00 41.12 40.27 2qgx n ASP 76 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2qgx n ASN 77 N 5.41 -5.21 -4.77 -2.24 5.03 -1.26 -4.25 115.26 107.97 2qgx n ASN 77 Ca 0.46 0.36 -0.40 0.00 0.87 0.00 0.00 54.58 55.87 2qgx n ASN 77 Cb 0.39 -4.56 -0.00 0.00 -1.02 0.00 0.00 39.78 34.59 2qgx n ASN 77 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2qgx s PHE 78 N -2.72 2.72 -2.12 3.10 2.19 -1.23 0.43 117.98 120.35 2qgx s PHE 78 Ca 0.00 1.32 0.15 0.00 0.33 0.00 0.00 56.93 58.73 2qgx s PHE 78 Cb 0.00 -3.81 0.58 0.00 -1.31 0.00 0.00 43.02 38.48 2qgx s PHE 78 CO 0.00 -2.45 1.42 -2.30 1.83 0.00 0.00 175.22 173.72 2qgx n PRO 79 N 0.24 1.59 -0.09 10.12 -0.02 -1.26 -4.84 135.00 140.74 2qgx n PRO 79 Ca 0.03 -0.90 -0.10 0.00 -2.02 0.00 0.00 63.50 60.51 2qgx n PRO 79 Cb 0.42 -1.30 -0.02 0.00 -0.02 0.00 0.00 33.50 32.57 2qgx n PRO 79 CO 0.00 0.00 0.00 0.74 1.98 0.00 0.00 175.50 178.22 2qgx h PHE 80 N 1.65 0.40 -2.71 6.00 0.04 -0.36 -3.38 116.94 118.58 2qgx h PHE 80 Ca 0.00 -0.01 -0.59 0.00 2.80 0.00 0.00 57.97 60.17 2qgx h PHE 80 Cb 0.37 -0.13 -0.11 0.00 2.20 0.00 0.00 35.95 38.28 2qgx h PHE 80 CO 0.12 0.35 -0.65 -0.51 -0.60 0.00 0.00 178.31 177.02 2qgx s ASP 81 N -5.60 4.72 0.87 2.17 1.01 0.11 -4.92 116.67 115.02 2qgx s ASP 81 Ca -0.13 -0.45 -0.11 0.00 0.71 0.00 0.00 52.55 52.56 2qgx s ASP 81 Cb 0.09 -0.98 0.12 0.00 1.01 0.00 0.00 42.92 43.16 2qgx s ASP 81 CO 0.72 0.07 1.17 -2.84 0.21 0.00 0.00 175.17 174.50 2qgx s PRO 82 N -3.13 1.27 0.36 8.23 0.02 -1.26 -3.49 135.00 136.99 2qgx s PRO 82 Ca 0.28 1.64 -0.26 0.00 0.02 0.00 0.00 61.00 62.68 2qgx s PRO 82 Cb -0.09 -1.75 -0.09 0.00 0.02 0.00 0.00 34.50 32.60 2qgx s PRO 82 CO 0.19 -2.47 1.11 -2.14 -0.33 0.00 0.00 177.00 173.37 2qgx s PRO 83 N -4.43 4.30 -0.49 5.54 0.02 -1.26 -4.71 135.00 133.97 2qgx s PRO 83 Ca 0.70 1.74 -0.29 0.00 0.02 0.00 0.00 61.00 63.17 2qgx s PRO 83 Cb -0.25 -2.82 0.02 0.00 0.02 0.00 0.00 34.50 31.47 2qgx s PRO 83 CO 0.55 -0.08 1.22 0.12 -0.33 0.00 0.00 177.00 178.48 2qgx s PHE 84 N -1.40 2.66 -0.08 6.54 5.36 -0.45 -4.87 117.98 125.75 2qgx s PHE 84 Ca 0.53 0.64 0.00 0.00 -0.96 0.00 0.00 56.93 57.13 2qgx s PHE 84 Cb -0.29 -4.43 -0.03 0.00 -0.34 0.00 0.00 43.02 37.93 2qgx s PHE 84 CO 0.36 -1.52 -0.06 0.08 -1.46 0.00 0.00 175.22 172.63 2qgx s VAL 85 N 4.86 3.79 0.07 3.12 1.01 -1.26 -0.75 120.40 131.24 2qgx s VAL 85 Ca 0.50 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 61.97 2qgx s VAL 85 Cb -0.09 -2.56 -0.01 0.00 0.00 0.00 0.00 36.38 33.72 2qgx s VAL 85 CO 0.31 0.59 0.14 0.00 0.00 0.00 0.00 175.10 176.13 2qgx s ARG 86 N -0.71 0.76 -0.25 2.72 1.70 -0.97 -4.17 118.95 118.04 2qgx s ARG 86 Ca 0.11 -0.96 -0.18 0.00 -0.47 0.00 0.00 55.73 54.23 2qgx s ARG 86 Cb -0.11 0.30 -0.03 0.00 -0.57 0.00 0.00 34.95 34.54 2qgx s ARG 86 CO 0.02 -0.22 0.51 0.08 -1.08 0.00 0.00 175.30 174.61 2qgx s VAL 87 N -3.65 5.08 -0.03 4.99 1.01 0.25 -1.17 120.40 126.88 2qgx s VAL 87 Ca 0.04 0.88 -0.13 0.00 0.00 0.00 0.00 61.98 62.77 2qgx s VAL 87 Cb 0.04 -3.83 -0.32 0.00 0.00 0.00 0.00 36.38 32.28 2qgx s VAL 87 CO -0.10 0.10 0.75 0.58 0.00 0.00 0.00 175.10 176.43 2qgx h VAL 88 N 5.36 1.03 -1.44 2.92 2.07 -0.38 -3.41 116.25 122.40 2qgx h VAL 88 Ca -0.30 -2.55 0.24 0.00 0.82 0.00 0.00 66.70 64.91 2qgx h VAL 88 Cb 1.14 2.84 -0.20 0.00 -1.52 0.00 0.00 31.29 33.55 2qgx h VAL 88 CO 0.72 0.84 0.80 -0.94 0.02 0.00 0.00 177.57 179.01 2qgx s SER 89 N -7.36 -0.15 0.92 0.57 1.04 -1.18 -4.75 113.70 102.79 2qgx s SER 89 Ca -0.14 0.04 -0.14 0.00 0.48 0.00 0.00 55.95 56.19 2qgx s SER 89 Cb 0.05 0.14 0.18 0.00 0.10 0.00 0.00 66.02 66.49 2qgx s SER 89 CO 0.87 -0.22 1.27 -2.84 0.98 0.00 0.00 173.24 173.31 2qgx s PRO 90 N -2.12 0.90 0.24 4.02 0.02 -1.26 0.69 135.00 137.49 2qgx s PRO 90 Ca 0.08 -0.42 -0.30 0.00 0.02 0.00 0.00 61.00 60.38 2qgx s PRO 90 Cb -0.01 -1.91 -0.10 0.00 0.02 0.00 0.00 34.50 32.50 2qgx s PRO 90 CO -0.05 -2.22 1.44 0.08 -0.33 0.00 0.00 177.00 175.92 2qgx s VAL 91 N -3.78 2.70 0.13 3.83 1.01 -1.26 -4.95 120.40 118.09 2qgx s VAL 91 Ca 0.72 0.58 0.08 0.00 0.00 0.00 0.00 61.98 63.36 2qgx s VAL 91 Cb -0.05 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.92 2qgx s VAL 91 CO 0.52 0.09 -0.18 -0.76 0.00 0.00 0.00 175.10 174.77 2qgx s LEU 92 N -0.24 2.39 -0.09 3.92 1.43 -1.26 -0.57 118.68 124.27 2qgx s LEU 92 Ca 0.60 -0.79 0.01 0.00 -1.03 0.00 0.00 54.13 52.91 2qgx s LEU 92 Cb -0.41 -0.76 -0.02 0.00 0.03 0.00 0.00 46.19 45.02 2qgx s LEU 92 CO 0.42 -0.04 -0.11 -0.94 0.23 0.00 0.00 176.35 175.91 2qgx s SER 93 N -2.39 4.27 0.47 2.29 1.04 0.11 -4.80 113.70 114.69 2qgx s SER 93 Ca 0.11 -0.18 0.00 0.00 0.48 0.00 0.00 55.95 56.36 2qgx s SER 93 Cb -0.07 -1.27 0.00 0.00 0.10 0.00 0.00 66.02 64.78 2qgx s SER 93 CO 0.05 0.27 0.00 0.61 0.98 0.00 0.00 173.24 175.15 2qgx n GLY 94 N 2.80 0.47 2.66 7.32 0.00 -1.26 -0.92 105.19 116.25 2qgx n GLY 94 Ca -0.18 -0.84 -0.18 0.00 0.00 0.00 0.00 46.02 44.82 2qgx n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qgx n GLY 95 N 0.00 1.69 2.37 -0.02 0.00 -0.42 -1.44 105.19 107.38 2qgx n GLY 95 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.88 2qgx n GLY 95 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2qgx n TYR 96 N -2.34 -0.03 -2.97 1.61 4.01 -1.26 -4.01 117.16 112.16 2qgx n TYR 96 Ca -0.18 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.16 2qgx n TYR 96 Cb 0.66 -2.38 -0.04 0.00 -0.31 0.00 0.00 39.34 37.27 2qgx n TYR 96 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2qgx s VAL 97 N -2.49 4.98 0.57 -0.72 1.01 -0.52 -0.01 120.40 123.21 2qgx s VAL 97 Ca 0.00 1.54 0.00 0.00 0.00 0.00 0.00 61.98 63.52 2qgx s VAL 97 Cb 0.00 -4.09 0.04 0.00 0.00 0.00 0.00 36.38 32.33 2qgx s VAL 97 CO 0.00 0.16 0.80 -0.76 0.00 0.00 0.00 175.10 175.31 2qgx s LEU 98 N 1.31 3.23 -0.01 3.92 1.43 0.19 -4.68 118.68 124.08 2qgx s LEU 98 Ca 0.38 0.06 -0.31 0.00 -1.03 0.00 0.00 54.13 53.23 2qgx s LEU 98 Cb -0.18 -2.91 -0.09 0.00 0.03 0.00 0.00 46.19 43.04 2qgx s LEU 98 CO 0.17 -1.19 1.98 0.61 0.23 0.00 0.00 176.35 178.15 2qgx n GLY 99 N -2.41 1.72 0.00 -3.19 0.00 -1.26 -1.68 105.19 98.37 2qgx n GLY 99 Ca 0.08 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.92 2qgx n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qgx n GLY 100 N 4.65 2.67 0.00 -0.02 0.00 -1.26 -4.39 105.19 106.83 2qgx n GLY 100 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2qgx n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qgx n GLY 101 N -0.84 0.98 3.77 -0.02 0.00 -0.68 -2.45 105.19 105.95 2qgx n GLY 101 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 2qgx n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qgx s ALA 102 N -2.00 2.33 -0.16 4.61 0.00 -1.24 0.83 121.76 126.14 2qgx s ALA 102 Ca 0.00 0.39 -0.01 0.00 0.00 0.00 0.00 51.96 52.34 2qgx s ALA 102 Cb 0.00 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.82 2qgx s ALA 102 CO 0.00 -1.58 -0.12 0.42 0.00 0.00 0.00 175.76 174.47 2qgx s ILE 103 N -2.67 2.96 -1.40 0.00 1.01 -1.26 0.57 121.20 120.42 2qgx s ILE 103 Ca 0.64 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 60.50 2qgx s ILE 103 Cb -0.19 -2.27 0.08 0.00 0.01 0.00 0.00 42.46 40.09 2qgx s ILE 103 CO 0.50 0.50 2.16 0.00 0.00 0.00 0.00 174.94 178.10 2qgx s MET 105 N 1.90 2.13 0.02 0.00 0.00 -1.26 -4.92 119.30 117.17 2qgx s MET 105 Ca 0.46 -0.99 -0.13 0.00 0.00 0.00 0.00 55.69 55.03 2qgx s MET 105 Cb 0.13 -2.28 -0.07 0.00 0.00 0.00 0.00 34.83 32.61 2qgx s MET 105 CO -0.05 0.52 1.19 0.93 0.00 0.00 0.00 175.02 177.61 2qgx h GLU 106 N 3.96 -0.44 -0.02 4.11 5.08 -1.96 -3.10 114.58 122.21 2qgx h GLU 106 Ca -0.49 0.03 0.01 0.00 -1.00 0.00 0.00 59.36 57.91 2qgx h GLU 106 Cb 1.16 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.51 2qgx h GLU 106 CO 0.50 -0.30 0.20 1.37 -1.00 0.00 0.00 179.01 179.79 2qgx h LEU 107 N -0.46 0.00 -0.19 1.33 -0.00 -1.97 0.53 115.31 114.55 2qgx h LEU 107 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.83 2qgx h LEU 107 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.01 2qgx h LEU 107 CO 0.07 0.00 0.00 0.18 -0.00 0.00 0.00 178.44 178.69 2qgx n LEU 108 N -3.03 0.28 -4.83 0.17 4.77 -1.17 -3.17 117.00 110.01 2qgx n LEU 108 Ca -0.02 -0.14 -0.22 0.00 -0.03 0.00 0.00 56.01 55.61 2qgx n LEU 108 Cb 0.27 -0.03 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 2qgx n LEU 108 CO 0.17 0.07 -0.12 0.42 -1.33 0.00 0.00 177.39 176.60 2qgx s THR 109 N -1.93 3.80 -0.50 -5.08 -4.23 0.18 -4.84 115.64 103.04 2qgx s THR 109 Ca 0.07 -1.41 0.00 0.00 -1.18 0.00 0.00 61.69 59.17 2qgx s THR 109 Cb 0.03 -3.24 0.01 0.00 1.34 0.00 0.00 72.50 70.65 2qgx s THR 109 CO 0.05 -0.24 0.77 0.29 -0.54 0.00 0.00 174.62 174.95 2qgx n LYS 110 N -1.29 1.05 0.00 3.99 5.02 -1.26 -2.53 118.16 123.14 2qgx n LYS 110 Ca -0.04 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 2qgx n LYS 110 Cb 0.59 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 34.33 2qgx n LYS 110 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 2qgx n GLN 111 N 0.24 0.00 0.00 1.97 7.27 -1.26 -4.84 117.38 120.76 2qgx n GLN 111 Ca 0.01 -0.25 0.00 0.00 0.07 0.00 0.00 57.00 56.83 2qgx n GLN 111 Cb 0.39 -0.47 0.00 0.00 2.41 0.00 0.00 30.24 32.58 2qgx n GLN 111 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2qgx n GLY 112 N 0.00 1.00 3.88 1.69 0.00 -1.13 -5.04 105.19 105.59 2qgx n GLY 112 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2qgx n GLY 112 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2qgx s TRP 113 N 0.00 3.52 -0.01 1.61 -0.11 -1.05 -4.18 118.94 118.71 2qgx s TRP 113 Ca 0.00 0.72 0.00 0.00 1.22 0.00 0.00 56.10 58.05 2qgx s TRP 113 Cb 0.00 -2.12 0.01 0.00 -1.50 0.00 0.00 33.47 29.86 2qgx s TRP 113 CO 0.00 0.44 -0.00 0.45 -4.62 0.00 0.00 176.95 173.22 2qgx s SER 114 N -2.10 0.26 0.28 5.86 0.15 -1.26 -5.01 113.70 111.88 2qgx s SER 114 Ca 0.38 -0.02 0.18 0.00 0.70 0.00 0.00 55.95 57.19 2qgx s SER 114 Cb -0.13 -0.10 0.97 0.00 -1.71 0.00 0.00 66.02 65.06 2qgx s SER 114 CO 0.21 -0.04 1.54 -1.20 1.20 0.00 0.00 173.24 174.94 2qgx n SER 115 N 3.59 0.47 0.10 5.45 7.64 -1.26 -0.86 113.62 128.74 2qgx n SER 115 Ca -0.20 0.71 -0.15 0.00 1.01 0.00 0.00 58.87 60.23 2qgx n SER 115 Cb 0.55 -0.76 -0.14 0.00 -1.01 0.00 0.00 64.21 62.85 2qgx n SER 115 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qgx h ALA 116 N 1.92 0.14 -2.02 -0.43 0.00 -1.94 -3.46 119.26 113.46 2qgx h ALA 116 Ca 0.00 -0.92 -0.60 0.00 0.00 0.00 0.00 54.91 53.39 2qgx h ALA 116 Cb 0.06 0.03 0.11 0.00 0.00 0.00 0.00 17.79 17.99 2qgx h ALA 116 CO 0.00 1.02 0.18 0.66 0.00 0.00 0.00 179.25 181.11 2qgx n TYR 117 N -3.51 1.38 -3.47 0.00 4.01 -0.04 -4.97 117.16 110.56 2qgx n TYR 117 Ca -0.09 0.68 -0.30 0.00 -0.16 0.00 0.00 57.90 58.04 2qgx n TYR 117 Cb 1.02 -2.27 -0.04 0.00 -0.31 0.00 0.00 39.34 37.74 2qgx n TYR 117 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2qgx s SER 118 N -0.50 6.49 0.46 7.72 0.01 -1.26 -4.97 113.70 121.65 2qgx s SER 118 Ca 0.59 0.70 0.24 0.00 1.31 0.00 0.00 55.95 58.79 2qgx s SER 118 Cb -0.69 -2.14 1.10 0.00 0.21 0.00 0.00 66.02 64.51 2qgx s SER 118 CO 0.60 -0.10 1.92 0.40 0.41 0.00 0.00 173.24 176.47 2qgx h ILE 119 N 1.68 0.65 -0.28 1.44 1.08 -1.93 -1.31 117.51 118.84 2qgx h ILE 119 Ca -0.47 -0.93 -0.04 0.00 -0.39 0.00 0.00 64.86 63.03 2qgx h ILE 119 Cb 1.18 1.60 -0.02 0.00 -3.07 0.00 0.00 36.82 36.51 2qgx h ILE 119 CO 0.68 0.21 0.01 -0.08 -0.69 0.00 0.00 178.15 178.28 2qgx h GLU 120 N 0.00 0.42 0.11 2.37 4.22 -1.93 -2.67 114.58 117.09 2qgx h GLU 120 Ca -0.00 -0.08 -0.24 0.00 0.08 0.00 0.00 59.36 59.12 2qgx h GLU 120 Cb 0.58 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2qgx h GLU 120 CO 0.03 0.44 -1.20 0.66 -2.18 0.00 0.00 179.01 176.76 2qgx h SER 121 N 0.41 0.36 -0.17 1.04 4.64 -1.69 -3.24 113.55 114.89 2qgx h SER 121 Ca 0.09 -0.86 0.02 0.00 -0.47 0.00 0.00 61.79 60.57 2qgx h SER 121 Cb 0.26 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.22 2qgx h SER 121 CO 0.01 1.53 0.12 1.62 -0.87 0.00 0.00 176.83 179.24 2qgx h VAL 122 N -0.39 1.00 -0.25 0.95 3.04 -1.28 0.25 116.25 119.57 2qgx h VAL 122 Ca -0.26 -0.06 -0.02 0.00 -1.01 0.00 0.00 66.70 65.35 2qgx h VAL 122 Cb 1.67 0.82 -0.01 0.00 -2.01 0.00 0.00 31.29 31.76 2qgx h VAL 122 CO 0.06 0.03 0.07 0.40 -1.01 0.00 0.00 177.57 177.12 2qgx h ILE 123 N 0.17 1.20 -0.43 3.17 2.04 -1.59 -1.65 117.51 120.42 2qgx h ILE 123 Ca 0.07 -0.66 -0.12 0.00 1.00 0.00 0.00 64.86 65.15 2qgx h ILE 123 Cb 0.08 1.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.31 2qgx h ILE 123 CO -0.01 0.21 -0.20 0.24 0.00 0.00 0.00 178.15 178.39 2qgx h MET 124 N 0.24 0.86 -0.14 2.37 2.86 -1.16 -0.50 114.93 119.45 2qgx h MET 124 Ca 0.08 -0.34 -0.04 0.00 -2.06 0.00 0.00 59.70 57.34 2qgx h MET 124 Cb 0.26 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.87 2qgx h MET 124 CO -0.00 0.98 -0.08 1.96 1.06 0.00 0.00 176.91 180.83 2qgx h GLN 125 N 0.75 0.22 -0.16 1.72 4.20 -0.51 0.17 115.11 121.50 2qgx h GLN 125 Ca 0.10 -0.04 -0.10 0.00 0.06 0.00 0.00 58.65 58.67 2qgx h GLN 125 Cb 0.73 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.48 2qgx h GLN 125 CO 0.06 0.31 -0.30 0.82 -0.67 0.00 0.00 178.83 179.05 2qgx h ILE 126 N 0.21 1.35 -0.05 2.54 2.04 -0.80 0.35 117.51 123.15 2qgx h ILE 126 Ca 0.05 -1.54 -0.00 0.00 1.00 0.00 0.00 64.86 64.36 2qgx h ILE 126 Cb 0.28 1.96 -0.00 0.00 -0.74 0.00 0.00 36.82 38.31 2qgx h ILE 126 CO 0.01 0.46 0.02 -1.28 0.00 0.00 0.00 178.15 177.37 2qgx h SER 127 N 0.11 0.06 0.00 1.72 0.87 -0.43 -0.95 113.55 114.94 2qgx h SER 127 Ca 0.01 -0.00 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 2qgx h SER 127 Cb 0.89 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 62.83 2qgx h SER 127 CO 0.07 0.06 -0.23 0.00 -0.53 0.00 0.00 176.83 176.19 2qgx h ALA 128 N 1.95 0.04 -1.00 6.23 0.00 -0.54 -3.19 119.26 122.76 2qgx h ALA 128 Ca 0.02 -0.55 0.18 0.00 0.00 0.00 0.00 54.91 54.55 2qgx h ALA 128 Cb 0.01 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 17.84 2qgx h ALA 128 CO -0.00 0.14 0.62 1.15 0.00 0.00 0.00 179.25 181.15 2qgx h THR 129 N -1.00 0.74 -0.69 0.00 2.02 -0.12 0.39 112.91 114.25 2qgx h THR 129 Ca -0.06 -0.27 -0.02 0.00 0.77 0.00 0.00 66.41 66.83 2qgx h THR 129 Cb 0.90 -0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 2qgx h THR 129 CO -0.04 0.14 0.34 -0.07 0.37 0.00 0.00 175.52 176.27 2qgx h LEU 130 N 0.79 0.89 -0.07 2.58 3.38 -1.30 -1.37 115.31 120.21 2qgx h LEU 130 Ca 0.56 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 58.30 2qgx h LEU 130 Cb 0.84 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.37 2qgx h LEU 130 CO -0.35 0.77 -0.36 0.58 0.09 0.00 0.00 178.44 179.17 2qgx h VAL 131 N 0.96 1.42 -0.80 1.22 2.07 -0.89 -0.92 116.25 119.31 2qgx h VAL 131 Ca 0.24 -1.76 0.06 0.00 0.82 0.00 0.00 66.70 66.06 2qgx h VAL 131 Cb 0.10 2.32 -0.05 0.00 -1.52 0.00 0.00 31.29 32.14 2qgx h VAL 131 CO -0.03 0.51 0.52 0.50 0.02 0.00 0.00 177.57 179.09 2qgx h LYS 132 N -0.11 0.86 -0.52 1.57 3.64 -0.31 0.80 116.57 122.51 2qgx h LYS 132 Ca -0.02 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 2qgx h LYS 132 Cb 1.01 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.64 2qgx h LYS 132 CO 0.07 0.57 0.00 0.41 -2.27 0.00 0.00 179.45 178.23 2qgx n GLY 133 N -1.43 0.69 3.96 5.01 0.00 -0.52 -4.91 105.19 107.99 2qgx n GLY 133 Ca 0.12 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 2qgx n GLY 133 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qgx n LYS 134 N 0.01 -0.57 -2.30 1.61 4.01 0.27 -1.30 118.16 119.90 2qgx n LYS 134 Ca 0.05 0.19 -0.37 0.00 -0.51 0.00 0.00 58.31 57.66 2qgx n LYS 134 Cb 0.27 -3.04 -0.02 0.00 -0.51 0.00 0.00 35.03 31.74 2qgx n LYS 134 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2qgx s ALA 135 N -3.53 3.06 0.05 7.82 0.00 -0.36 -4.37 121.76 124.44 2qgx s ALA 135 Ca 0.48 0.93 0.02 0.00 0.00 0.00 0.00 51.96 53.39 2qgx s ALA 135 Cb -0.23 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 2qgx s ALA 135 CO 0.94 -0.56 -0.08 1.03 0.00 0.00 0.00 175.76 177.09 2qgx s ARG 136 N -2.50 0.60 -0.30 0.00 1.81 -0.10 -3.55 118.95 114.90 2qgx s ARG 136 Ca 0.60 -0.85 -0.28 0.00 -1.72 0.00 0.00 55.73 53.49 2qgx s ARG 136 Cb -0.29 -0.34 0.01 0.00 -0.45 0.00 0.00 34.95 33.88 2qgx s ARG 136 CO 0.36 0.06 1.00 0.08 -0.68 0.00 0.00 175.30 176.12 2qgx s VAL 137 N -1.63 4.60 -1.04 3.52 1.01 -1.26 0.05 120.40 125.64 2qgx s VAL 137 Ca -0.07 1.66 -0.23 0.00 0.00 0.00 0.00 61.98 63.35 2qgx s VAL 137 Cb -0.08 -4.34 0.00 0.00 0.00 0.00 0.00 36.38 31.97 2qgx s VAL 137 CO 0.00 -0.38 1.71 -1.58 0.00 0.00 0.00 175.10 174.85 2qgx s GLN 138 N 3.42 3.18 0.00 2.72 2.00 0.27 -4.81 119.66 126.44 2qgx s GLN 138 Ca 0.42 -0.99 0.09 0.00 -2.00 0.00 0.00 55.36 52.89 2qgx s GLN 138 Cb -0.13 -5.28 0.55 0.00 0.80 0.00 0.00 33.01 28.95 2qgx s GLN 138 CO 0.13 -2.81 1.03 1.19 -0.50 0.00 0.00 175.29 174.33 2qgx n PHE 139 N 11.12 0.00 -0.08 1.67 3.01 -1.26 -3.20 117.46 128.72 2qgx n PHE 139 Ca 0.39 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.77 2qgx n PHE 139 Cb 0.48 -0.04 -0.04 0.00 -0.01 0.00 0.00 39.48 39.88 2qgx n PHE 139 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2qgx n GLY 140 N -0.43 -0.88 3.75 1.37 0.00 -1.26 -4.99 105.19 102.75 2qgx n GLY 140 Ca 0.07 -0.14 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 2qgx n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qgx s ALA 141 N -2.69 2.75 0.53 4.61 0.00 -1.19 -5.02 121.76 120.75 2qgx s ALA 141 Ca -0.19 1.25 -0.09 0.00 0.00 0.00 0.00 51.96 52.92 2qgx s ALA 141 Cb 0.03 -3.54 -0.05 0.00 0.00 0.00 0.00 23.12 19.57 2qgx s ALA 141 CO 0.31 -1.31 0.90 -0.80 0.00 0.00 0.00 175.76 174.86 2qgx s ASN 142 N -1.12 6.32 0.64 0.00 0.01 -1.26 -4.80 114.94 114.73 2qgx s ASN 142 Ca 0.73 1.21 0.38 0.00 -0.71 0.00 0.00 52.86 54.47 2qgx s ASN 142 Cb -0.38 -2.37 2.13 0.00 0.41 0.00 0.00 41.25 41.04 2qgx s ASN 142 CO 0.44 -0.67 2.27 0.11 -1.51 0.00 0.00 177.10 177.73 2qgx h LYS 143 N 0.20 0.00 0.00 -0.60 6.56 -1.94 -0.78 116.57 120.01 2qgx h LYS 143 Ca -0.46 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.13 2qgx h LYS 143 Cb 1.19 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.85 2qgx h LYS 143 CO 0.62 0.00 0.00 0.66 -2.06 0.00 0.00 179.45 178.67 2qgx h SER 144 N 0.00 0.00 -0.72 0.86 4.64 -1.93 0.31 113.55 116.71 2qgx h SER 144 Ca 0.01 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 61.37 2qgx h SER 144 Cb 0.14 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.19 2qgx h SER 144 CO -0.00 0.00 0.48 -0.61 -0.87 0.00 0.00 176.83 175.83 2qgx h GLN 145 N 0.00 0.84 -4.65 4.77 5.75 -1.52 -3.38 115.11 116.92 2qgx h GLN 145 Ca 0.00 -0.05 -0.69 0.00 -0.15 0.00 0.00 58.65 57.76 2qgx h GLN 145 Cb 0.00 -0.19 -0.21 0.00 1.07 0.00 0.00 27.48 28.15 2qgx h GLN 145 CO 0.00 0.56 -0.49 0.71 -2.65 0.00 0.00 178.83 176.96 2qgx s TYR 146 N -5.75 3.22 0.05 3.99 2.02 0.10 -4.30 117.35 116.68 2qgx s TYR 146 Ca -0.10 -0.52 0.02 0.00 -0.37 0.00 0.00 57.07 56.09 2qgx s TYR 146 Cb 0.19 -2.47 -0.03 0.00 -0.40 0.00 0.00 41.96 39.24 2qgx s TYR 146 CO 0.77 -0.49 -0.08 -1.54 -1.57 0.00 0.00 175.55 172.64 2qgx s SER 147 N 1.66 0.93 0.33 2.29 1.04 -1.03 -4.94 113.70 113.98 2qgx s SER 147 Ca 0.05 -0.64 0.05 0.00 0.48 0.00 0.00 55.95 55.89 2qgx s SER 147 Cb -0.18 0.05 0.69 0.00 0.10 0.00 0.00 66.02 66.68 2qgx s SER 147 CO 0.09 -0.25 1.88 0.25 0.98 0.00 0.00 173.24 176.19 2qgx h LEU 148 N 4.19 0.77 0.07 2.42 5.85 -1.96 0.11 115.31 126.76 2qgx h LEU 148 Ca -0.36 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.40 2qgx h LEU 148 Cb 1.19 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 2qgx h LEU 148 CO 0.45 0.43 -0.12 0.74 -0.34 0.00 0.00 178.44 179.60 2qgx h THR 149 N 0.83 0.72 0.00 1.05 2.02 -1.95 0.15 112.91 115.73 2qgx h THR 149 Ca 0.43 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.58 2qgx h THR 149 Cb 0.51 0.72 -0.00 0.00 -1.74 0.00 0.00 68.15 67.63 2qgx h THR 149 CO -0.20 0.00 -0.16 0.03 0.37 0.00 0.00 175.52 175.56 2qgx h ARG 150 N -0.24 0.00 0.15 6.66 3.08 -1.59 -2.95 114.38 119.50 2qgx h ARG 150 Ca 0.02 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.78 2qgx h ARG 150 Cb 0.26 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.33 2qgx h ARG 150 CO -0.07 0.16 -1.29 0.00 -1.07 0.00 0.00 179.97 177.70 2qgx h ALA 151 N 1.84 0.02 0.70 0.04 0.00 -0.22 -3.07 119.26 118.56 2qgx h ALA 151 Ca -0.00 -0.82 -0.03 0.00 0.00 0.00 0.00 54.91 54.05 2qgx h ALA 151 Cb 0.52 0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.40 2qgx h ALA 151 CO 0.02 0.79 -0.34 1.96 0.00 0.00 0.00 179.25 181.68 2qgx h GLN 152 N 0.17 -0.91 -0.20 0.00 1.08 -0.82 -0.69 115.11 113.75 2qgx h GLN 152 Ca -0.18 0.06 0.04 0.00 -1.45 0.00 0.00 58.65 57.12 2qgx h GLN 152 Cb 1.97 0.21 -0.01 0.00 -0.05 0.00 0.00 27.48 29.60 2qgx h GLN 152 CO 0.23 -0.61 0.14 1.96 -0.95 0.00 0.00 178.83 179.61 2qgx h GLN 153 N -1.20 0.11 0.56 1.46 1.08 -1.70 0.49 115.11 115.91 2qgx h GLN 153 Ca -0.10 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.07 2qgx h GLN 153 Cb 0.72 -0.03 0.01 0.00 -0.05 0.00 0.00 27.48 28.13 2qgx h GLN 153 CO 0.16 0.07 -0.27 1.03 -0.95 0.00 0.00 178.83 178.87 2qgx h SER 154 N 0.12 -0.64 -0.53 1.46 0.87 -1.51 -2.37 113.55 110.95 2qgx h SER 154 Ca 0.09 -0.03 0.14 0.00 -1.23 0.00 0.00 61.79 60.76 2qgx h SER 154 Cb 0.21 0.17 -0.02 0.00 -0.44 0.00 0.00 62.40 62.31 2qgx h SER 154 CO -0.01 -0.25 0.37 0.22 -0.53 0.00 0.00 176.83 176.63 2qgx h TYR 155 N -1.12 0.07 0.80 2.24 3.20 -0.61 -2.13 116.97 119.42 2qgx h TYR 155 Ca -0.08 0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.76 2qgx h TYR 155 Cb 0.63 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.87 2qgx h TYR 155 CO 0.01 0.03 -0.49 -0.22 -1.64 0.00 0.00 178.16 175.85 2qgx h LYS 156 N 0.07 -1.16 -0.79 1.82 3.64 0.13 -2.65 116.57 117.63 2qgx h LYS 156 Ca 0.25 0.08 0.10 0.00 -1.27 0.00 0.00 60.65 59.81 2qgx h LYS 156 Cb 0.91 0.26 -0.05 0.00 -0.41 0.00 0.00 32.23 32.94 2qgx h LYS 156 CO -0.02 -0.77 0.51 0.77 -2.27 0.00 0.00 179.45 177.68 2qgx h SER 157 N -1.20 0.63 -0.55 4.20 0.02 -0.87 -1.96 113.55 113.82 2qgx h SER 157 Ca -0.11 0.02 0.11 0.00 -0.84 0.00 0.00 61.79 60.97 2qgx h SER 157 Cb 0.96 -0.11 -0.10 0.00 0.14 0.00 0.00 62.40 63.29 2qgx h SER 157 CO 0.11 0.37 -0.05 0.25 -1.14 0.00 0.00 176.83 176.37 2qgx h LEU 158 N 0.70 -0.33 0.00 5.07 7.12 -1.07 -3.52 115.31 123.28 2qgx h LEU 158 Ca 0.37 0.15 0.00 0.00 0.13 0.00 0.00 57.88 58.52 2qgx h LEU 158 Cb 0.48 0.27 0.00 0.00 -0.53 0.00 0.00 40.66 40.89 2qgx h LEU 158 CO -0.14 -0.12 0.00 0.52 -0.13 0.00 0.00 178.44 178.57