#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qgx s SER 2 N 0.00 0.14 0.36 1.61 1.04 -1.26 -5.03 113.70 110.56 2qgx s SER 2 Ca 0.00 -0.32 0.12 0.00 0.48 0.00 0.00 55.95 56.23 2qgx s SER 2 Cb 0.00 0.10 0.92 0.00 0.10 0.00 0.00 66.02 67.14 2qgx s SER 2 CO 0.00 -0.24 1.80 0.58 0.98 0.00 0.00 173.24 176.37 2qgx h VAL 3 N 4.71 0.67 0.01 5.02 2.07 -2.04 -0.72 116.25 125.97 2qgx h VAL 3 Ca -0.30 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.02 2qgx h VAL 3 Cb 1.21 0.03 -0.00 0.00 -1.52 0.00 0.00 31.29 31.00 2qgx h VAL 3 CO 0.43 0.11 -0.02 1.56 0.02 0.00 0.00 177.57 179.67 2qgx h GLN 4 N 0.58 -0.04 0.07 1.57 1.08 -1.99 -1.74 115.11 114.64 2qgx h GLN 4 Ca 0.55 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.74 2qgx h GLN 4 Cb 1.09 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.53 2qgx h GLN 4 CO -0.30 -0.02 -0.03 0.00 -0.95 0.00 0.00 178.83 177.53 2qgx h ALA 5 N 0.95 -0.09 -0.56 3.87 0.00 -1.55 -1.96 119.26 119.93 2qgx h ALA 5 Ca 0.01 -0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.72 2qgx h ALA 5 Cb 0.05 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 2qgx h ALA 5 CO -0.02 -0.32 0.33 1.79 0.00 0.00 0.00 179.25 181.04 2qgx h THR 6 N -0.55 1.04 -0.29 0.00 1.35 -1.31 0.29 112.91 113.44 2qgx h THR 6 Ca -0.01 -0.22 0.05 0.00 -0.55 0.00 0.00 66.41 65.67 2qgx h THR 6 Cb 0.48 0.33 -0.04 0.00 -1.73 0.00 0.00 68.15 67.19 2qgx h THR 6 CO 0.02 0.12 0.02 -0.78 -0.25 0.00 0.00 175.52 174.65 2qgx h ASP 7 N 0.65 -0.07 0.08 5.36 -0.00 -1.35 0.47 116.42 121.57 2qgx h ASP 7 Ca 0.23 0.06 0.01 0.00 -0.00 0.00 0.00 57.03 57.32 2qgx h ASP 7 Cb 0.04 0.10 -0.01 0.00 -0.00 0.00 0.00 39.33 39.46 2qgx h ASP 7 CO -0.11 0.00 -0.10 -0.09 -0.00 0.00 0.00 179.24 178.94 2qgx h ARG 8 N 0.12 -0.21 -0.41 0.28 9.65 -0.51 0.65 114.38 123.94 2qgx h ARG 8 Ca 0.14 0.01 0.01 0.00 -1.10 0.00 0.00 59.98 59.04 2qgx h ARG 8 Cb 0.17 0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.77 2qgx h ARG 8 CO -0.21 -0.14 0.27 -0.07 2.80 0.00 0.00 179.97 182.61 2qgx h LEU 9 N -0.22 0.45 -0.58 3.80 3.38 -0.15 0.20 115.31 122.20 2qgx h LEU 9 Ca 0.01 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.03 2qgx h LEU 9 Cb 0.22 -0.11 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 2qgx h LEU 9 CO -0.04 0.32 0.29 0.24 0.09 0.00 0.00 178.44 179.34 2qgx h MET 10 N 0.54 0.53 -0.93 1.13 2.86 0.14 0.01 114.93 119.21 2qgx h MET 10 Ca 0.16 -0.03 0.02 0.00 -2.06 0.00 0.00 59.70 57.78 2qgx h MET 10 Cb -0.04 -0.12 -0.05 0.00 0.06 0.00 0.00 31.60 31.45 2qgx h MET 10 CO -0.05 0.35 0.61 -0.22 1.06 0.00 0.00 176.91 178.67 2qgx h LYS 11 N 0.55 1.20 0.12 1.72 3.64 -0.22 0.74 116.57 124.32 2qgx h LYS 11 Ca 0.27 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.57 2qgx h LYS 11 Cb 0.20 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.75 2qgx h LYS 11 CO -0.19 0.79 -0.09 0.93 -2.27 0.00 0.00 179.45 178.62 2qgx h GLU 12 N 1.23 -0.20 -0.23 1.90 4.39 0.11 -1.17 114.58 120.61 2qgx h GLU 12 Ca 0.35 0.01 -0.18 0.00 0.34 0.00 0.00 59.36 59.89 2qgx h GLU 12 Cb -0.10 0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 2qgx h GLU 12 CO -0.09 -0.14 -0.54 1.25 -1.16 0.00 0.00 179.01 178.33 2qgx h LEU 13 N -0.21 0.88 -0.85 1.33 6.46 -0.93 -2.29 115.31 119.69 2qgx h LEU 13 Ca -0.01 -0.56 0.14 0.00 -0.12 0.00 0.00 57.88 57.34 2qgx h LEU 13 Cb 0.19 -0.25 -0.09 0.00 -0.73 0.00 0.00 40.66 39.77 2qgx h LEU 13 CO -0.00 1.28 0.44 0.03 -0.62 0.00 0.00 178.44 179.56 2qgx h ARG 14 N 0.51 0.61 -0.23 1.25 2.47 -0.78 0.15 114.38 118.37 2qgx h ARG 14 Ca -0.00 -0.04 -0.12 0.00 -1.26 0.00 0.00 59.98 58.56 2qgx h ARG 14 Cb 1.16 -0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 29.33 2qgx h ARG 14 CO 0.12 0.40 -0.36 -0.44 0.56 0.00 0.00 179.97 180.25 2qgx h ASP 15 N 0.63 0.53 -0.54 7.04 5.19 -1.07 -3.18 116.42 125.02 2qgx h ASP 15 Ca 0.46 -0.22 -0.03 0.00 -0.62 0.00 0.00 57.03 56.62 2qgx h ASP 15 Cb 0.64 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.98 2qgx h ASP 15 CO -0.36 0.85 0.23 0.40 -3.12 0.00 0.00 179.24 177.24 2qgx h ILE 16 N 0.43 1.22 0.00 0.35 2.04 -0.41 -2.49 117.51 118.64 2qgx h ILE 16 Ca 0.05 -0.66 -0.02 0.00 1.00 0.00 0.00 64.86 65.23 2qgx h ILE 16 Cb 0.83 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 37.54 2qgx h ILE 16 CO 0.07 0.25 -0.09 1.88 0.00 0.00 0.00 178.15 180.26 2qgx h TYR 17 N 0.73 0.00 -0.74 1.37 0.05 -1.30 -2.82 116.97 114.27 2qgx h TYR 17 Ca 0.18 0.00 -0.25 0.00 0.05 0.00 0.00 58.73 58.72 2qgx h TYR 17 Cb 0.18 0.00 -0.15 0.00 1.01 0.00 0.00 36.73 37.78 2qgx h TYR 17 CO 0.00 0.09 0.29 -2.13 -1.05 0.00 0.00 178.16 175.37 2qgx n ARG 18 N -4.36 3.42 -4.48 4.88 0.63 -0.95 -4.64 116.66 111.16 2qgx n ARG 18 Ca -0.03 -3.08 -0.31 0.00 -0.92 0.00 0.00 57.85 53.51 2qgx n ARG 18 Cb 0.17 -2.18 -0.11 0.00 0.45 0.00 0.00 32.46 30.79 2qgx n ARG 18 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 2qgx s SER 19 N -1.19 4.10 0.37 6.15 1.04 -1.07 -5.03 113.70 118.07 2qgx s SER 19 Ca 0.54 -0.38 0.11 0.00 0.48 0.00 0.00 55.95 56.71 2qgx s SER 19 Cb 0.44 -0.74 0.74 0.00 0.10 0.00 0.00 66.02 66.56 2qgx s SER 19 CO 0.12 0.23 1.85 1.56 0.98 0.00 0.00 173.24 177.99 2qgx h GLN 20 N 4.23 0.10 -0.65 4.02 1.08 -1.91 0.99 115.11 122.96 2qgx h GLN 20 Ca -0.48 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 56.67 2qgx h GLN 20 Cb 1.16 -0.01 -0.03 0.00 -0.05 0.00 0.00 27.48 28.55 2qgx h GLN 20 CO 0.50 0.38 0.36 0.66 -0.95 0.00 0.00 178.83 179.78 2qgx h SER 21 N 0.09 0.79 0.16 1.46 4.64 -1.96 0.03 113.55 118.76 2qgx h SER 21 Ca 0.01 -0.06 -0.30 0.00 -0.47 0.00 0.00 61.79 60.98 2qgx h SER 21 Cb 0.56 -0.20 0.01 0.00 -0.31 0.00 0.00 62.40 62.45 2qgx h SER 21 CO 0.04 0.64 -1.45 0.15 -0.87 0.00 0.00 176.83 175.33 2qgx h PHE 22 N 0.90 0.60 -0.12 4.77 3.57 -1.65 -3.08 116.94 121.93 2qgx h PHE 22 Ca 0.23 -0.44 -0.00 0.00 3.53 0.00 0.00 57.97 61.29 2qgx h PHE 22 Cb 0.01 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.72 2qgx h PHE 22 CO 0.01 1.57 0.07 0.87 -2.23 0.00 0.00 178.31 178.59 2qgx h LYS 23 N -0.14 0.16 -0.29 1.11 1.57 -0.71 -2.50 116.57 115.77 2qgx h LYS 23 Ca -0.29 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.44 2qgx h LYS 23 Cb 1.89 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 34.16 2qgx h LYS 23 CO 0.13 0.12 0.05 0.78 -0.57 0.00 0.00 179.45 179.96 2qgx h GLY 24 N 0.20 0.52 0.00 3.86 0.00 -1.10 -3.48 103.07 103.07 2qgx h GLY 24 Ca 0.04 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2qgx h GLY 24 CO -0.01 0.32 0.00 0.61 0.00 0.00 0.00 176.54 177.46 2qgx n GLY 25 N -0.48 1.85 0.33 4.60 0.00 -0.94 -5.03 105.19 105.52 2qgx n GLY 25 Ca -0.03 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.99 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 0.81 -5.10 1.61 4.21 -1.74 -3.37 115.58 111.99 2qgx h ASN 26 Ca 0.00 -0.06 -0.05 0.00 1.21 0.00 0.00 56.30 57.41 2qgx h ASN 26 Cb 0.00 -0.20 -0.12 0.00 -1.12 0.00 0.00 38.32 36.88 2qgx h ASN 26 CO 0.00 0.64 -0.08 -0.72 -1.29 0.00 0.00 177.43 175.99 2qgx s TYR 27 N -5.63 -0.11 0.21 1.19 -0.85 -1.26 0.63 117.35 111.52 2qgx s TYR 27 Ca -0.10 -0.23 0.11 0.00 -0.52 0.00 0.00 57.07 56.33 2qgx s TYR 27 Cb 0.17 0.26 -0.04 0.00 0.38 0.00 0.00 41.96 42.72 2qgx s TYR 27 CO 0.78 -0.76 -0.21 0.00 -1.52 0.00 0.00 175.55 173.84 2qgx s ALA 28 N -3.84 2.64 -0.18 9.51 0.00 -0.35 -4.88 121.76 124.65 2qgx s ALA 28 Ca 0.06 -1.66 0.00 0.00 0.00 0.00 0.00 51.96 50.37 2qgx s ALA 28 Cb 0.01 -0.38 0.04 0.00 0.00 0.00 0.00 23.12 22.79 2qgx s ALA 28 CO -0.08 0.41 -0.09 0.08 0.00 0.00 0.00 175.76 176.07 2qgx s VAL 29 N -1.84 1.45 -0.13 0.00 1.01 -1.26 -1.61 120.40 118.02 2qgx s VAL 29 Ca 0.23 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.43 2qgx s VAL 29 Cb -0.07 -1.52 -0.00 0.00 0.00 0.00 0.00 36.38 34.78 2qgx s VAL 29 CO 0.12 0.22 -0.18 -1.61 0.00 0.00 0.00 175.10 173.65 2qgx s GLU 30 N 1.49 3.21 -0.57 2.72 0.41 -0.16 -4.96 118.70 120.85 2qgx s GLU 30 Ca 0.01 -0.78 -0.28 0.00 -0.41 0.00 0.00 54.97 53.52 2qgx s GLU 30 Cb -0.15 -2.52 0.03 0.00 -1.78 0.00 0.00 34.13 29.71 2qgx s GLU 30 CO -0.09 0.13 1.14 -0.51 -0.49 0.00 0.00 175.26 175.44 2qgx s LEU 31 N 0.52 3.58 0.01 1.80 1.43 -1.26 0.79 118.68 125.55 2qgx s LEU 31 Ca -0.11 0.06 -0.30 0.00 -1.03 0.00 0.00 54.13 52.75 2qgx s LEU 31 Cb -0.16 -3.14 -0.07 0.00 0.03 0.00 0.00 46.19 42.84 2qgx s LEU 31 CO 0.04 -1.42 1.74 0.54 0.23 0.00 0.00 176.35 177.49 2qgx s VAL 32 N 4.73 3.23 -1.72 -1.59 0.11 -0.91 -1.41 120.40 122.85 2qgx s VAL 32 Ca 0.41 0.44 0.00 0.00 -2.93 0.00 0.00 61.98 59.90 2qgx s VAL 32 Cb -0.08 -3.28 0.00 0.00 -1.53 0.00 0.00 36.38 31.49 2qgx s VAL 32 CO 0.25 -0.03 0.00 0.59 -3.33 0.00 0.00 175.10 172.58 2qgx n ASN 33 N 6.71 -5.40 -0.78 3.54 3.02 -1.26 -1.82 115.26 119.28 2qgx n ASN 33 Ca 0.18 0.13 -0.10 0.00 -0.03 0.00 0.00 54.58 54.75 2qgx n ASN 33 Cb 0.41 -4.57 -0.04 0.00 -0.61 0.00 0.00 39.78 34.97 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 -1.79 -4.77 -4.67 6.41 8.00 -0.50 -4.96 116.55 114.27 2qgx n ASP 34 Ca -0.22 0.25 -0.42 0.00 0.71 0.00 0.00 54.79 55.11 2qgx n ASP 34 Cb 0.66 -3.16 -0.03 0.00 -0.02 0.00 0.00 41.12 38.57 2qgx n ASP 34 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2qgx s SER 35 N -2.62 7.03 0.00 -2.24 0.15 -0.75 -4.91 113.70 110.36 2qgx s SER 35 Ca 0.00 1.28 0.15 0.00 0.70 0.00 0.00 55.95 58.09 2qgx s SER 35 Cb 0.00 -2.50 0.68 0.00 -1.71 0.00 0.00 66.02 62.49 2qgx s SER 35 CO 0.00 -0.51 1.48 -0.11 1.20 0.00 0.00 173.24 175.30 2qgx n LEU 36 N 5.66 0.00 -1.04 3.45 -0.00 -1.26 -2.51 117.00 121.30 2qgx n LEU 36 Ca 0.08 0.47 0.08 0.00 -0.00 0.00 0.00 56.01 56.63 2qgx n LEU 36 Cb 0.48 -0.47 0.27 0.00 -0.00 0.00 0.00 43.42 43.70 2qgx n LEU 36 CO 0.50 -0.22 0.72 -1.22 -0.00 0.00 0.00 177.39 177.17 2qgx n TYR 37 N -1.47 1.04 -3.17 1.96 4.01 -1.26 -4.87 117.16 113.40 2qgx n TYR 37 Ca 0.04 -0.74 0.02 0.00 -0.16 0.00 0.00 57.90 57.06 2qgx n TYR 37 Cb 0.17 -0.26 -0.01 0.00 -0.31 0.00 0.00 39.34 38.92 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 -1.47 -1.26 -0.03 7.72 2.15 -1.04 -1.67 116.67 121.07 2qgx s ASP 38 Ca 0.41 0.45 0.03 0.00 0.43 0.00 0.00 52.55 53.87 2qgx s ASP 38 Cb 0.30 1.97 -0.03 0.00 -0.30 0.00 0.00 42.92 44.86 2qgx s ASP 38 CO 0.13 -0.29 -0.09 0.26 -0.17 0.00 0.00 175.17 175.01 2qgx s TRP 39 N 2.80 2.84 -0.40 -5.34 0.51 -0.04 -2.13 118.94 117.18 2qgx s TRP 39 Ca 0.15 -0.06 -0.15 0.00 -2.12 0.00 0.00 56.10 53.92 2qgx s TRP 39 Cb -0.13 -1.63 0.02 0.00 -0.81 0.00 0.00 33.47 30.92 2qgx s TRP 39 CO -0.23 0.31 0.29 -0.80 -0.51 0.00 0.00 176.95 176.01 2qgx s ASN 40 N -1.08 6.09 -0.38 2.95 0.01 0.24 -0.61 114.94 122.15 2qgx s ASN 40 Ca 0.14 -0.85 -0.11 0.00 -0.71 0.00 0.00 52.86 51.32 2qgx s ASN 40 Cb -0.11 -2.15 0.03 0.00 0.41 0.00 0.00 41.25 39.43 2qgx s ASN 40 CO 0.04 -0.43 0.23 -0.69 -1.51 0.00 0.00 177.10 174.74 2qgx s VAL 41 N 1.68 4.65 -0.34 1.60 1.01 0.21 -0.99 120.40 128.23 2qgx s VAL 41 Ca 0.05 -0.88 -0.18 0.00 0.00 0.00 0.00 61.98 60.96 2qgx s VAL 41 Cb -0.19 -3.62 -0.01 0.00 0.00 0.00 0.00 36.38 32.57 2qgx s VAL 41 CO 0.10 -0.27 0.53 -0.54 0.00 0.00 0.00 175.10 174.92 2qgx s LYS 42 N 1.56 3.70 -0.42 2.72 1.02 -0.63 -0.03 119.74 127.66 2qgx s LYS 42 Ca 0.02 -0.05 -0.28 0.00 0.02 0.00 0.00 55.97 55.68 2qgx s LYS 42 Cb -0.20 -3.78 -0.00 0.00 -0.52 0.00 0.00 37.83 33.33 2qgx s LYS 42 CO 0.07 -0.61 1.61 -0.51 -0.92 0.00 0.00 175.35 174.99 2qgx s LEU 43 N 2.43 3.50 -0.08 3.17 1.43 0.10 -1.22 118.68 128.02 2qgx s LEU 43 Ca 0.20 0.88 0.08 0.00 -1.03 0.00 0.00 54.13 54.26 2qgx s LEU 43 Cb -0.15 -3.35 -0.24 0.00 0.03 0.00 0.00 46.19 42.48 2qgx s LEU 43 CO 0.13 -1.68 0.53 0.18 0.23 0.00 0.00 176.35 175.74 2qgx n LEU 44 N 9.93 1.28 -4.07 1.79 4.77 0.20 -1.95 117.00 128.96 2qgx n LEU 44 Ca 0.19 0.33 -0.22 0.00 -0.03 0.00 0.00 56.01 56.27 2qgx n LEU 44 Cb 0.48 -0.14 -0.15 0.00 -2.33 0.00 0.00 43.42 41.28 2qgx n LEU 44 CO 0.70 0.52 -0.46 -0.54 -1.33 0.00 0.00 177.39 176.27 2qgx s LYS 45 N -2.58 1.23 0.23 3.23 1.02 0.19 -4.90 119.74 118.17 2qgx s LYS 45 Ca -0.10 -0.44 0.01 0.00 0.02 0.00 0.00 55.97 55.46 2qgx s LYS 45 Cb 0.08 -1.13 -0.05 0.00 -0.52 0.00 0.00 37.83 36.21 2qgx s LYS 45 CO 0.81 0.20 0.10 0.14 -0.92 0.00 0.00 175.35 175.67 2qgx s VAL 46 N 0.01 0.40 -0.38 3.17 -7.23 -1.26 -4.88 120.40 110.23 2qgx s VAL 46 Ca -0.01 -2.00 -0.43 0.00 -1.81 0.00 0.00 61.98 57.74 2qgx s VAL 46 Cb -0.08 -2.54 -0.17 0.00 0.56 0.00 0.00 36.38 34.14 2qgx s VAL 46 CO 0.01 -0.05 1.73 0.47 -0.31 0.00 0.00 175.10 176.95 2qgx n ASP 47 N -0.38 1.86 0.17 4.85 8.00 -1.26 -4.81 116.55 124.97 2qgx n ASP 47 Ca -0.00 1.07 0.13 0.00 0.71 0.00 0.00 54.79 56.70 2qgx n ASP 47 Cb 0.66 -1.04 0.45 0.00 -0.02 0.00 0.00 41.12 41.18 2qgx n ASP 47 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 2qgx h GLN 48 N 6.70 0.00 -0.00 -1.24 4.15 -1.98 -2.36 115.11 120.38 2qgx h GLN 48 Ca -0.43 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.99 2qgx h GLN 48 Cb 1.34 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.03 2qgx h GLN 48 CO 0.98 0.00 -0.12 -0.40 -1.93 0.00 0.00 178.83 177.36 2qgx n ASP 49 N -2.56 0.47 -4.92 -0.69 5.75 -1.26 -4.83 116.55 108.51 2qgx n ASP 49 Ca 0.03 -0.52 -0.27 0.00 -0.01 0.00 0.00 54.79 54.02 2qgx n ASP 49 Cb 0.35 -0.07 -0.02 0.00 -1.03 0.00 0.00 41.12 40.35 2qgx n ASP 49 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2qgx s SER 50 N -2.52 6.37 0.20 -1.12 1.04 -0.89 -5.00 113.70 111.78 2qgx s SER 50 Ca 0.27 0.69 -0.07 0.00 0.48 0.00 0.00 55.95 57.33 2qgx s SER 50 Cb 0.20 -2.14 0.14 0.00 0.10 0.00 0.00 66.02 64.32 2qgx s SER 50 CO 0.49 -0.31 1.64 0.00 0.98 0.00 0.00 173.24 176.03 2qgx h ALA 51 N 1.09 0.86 -0.88 5.32 0.00 -1.89 -2.80 119.26 120.95 2qgx h ALA 51 Ca -0.48 -0.34 0.16 0.00 0.00 0.00 0.00 54.91 54.24 2qgx h ALA 51 Cb 1.20 -0.18 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 2qgx h ALA 51 CO 0.64 0.65 0.57 1.25 0.00 0.00 0.00 179.25 182.35 2qgx h LEU 52 N 0.82 0.58 -0.49 0.00 5.85 -1.90 0.27 115.31 120.45 2qgx h LEU 52 Ca 0.13 0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.89 2qgx h LEU 52 Cb 0.65 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 2qgx h LEU 52 CO 0.05 0.28 0.29 -0.74 -0.34 0.00 0.00 178.44 177.97 2qgx h HIS 53 N 0.60 0.65 0.00 1.25 2.76 -1.67 -1.06 115.15 117.68 2qgx h HIS 53 Ca 0.45 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.51 2qgx h HIS 53 Cb 0.84 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.57 2qgx h HIS 53 CO -0.00 0.46 -0.48 -0.91 -1.30 0.00 0.00 177.93 175.70 2qgx h ASN 54 N 0.65 0.00 -0.44 3.26 2.35 -1.17 -1.84 115.58 118.40 2qgx h ASN 54 Ca 0.17 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 2qgx h ASN 54 Cb 0.01 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.37 2qgx h ASN 54 CO -0.03 0.48 -0.06 0.44 -1.65 0.00 0.00 177.43 176.61 2qgx h ASP 55 N 0.00 0.81 0.08 5.81 3.32 -0.51 -0.16 116.42 125.78 2qgx h ASP 55 Ca -0.00 -0.34 -0.15 0.00 0.02 0.00 0.00 57.03 56.55 2qgx h ASP 55 Cb 0.92 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.24 2qgx h ASP 55 CO 0.06 0.96 -0.54 -0.07 -1.72 0.00 0.00 179.24 177.93 2qgx h LEU 56 N 0.64 0.54 -0.35 1.55 3.38 -1.10 -0.39 115.31 119.58 2qgx h LEU 56 Ca 0.12 -0.28 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 2qgx h LEU 56 Cb 0.58 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2qgx h LEU 56 CO 0.03 0.97 0.11 1.56 0.09 0.00 0.00 178.44 181.20 2qgx h GLN 57 N 0.38 0.55 -0.08 1.13 1.08 -1.22 -1.48 115.11 115.47 2qgx h GLN 57 Ca 0.01 -0.12 -0.05 0.00 -1.45 0.00 0.00 58.65 57.04 2qgx h GLN 57 Cb 1.06 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.40 2qgx h GLN 57 CO 0.10 0.57 -0.17 0.82 -0.95 0.00 0.00 178.83 179.20 2qgx h ILE 58 N 0.42 1.17 0.00 2.54 2.04 -0.90 -2.63 117.51 120.13 2qgx h ILE 58 Ca 0.11 -0.76 -0.11 0.00 1.00 0.00 0.00 64.86 65.11 2qgx h ILE 58 Cb 0.26 1.30 -0.02 0.00 -0.74 0.00 0.00 36.82 37.62 2qgx h ILE 58 CO -0.00 0.23 -0.50 0.25 0.00 0.00 0.00 178.15 178.12 2qgx h LEU 59 N 0.12 0.00 0.26 1.44 5.85 -0.56 -2.76 115.31 119.66 2qgx h LEU 59 Ca 0.02 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2qgx h LEU 59 Cb 0.37 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.41 2qgx h LEU 59 CO 0.02 0.50 -0.12 0.50 -0.34 0.00 0.00 178.44 179.00 2qgx h LYS 60 N 0.00 -0.33 0.00 1.25 3.64 -0.90 0.11 116.57 120.34 2qgx h LYS 60 Ca -0.01 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 2qgx h LYS 60 Cb 1.06 0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.95 2qgx h LYS 60 CO 0.07 -0.04 -0.07 1.49 -2.27 0.00 0.00 179.45 178.63 2qgx h GLU 61 N -0.99 0.00 0.00 1.90 4.22 -1.65 0.11 114.58 118.16 2qgx h GLU 61 Ca -0.04 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.40 2qgx h GLU 61 Cb 0.45 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.70 2qgx h GLU 61 CO 0.06 0.07 0.00 1.17 -2.18 0.00 0.00 179.01 178.13 2qgx n LYS 62 N -4.44 0.00 0.00 1.92 3.00 -1.04 -4.66 118.16 112.94 2qgx n LYS 62 Ca -0.03 0.33 0.11 0.00 -0.00 0.00 0.00 58.31 58.72 2qgx n LYS 62 Cb 0.15 -0.82 -0.01 0.00 0.00 0.00 0.00 35.03 34.35 2qgx n LYS 62 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2qgx n GLU 63 N -1.65 0.61 0.00 1.64 2.13 0.29 -4.99 120.64 118.67 2qgx n GLU 63 Ca 0.00 -0.49 0.00 0.00 0.66 0.00 0.00 57.16 57.33 2qgx n GLU 63 Cb 0.00 -1.49 0.00 0.00 0.27 0.00 0.00 31.44 30.22 2qgx n GLU 63 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2qgx n GLY 64 N 1.45 3.05 3.64 8.31 0.00 0.37 -4.97 105.19 117.03 2qgx n GLY 64 Ca 0.07 -0.40 -0.43 0.00 0.00 0.00 0.00 46.02 45.26 2qgx n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qgx s ALA 65 N -2.06 3.50 -1.39 4.61 0.00 -1.23 -4.65 121.76 120.55 2qgx s ALA 65 Ca 0.00 -0.08 0.16 0.00 0.00 0.00 0.00 51.96 52.03 2qgx s ALA 65 Cb 0.00 -3.64 0.45 0.00 0.00 0.00 0.00 23.12 19.93 2qgx s ALA 65 CO 0.00 -1.45 1.37 -0.40 0.00 0.00 0.00 175.76 175.28 2qgx n ASP 66 N 6.80 3.36 -4.44 0.00 3.85 -1.26 -3.11 116.55 121.76 2qgx n ASP 66 Ca 0.11 -2.00 -0.21 0.00 -0.71 0.00 0.00 54.79 51.98 2qgx n ASP 66 Cb 0.47 -0.34 -0.10 0.00 -1.35 0.00 0.00 41.12 39.80 2qgx n ASP 66 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.20 176.91 2qgx s PHE 67 N -1.01 1.96 -0.29 2.11 -0.12 -1.26 -4.80 117.98 114.57 2qgx s PHE 67 Ca 0.34 -0.75 -0.08 0.00 -0.05 0.00 0.00 56.93 56.39 2qgx s PHE 67 Cb 0.18 -1.16 -0.01 0.00 -0.63 0.00 0.00 43.02 41.39 2qgx s PHE 67 CO 0.23 0.23 0.11 0.42 -0.05 0.00 0.00 175.22 176.16 2qgx s ILE 68 N -3.07 4.35 -0.48 -4.49 1.01 -0.82 -4.44 121.20 113.27 2qgx s ILE 68 Ca 0.31 -0.41 -0.23 0.00 0.00 0.00 0.00 60.65 60.32 2qgx s ILE 68 Cb 0.05 -3.17 0.03 0.00 0.01 0.00 0.00 42.46 39.39 2qgx s ILE 68 CO 0.13 0.16 0.81 -0.22 0.00 0.00 0.00 174.94 175.82 2qgx s LEU 69 N 1.59 4.26 0.16 2.97 2.96 0.13 0.03 118.68 130.77 2qgx s LEU 69 Ca 0.05 -0.21 -0.01 0.00 -0.22 0.00 0.00 54.13 53.73 2qgx s LEU 69 Cb -0.16 -2.91 -0.04 0.00 0.50 0.00 0.00 46.19 43.58 2qgx s LEU 69 CO 0.04 -0.99 0.35 -0.76 -1.32 0.00 0.00 176.35 173.67 2qgx s LEU 70 N 3.40 4.27 -0.20 -0.68 1.43 0.96 -0.74 118.68 127.12 2qgx s LEU 70 Ca 0.29 0.41 0.01 0.00 -1.03 0.00 0.00 54.13 53.81 2qgx s LEU 70 Cb -0.13 -3.15 0.04 0.00 0.03 0.00 0.00 46.19 42.99 2qgx s LEU 70 CO 0.21 0.03 -0.11 0.21 0.23 0.00 0.00 176.35 176.92 2qgx s ASN 71 N -2.86 3.45 -0.33 2.29 3.04 0.01 -0.62 114.94 119.93 2qgx s ASN 71 Ca 0.38 -0.91 -0.12 0.00 0.04 0.00 0.00 52.86 52.25 2qgx s ASN 71 Cb -0.12 -1.26 -0.02 0.00 -1.54 0.00 0.00 41.25 38.31 2qgx s ASN 71 CO 0.28 -0.14 0.23 -0.36 -3.04 0.00 0.00 177.10 174.06 2qgx s PHE 72 N 1.38 3.22 -0.20 0.43 0.40 0.22 -2.18 117.98 121.24 2qgx s PHE 72 Ca -0.02 -0.16 -0.04 0.00 -0.60 0.00 0.00 56.93 56.11 2qgx s PHE 72 Cb -0.16 -2.45 -0.02 0.00 0.51 0.00 0.00 43.02 40.90 2qgx s PHE 72 CO -0.08 -0.32 -0.03 0.45 0.70 0.00 0.00 175.22 175.94 2qgx s SER 73 N 1.72 4.56 0.00 1.36 0.15 -0.95 -0.86 113.70 119.68 2qgx s SER 73 Ca 0.06 -0.29 0.16 0.00 0.70 0.00 0.00 55.95 56.58 2qgx s SER 73 Cb -0.17 -1.78 0.16 0.00 -1.71 0.00 0.00 66.02 62.53 2qgx s SER 73 CO 0.10 0.03 1.04 0.49 1.20 0.00 0.00 173.24 176.11 2qgx n PHE 74 N 4.45 0.09 0.02 3.44 3.72 -0.67 -1.43 117.46 127.08 2qgx n PHE 74 Ca -0.18 -0.07 -0.01 0.00 -0.05 0.00 0.00 57.45 57.15 2qgx n PHE 74 Cb 0.51 -0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 39.05 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 3.04 -0.07 -4.55 -1.08 1.57 -1.92 -2.74 116.57 110.81 2qgx h LYS 75 Ca 0.00 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 58.14 2qgx h LYS 75 Cb 0.67 0.02 -0.39 0.00 0.08 0.00 0.00 32.23 32.61 2qgx h LYS 75 CO 0.00 -0.05 -0.76 -0.51 -0.57 0.00 0.00 179.45 177.57 2qgx s ASP 76 N -2.36 4.42 -0.45 0.86 -0.00 -1.26 -4.18 116.67 113.70 2qgx s ASP 76 Ca -0.01 -1.70 0.06 0.00 -0.00 0.00 0.00 52.55 50.89 2qgx s ASP 76 Cb 0.00 -1.44 0.19 0.00 -0.00 0.00 0.00 42.92 41.68 2qgx s ASP 76 CO 0.04 -0.30 0.54 -3.20 -0.00 0.00 0.00 175.17 172.25 2qgx n ASN 77 N 4.45 -1.62 -4.77 0.27 4.05 -1.26 -4.84 115.26 111.54 2qgx n ASN 77 Ca -0.05 -2.68 -0.38 0.00 0.45 0.00 0.00 54.58 51.92 2qgx n ASN 77 Cb 0.42 0.42 0.00 0.00 1.23 0.00 0.00 39.78 41.86 2qgx n ASN 77 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 2qgx s PHE 78 N 0.23 2.77 -1.11 1.20 5.36 -1.04 -0.06 117.98 125.34 2qgx s PHE 78 Ca 0.32 1.47 0.25 0.00 -0.96 0.00 0.00 56.93 58.01 2qgx s PHE 78 Cb 0.06 -3.54 0.42 0.00 -0.34 0.00 0.00 43.02 39.62 2qgx s PHE 78 CO -0.14 -1.91 1.35 -2.30 -1.46 0.00 0.00 175.22 170.76 2qgx n PRO 79 N -0.34 0.12 0.16 10.12 -0.02 -1.26 -4.84 135.00 138.94 2qgx n PRO 79 Ca 0.06 -0.08 -0.15 0.00 -2.02 0.00 0.00 63.50 61.31 2qgx n PRO 79 Cb 0.46 -1.50 -0.08 0.00 -0.02 0.00 0.00 33.50 32.36 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 0.19 -1.22 -3.32 6.00 0.04 -1.80 -3.34 116.94 113.49 2qgx h PHE 80 Ca 0.00 0.02 -0.49 0.00 2.80 0.00 0.00 57.97 60.30 2qgx h PHE 80 Cb 0.51 0.50 0.02 0.00 2.20 0.00 0.00 35.95 39.18 2qgx h PHE 80 CO 0.00 -0.55 -0.00 -0.51 -0.60 0.00 0.00 178.31 176.65 2qgx s ASP 81 N -4.63 6.31 0.86 2.17 1.01 0.91 -4.69 116.67 118.60 2qgx s ASP 81 Ca -0.17 0.78 -0.11 0.00 0.71 0.00 0.00 52.55 53.76 2qgx s ASP 81 Cb 0.07 -2.18 0.11 0.00 1.01 0.00 0.00 42.92 41.93 2qgx s ASP 81 CO 0.63 -0.45 1.16 -2.84 0.21 0.00 0.00 175.17 173.88 2qgx s PRO 82 N -4.44 1.40 0.44 8.23 0.02 -1.26 -3.71 135.00 135.68 2qgx s PRO 82 Ca 0.45 1.57 -0.24 0.00 0.02 0.00 0.00 61.00 62.80 2qgx s PRO 82 Cb -0.10 -1.77 -0.08 0.00 0.02 0.00 0.00 34.50 32.57 2qgx s PRO 82 CO 0.40 -2.35 1.21 -2.14 -0.33 0.00 0.00 177.00 173.79 2qgx s PRO 83 N -4.50 3.81 -1.14 5.54 0.02 -1.26 -4.43 135.00 133.04 2qgx s PRO 83 Ca 0.68 1.92 -0.20 0.00 0.02 0.00 0.00 61.00 63.42 2qgx s PRO 83 Cb -0.24 -2.53 0.07 0.00 0.02 0.00 0.00 34.50 31.82 2qgx s PRO 83 CO 0.55 -0.55 1.55 0.12 -0.33 0.00 0.00 177.00 178.34 2qgx s PHE 84 N -1.43 2.70 -0.11 6.54 5.36 -0.51 -4.92 117.98 125.62 2qgx s PHE 84 Ca 0.61 -1.24 -0.14 0.00 -0.96 0.00 0.00 56.93 55.20 2qgx s PHE 84 Cb -0.32 -4.69 -0.05 0.00 -0.34 0.00 0.00 43.02 37.62 2qgx s PHE 84 CO 0.40 -1.84 0.34 0.08 -1.46 0.00 0.00 175.22 172.74 2qgx s VAL 85 N 4.41 5.23 0.06 3.12 1.01 -1.26 -2.23 120.40 130.74 2qgx s VAL 85 Ca 0.48 0.66 -0.05 0.00 0.00 0.00 0.00 61.98 63.07 2qgx s VAL 85 Cb 0.01 -3.66 -0.02 0.00 0.00 0.00 0.00 36.38 32.72 2qgx s VAL 85 CO -0.02 0.45 0.09 0.00 0.00 0.00 0.00 175.10 175.62 2qgx s ARG 86 N -0.07 0.67 -0.22 2.72 1.70 -0.93 -4.09 118.95 118.73 2qgx s ARG 86 Ca 0.20 -0.93 -0.16 0.00 -0.47 0.00 0.00 55.73 54.36 2qgx s ARG 86 Cb -0.14 0.26 -0.04 0.00 -0.57 0.00 0.00 34.95 34.46 2qgx s ARG 86 CO 0.07 -0.17 0.42 0.08 -1.08 0.00 0.00 175.30 174.62 2qgx s VAL 87 N -3.31 5.17 -0.19 4.99 1.01 0.28 -0.81 120.40 127.55 2qgx s VAL 87 Ca 0.01 0.73 -0.23 0.00 0.00 0.00 0.00 61.98 62.50 2qgx s VAL 87 Cb 0.03 -3.75 -0.21 0.00 0.00 0.00 0.00 36.38 32.45 2qgx s VAL 87 CO -0.08 0.21 0.36 0.58 0.00 0.00 0.00 175.10 176.17 2qgx h VAL 88 N 5.14 1.10 -1.73 2.92 2.07 -1.27 -3.40 116.25 121.09 2qgx h VAL 88 Ca -0.34 -2.23 0.05 0.00 0.82 0.00 0.00 66.70 64.99 2qgx h VAL 88 Cb 1.16 2.51 -0.21 0.00 -1.52 0.00 0.00 31.29 33.22 2qgx h VAL 88 CO 0.71 0.41 0.45 -0.94 0.02 0.00 0.00 177.57 178.22 2qgx s SER 89 N -6.73 -0.44 0.92 0.57 1.04 -1.21 -4.79 113.70 103.05 2qgx s SER 89 Ca -0.26 0.45 -0.06 0.00 0.48 0.00 0.00 55.95 56.56 2qgx s SER 89 Cb 0.04 0.37 0.09 0.00 0.10 0.00 0.00 66.02 66.62 2qgx s SER 89 CO 0.63 -0.43 0.53 -2.65 0.98 0.00 0.00 173.24 172.30 2qgx n PRO 90 N 0.69 -0.40 -2.46 4.02 -0.02 -1.26 0.17 135.00 135.74 2qgx n PRO 90 Ca -0.12 -0.91 -0.41 0.00 -2.02 0.00 0.00 63.50 60.03 2qgx n PRO 90 Cb 0.58 -0.52 -0.03 0.00 -0.02 0.00 0.00 33.50 33.50 2qgx n PRO 90 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2qgx s VAL 91 N -2.04 3.92 0.01 -1.45 1.01 -1.26 -4.97 120.40 115.62 2qgx s VAL 91 Ca 0.31 1.52 0.05 0.00 0.00 0.00 0.00 61.98 63.86 2qgx s VAL 91 Cb -0.01 -3.97 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 2qgx s VAL 91 CO 0.22 0.20 -0.16 -0.76 0.00 0.00 0.00 175.10 174.59 2qgx s LEU 92 N 0.28 2.09 -0.12 3.92 1.43 -1.26 -0.79 118.68 124.23 2qgx s LEU 92 Ca 0.54 -0.37 0.01 0.00 -1.03 0.00 0.00 54.13 53.28 2qgx s LEU 92 Cb -0.30 -0.80 -0.01 0.00 0.03 0.00 0.00 46.19 45.11 2qgx s LEU 92 CO 0.33 0.15 -0.17 -0.55 0.23 0.00 0.00 176.35 176.34 2qgx s SER 93 N -0.69 3.70 0.00 2.29 0.15 -0.94 -4.80 113.70 113.41 2qgx s SER 93 Ca 0.05 -0.40 0.00 0.00 0.70 0.00 0.00 55.95 56.30 2qgx s SER 93 Cb -0.07 -1.53 0.00 0.00 -1.71 0.00 0.00 66.02 62.71 2qgx s SER 93 CO 0.00 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.22 2qgx n GLY 94 N 3.50 -3.56 2.65 9.45 0.00 -1.26 -1.76 105.19 114.21 2qgx n GLY 94 Ca -0.18 -1.97 -0.10 0.00 0.00 0.00 0.00 46.02 43.77 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 -0.19 1.00 2.37 -0.02 0.00 -1.17 -2.29 105.19 104.89 2qgx n GLY 95 Ca 0.00 -0.11 -0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.35 0.00 -2.43 1.61 4.01 -1.26 -4.65 117.16 112.08 2qgx n TYR 96 Ca -0.10 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.22 2qgx n TYR 96 Cb 0.50 -0.79 -0.03 0.00 -0.31 0.00 0.00 39.34 38.71 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 -1.65 3.85 1.33 -0.72 1.01 -0.97 -1.83 120.40 121.41 2qgx s VAL 97 Ca 0.00 0.74 -0.22 0.00 0.00 0.00 0.00 61.98 62.50 2qgx s VAL 97 Cb 0.00 -4.49 0.33 0.00 0.00 0.00 0.00 36.38 32.22 2qgx s VAL 97 CO 0.00 -1.19 1.04 -0.76 0.00 0.00 0.00 175.10 174.20 2qgx s LEU 98 N 5.76 -0.18 -0.50 3.92 1.43 0.81 -4.62 118.68 125.30 2qgx s LEU 98 Ca 0.51 0.60 -0.27 0.00 -1.03 0.00 0.00 54.13 53.94 2qgx s LEU 98 Cb -0.10 -2.12 0.03 0.00 0.03 0.00 0.00 46.19 44.03 2qgx s LEU 98 CO 0.26 -4.79 1.02 -0.83 0.23 0.00 0.00 176.35 172.23 2qgx s GLY 99 N -3.73 1.37 0.00 -3.19 0.00 -1.26 -3.10 107.32 97.41 2qgx s GLY 99 Ca 0.71 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 44.64 2qgx s GLY 99 CO 0.56 2.20 0.00 0.61 0.00 0.00 0.00 173.10 176.47 2qgx n GLY 100 N 4.96 1.28 0.00 0.20 0.00 -1.26 -4.76 105.19 105.62 2qgx n GLY 100 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 0.00 2.02 3.52 -0.02 0.00 -1.18 -0.66 105.19 108.86 2qgx n GLY 101 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 2qgx n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qgx n ALA 102 N 0.00 -1.25 -4.05 4.61 0.00 -1.26 -0.55 120.51 118.01 2qgx n ALA 102 Ca 0.00 -0.32 -0.31 0.00 0.00 0.00 0.00 53.44 52.81 2qgx n ALA 102 Cb 0.00 -1.95 -0.16 0.00 0.00 0.00 0.00 19.45 17.33 2qgx n ALA 102 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2qgx s ILE 103 N -2.02 1.75 -1.24 0.00 1.01 -1.26 -0.13 121.20 119.30 2qgx s ILE 103 Ca 0.67 -0.78 -0.09 0.00 0.00 0.00 0.00 60.65 60.45 2qgx s ILE 103 Cb -0.31 -1.63 0.19 0.00 0.01 0.00 0.00 42.46 40.71 2qgx s ILE 103 CO 0.57 0.46 1.77 0.00 0.00 0.00 0.00 174.94 177.73 2qgx s MET 105 N 0.03 2.99 0.11 0.00 -1.94 -1.26 -4.89 119.30 114.34 2qgx s MET 105 Ca 0.39 -0.74 -0.19 0.00 -1.71 0.00 0.00 55.69 53.44 2qgx s MET 105 Cb 0.07 -2.74 -0.06 0.00 2.01 0.00 0.00 34.83 34.12 2qgx s MET 105 CO 0.02 0.53 1.68 1.49 -0.01 0.00 0.00 175.02 178.73 2qgx h GLU 106 N 2.77 0.37 0.00 2.03 4.22 -1.94 -2.86 114.58 119.18 2qgx h GLU 106 Ca -0.47 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 58.91 2qgx h GLU 106 Cb 1.18 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2qgx h GLU 106 CO 0.66 0.37 0.00 1.47 -2.18 0.00 0.00 179.01 179.33 2qgx n LEU 107 N -4.81 0.03 -1.13 1.64 -0.00 -1.25 -2.23 117.00 109.25 2qgx n LEU 107 Ca -0.03 0.51 0.09 0.00 -0.00 0.00 0.00 56.01 56.58 2qgx n LEU 107 Cb 0.10 -0.50 0.26 0.00 -0.00 0.00 0.00 43.42 43.28 2qgx n LEU 107 CO 0.35 -0.22 0.72 0.18 -0.00 0.00 0.00 177.39 178.42 2qgx n LEU 108 N -1.54 3.30 -4.63 1.47 4.77 -1.08 -3.34 117.00 115.95 2qgx n LEU 108 Ca 0.04 -1.65 -0.23 0.00 -0.03 0.00 0.00 56.01 54.14 2qgx n LEU 108 Cb 0.20 -0.42 -0.08 0.00 -2.33 0.00 0.00 43.42 40.80 2qgx n LEU 108 CO 0.16 0.74 -0.33 -0.89 -1.33 0.00 0.00 177.39 175.74 2qgx s THR 109 N -1.38 3.28 0.32 -5.08 2.01 -0.95 -4.77 115.64 109.07 2qgx s THR 109 Ca 0.39 -1.95 0.09 0.00 0.31 0.00 0.00 61.69 60.52 2qgx s THR 109 Cb 0.22 -2.80 0.31 0.00 0.01 0.00 0.00 72.50 70.24 2qgx s THR 109 CO 0.24 -0.35 1.74 0.11 -0.69 0.00 0.00 174.62 175.67 2qgx h LYS 110 N 1.90 0.60 0.08 4.92 1.57 -1.87 0.85 116.57 124.61 2qgx h LYS 110 Ca -0.44 -0.04 -0.29 0.00 -1.87 0.00 0.00 60.65 58.02 2qgx h LYS 110 Cb 1.25 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 2qgx h LYS 110 CO 0.61 0.39 -1.48 1.96 -0.57 0.00 0.00 179.45 180.36 2qgx h GLN 111 N 0.61 0.17 -0.01 3.15 7.50 -1.93 -3.32 115.11 121.28 2qgx h GLN 111 Ca 0.63 -0.28 0.00 0.00 0.50 0.00 0.00 58.65 59.50 2qgx h GLN 111 Cb 1.16 0.11 0.00 0.00 0.05 0.00 0.00 27.48 28.80 2qgx h GLN 111 CO -0.46 1.00 -0.25 0.41 -1.50 0.00 0.00 178.83 178.03 2qgx n GLY 112 N 1.60 -0.60 3.90 3.46 0.00 -0.87 -4.91 105.19 107.77 2qgx n GLY 112 Ca -0.14 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 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 -2.48 3.54 -0.02 1.61 -0.11 0.24 -3.85 118.94 117.87 2qgx s TRP 113 Ca 0.25 0.41 0.03 0.00 1.22 0.00 0.00 56.10 58.01 2qgx s TRP 113 Cb 0.19 -1.87 -0.00 0.00 -1.50 0.00 0.00 33.47 30.29 2qgx s TRP 113 CO 0.51 0.59 -0.11 0.45 -4.62 0.00 0.00 176.95 173.78 2qgx s SER 114 N -2.12 1.33 0.00 5.86 0.15 -1.26 -4.95 113.70 112.71 2qgx s SER 114 Ca 0.32 -0.21 0.11 0.00 0.70 0.00 0.00 55.95 56.87 2qgx s SER 114 Cb -0.13 -0.26 0.47 0.00 -1.71 0.00 0.00 66.02 64.39 2qgx s SER 114 CO 0.22 0.11 1.33 -1.54 1.20 0.00 0.00 173.24 174.55 2qgx n SER 115 N 3.05 0.00 -0.98 5.45 3.41 -1.25 -1.93 113.62 121.37 2qgx n SER 115 Ca -0.16 0.45 0.11 0.00 -0.26 0.00 0.00 58.87 59.00 2qgx n SER 115 Cb 0.55 -0.47 0.27 0.00 -0.26 0.00 0.00 64.21 64.30 2qgx n SER 115 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qgx n ALA 116 N -1.47 2.44 -1.76 7.33 0.00 -1.26 -4.90 120.51 120.89 2qgx n ALA 116 Ca 0.03 -0.89 -0.39 0.00 0.00 0.00 0.00 53.44 52.19 2qgx n ALA 116 Cb 0.12 -0.95 -0.06 0.00 0.00 0.00 0.00 19.45 18.56 2qgx n ALA 116 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2qgx s TYR 117 N -1.48 3.82 0.63 0.00 1.51 -0.81 -5.05 117.35 115.97 2qgx s TYR 117 Ca 0.37 1.84 -0.14 0.00 -1.01 0.00 0.00 57.07 58.13 2qgx s TYR 117 Cb 0.21 -3.05 -0.02 0.00 -0.11 0.00 0.00 41.96 38.98 2qgx s TYR 117 CO 0.29 0.13 1.05 0.45 -1.11 0.00 0.00 175.55 176.36 2qgx s SER 118 N -1.18 5.68 -0.14 2.29 0.15 -1.26 -4.98 113.70 114.25 2qgx s SER 118 Ca 0.44 1.71 -0.19 0.00 0.70 0.00 0.00 55.95 58.61 2qgx s SER 118 Cb -0.26 -2.51 -0.25 0.00 -1.71 0.00 0.00 66.02 61.29 2qgx s SER 118 CO 0.33 -1.24 0.47 0.40 1.20 0.00 0.00 173.24 174.40 2qgx h ILE 119 N -0.04 1.08 -0.59 6.45 1.08 -1.96 -2.29 117.51 121.23 2qgx h ILE 119 Ca -0.45 -2.32 0.13 0.00 -0.39 0.00 0.00 64.86 61.82 2qgx h ILE 119 Cb 1.21 2.65 -0.03 0.00 -3.07 0.00 0.00 36.82 37.58 2qgx h ILE 119 CO 0.57 0.58 0.40 1.05 -0.69 0.00 0.00 178.15 180.07 2qgx h GLU 120 N -0.58 0.25 0.41 2.37 -0.00 -1.95 0.13 114.58 115.20 2qgx h GLU 120 Ca -0.28 -0.01 -0.02 0.00 -0.00 0.00 0.00 59.36 59.04 2qgx h GLU 120 Cb 1.54 -0.06 0.00 0.00 -0.00 0.00 0.00 28.75 30.24 2qgx h GLU 120 CO -0.03 0.16 -0.20 1.03 -0.00 0.00 0.00 179.01 179.98 2qgx h SER 121 N 0.25 -0.47 -0.92 3.06 0.87 -1.96 0.13 113.55 114.52 2qgx h SER 121 Ca 0.28 -0.08 0.17 0.00 -1.23 0.00 0.00 61.79 60.93 2qgx h SER 121 Cb 0.76 0.12 -0.08 0.00 -0.44 0.00 0.00 62.40 62.76 2qgx h SER 121 CO -0.06 -0.19 0.59 0.58 -0.53 0.00 0.00 176.83 177.22 2qgx h VAL 122 N -0.74 0.76 -0.35 2.23 2.07 -0.61 0.75 116.25 120.35 2qgx h VAL 122 Ca -0.06 -0.21 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 2qgx h VAL 122 Cb 0.52 0.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.37 2qgx h VAL 122 CO 0.09 0.11 -0.17 0.40 0.02 0.00 0.00 177.57 178.03 2qgx h ILE 123 N 0.61 1.29 -0.36 4.57 2.04 -0.53 -2.14 117.51 122.99 2qgx h ILE 123 Ca 0.48 -1.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.04 2qgx h ILE 123 Cb 0.90 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.34 2qgx h ILE 123 CO -0.23 0.42 0.15 0.24 0.00 0.00 0.00 178.15 178.73 2qgx h MET 124 N 0.51 0.53 -0.13 2.37 2.86 0.14 -2.55 114.93 118.67 2qgx h MET 124 Ca 0.08 -0.09 -0.01 0.00 -2.06 0.00 0.00 59.70 57.61 2qgx h MET 124 Cb 0.71 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.27 2qgx h MET 124 CO 0.05 0.51 0.03 1.96 1.06 0.00 0.00 176.91 180.52 2qgx h GLN 125 N 0.43 0.20 -0.84 1.72 1.08 -0.99 -2.43 115.11 114.29 2qgx h GLN 125 Ca 0.12 -0.05 0.15 0.00 -1.45 0.00 0.00 58.65 57.42 2qgx h GLN 125 Cb 0.17 -0.03 -0.10 0.00 -0.05 0.00 0.00 27.48 27.48 2qgx h GLN 125 CO -0.01 0.36 0.42 0.82 -0.95 0.00 0.00 178.83 179.46 2qgx h ILE 126 N 0.01 0.71 -0.22 2.54 2.04 -1.35 0.11 117.51 121.35 2qgx h ILE 126 Ca 0.04 -0.20 -0.08 0.00 1.00 0.00 0.00 64.86 65.62 2qgx h ILE 126 Cb 0.24 0.07 -0.01 0.00 -0.74 0.00 0.00 36.82 36.38 2qgx h ILE 126 CO -0.00 0.11 -0.22 -1.28 0.00 0.00 0.00 178.15 176.75 2qgx h SER 127 N 0.59 0.39 0.59 1.72 0.87 -1.30 -2.58 113.55 113.83 2qgx h SER 127 Ca 0.46 -0.12 -0.25 0.00 -1.23 0.00 0.00 61.79 60.65 2qgx h SER 127 Cb 0.67 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 2qgx h SER 127 CO -0.37 0.63 -1.12 0.00 -0.53 0.00 0.00 176.83 175.43 2qgx h ALA 128 N 1.41 0.22 0.00 6.23 0.00 -0.46 -3.15 119.26 123.51 2qgx h ALA 128 Ca 0.06 -0.83 0.00 0.00 0.00 0.00 0.00 54.91 54.14 2qgx h ALA 128 Cb 0.59 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.37 2qgx h ALA 128 CO 0.04 0.95 0.00 1.79 0.00 0.00 0.00 179.25 182.03 2qgx h THR 129 N 0.11 0.00 -0.20 0.00 1.35 -0.84 -0.35 112.91 112.98 2qgx h THR 129 Ca -0.10 -0.66 -0.16 0.00 -0.55 0.00 0.00 66.41 64.94 2qgx h THR 129 Cb 1.82 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 69.86 2qgx h THR 129 CO 0.18 0.00 -0.53 -0.07 -0.25 0.00 0.00 175.52 174.86 2qgx h LEU 130 N 0.00 0.62 0.11 3.87 3.38 -1.42 0.04 115.31 121.91 2qgx h LEU 130 Ca 0.00 -0.32 -0.14 0.00 0.09 0.00 0.00 57.88 57.50 2qgx h LEU 130 Cb 0.73 -0.18 0.02 0.00 0.09 0.00 0.00 40.66 41.32 2qgx h LEU 130 CO 0.00 1.03 -0.63 0.58 0.09 0.00 0.00 178.44 179.51 2qgx h VAL 131 N 0.44 1.58 -0.79 1.22 2.07 -1.47 0.03 116.25 119.33 2qgx h VAL 131 Ca 0.01 -2.49 -0.02 0.00 0.82 0.00 0.00 66.70 65.02 2qgx h VAL 131 Cb 1.07 3.24 -0.04 0.00 -1.52 0.00 0.00 31.29 34.04 2qgx h VAL 131 CO 0.10 0.69 0.43 0.11 0.02 0.00 0.00 177.57 178.92 2qgx h LYS 132 N -0.52 1.10 0.00 1.57 1.57 -1.13 -1.08 116.57 118.09 2qgx h LYS 132 Ca -0.11 -0.12 0.00 0.00 -1.87 0.00 0.00 60.65 58.54 2qgx h LYS 132 Cb 1.49 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 33.59 2qgx h LYS 132 CO 0.12 0.81 0.00 0.41 -0.57 0.00 0.00 179.45 180.21 2qgx n GLY 133 N -1.17 -0.99 3.60 3.86 0.00 -0.00 -4.92 105.19 105.57 2qgx n GLY 133 Ca 0.08 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.92 -3.13 -2.30 1.61 5.02 -0.41 -3.03 118.16 114.99 2qgx n LYS 134 Ca 0.20 0.62 -0.35 0.00 -2.02 0.00 0.00 58.31 56.76 2qgx n LYS 134 Cb 0.09 -4.96 -0.00 0.00 -0.02 0.00 0.00 35.03 30.13 2qgx n LYS 134 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qgx s ALA 135 N -3.55 2.72 -0.01 7.82 0.00 -0.01 -4.65 121.76 124.08 2qgx s ALA 135 Ca 0.25 0.78 -0.01 0.00 0.00 0.00 0.00 51.96 52.98 2qgx s ALA 135 Cb -0.07 -3.34 0.01 0.00 0.00 0.00 0.00 23.12 19.72 2qgx s ALA 135 CO 0.81 -0.69 0.03 1.03 0.00 0.00 0.00 175.76 176.94 2qgx s ARG 136 N -3.29 0.03 -0.12 0.00 1.81 -0.72 -4.01 118.95 112.66 2qgx s ARG 136 Ca 0.72 0.06 -0.29 0.00 -1.72 0.00 0.00 55.73 54.50 2qgx s ARG 136 Cb -0.22 -0.01 -0.04 0.00 -0.45 0.00 0.00 34.95 34.22 2qgx s ARG 136 CO 0.26 -0.02 1.66 0.08 -0.68 0.00 0.00 175.30 176.60 2qgx s VAL 137 N 0.13 3.61 -1.25 3.52 1.01 -1.26 -2.21 120.40 123.95 2qgx s VAL 137 Ca -0.01 0.72 -0.19 0.00 0.00 0.00 0.00 61.98 62.50 2qgx s VAL 137 Cb -0.02 -3.53 0.05 0.00 0.00 0.00 0.00 36.38 32.89 2qgx s VAL 137 CO -0.00 -0.14 1.72 -1.10 0.00 0.00 0.00 175.10 175.58 2qgx s GLN 138 N 4.33 3.80 0.56 2.72 -1.52 0.03 -4.79 119.66 124.80 2qgx s GLN 138 Ca 0.74 -1.79 0.24 0.00 -1.95 0.00 0.00 55.36 52.60 2qgx s GLN 138 Cb -0.30 -5.49 1.52 0.00 -0.22 0.00 0.00 33.01 28.53 2qgx s GLN 138 CO 0.29 -2.40 2.13 0.74 -0.25 0.00 0.00 175.29 175.81 2qgx h PHE 139 N 8.09 0.00 0.14 0.91 -1.00 -1.91 -2.47 116.94 120.71 2qgx h PHE 139 Ca 0.39 0.00 -0.26 0.00 2.81 0.00 0.00 57.97 60.92 2qgx h PHE 139 Cb 0.90 0.00 0.03 0.00 3.61 0.00 0.00 35.95 40.48 2qgx h PHE 139 CO 1.39 0.00 -1.09 0.78 -1.61 0.00 0.00 178.31 177.78 2qgx h GLY 140 N 0.00 0.55 -4.72 -1.45 0.00 -1.98 -3.47 103.07 92.00 2qgx h GLY 140 Ca 0.07 -1.24 -0.63 0.00 0.00 0.00 0.00 47.33 45.52 2qgx h GLY 140 CO -0.00 1.09 -0.16 0.00 0.00 0.00 0.00 176.54 177.47 2qgx n ALA 141 N -2.67 -1.40 -1.69 3.60 0.00 -0.93 -4.84 120.51 112.57 2qgx n ALA 141 Ca -0.14 0.41 -0.42 0.00 0.00 0.00 0.00 53.44 53.29 2qgx n ALA 141 Cb 0.92 -1.84 -0.03 0.00 0.00 0.00 0.00 19.45 18.50 2qgx n ALA 141 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2qgx s ASN 142 N -0.74 6.43 -0.54 0.00 3.84 -1.26 -4.93 114.94 117.74 2qgx s ASN 142 Ca 0.61 2.73 -0.22 0.00 0.21 0.00 0.00 52.86 56.19 2qgx s ASN 142 Cb -0.80 -2.55 0.05 0.00 -0.55 0.00 0.00 41.25 37.40 2qgx s ASN 142 CO 0.58 -1.03 0.81 -0.54 -2.79 0.00 0.00 177.10 174.13 2qgx s LYS 143 N 3.50 3.23 -0.01 0.43 3.01 -1.26 0.18 119.74 128.82 2qgx s LYS 143 Ca 0.84 -0.57 0.04 0.00 -1.01 0.00 0.00 55.97 55.27 2qgx s LYS 143 Cb -0.45 -4.08 -0.01 0.00 -1.01 0.00 0.00 37.83 32.28 2qgx s LYS 143 CO 0.39 -1.40 -0.12 -1.12 0.51 0.00 0.00 175.35 173.61 2qgx s SER 144 N 2.84 1.38 0.19 2.83 0.01 -1.26 -5.06 113.70 114.63 2qgx s SER 144 Ca 0.23 -0.21 0.20 0.00 1.31 0.00 0.00 55.95 57.48 2qgx s SER 144 Cb -0.16 -0.16 0.87 0.00 0.21 0.00 0.00 66.02 66.79 2qgx s SER 144 CO 0.15 0.14 1.62 0.00 0.41 0.00 0.00 173.24 175.56 2qgx n GLN 145 N 2.80 0.14 -2.36 12.44 10.64 0.13 -4.68 117.38 136.48 2qgx n GLN 145 Ca -0.14 0.41 -0.35 0.00 -1.83 0.00 0.00 57.00 55.09 2qgx n GLN 145 Cb 0.56 -1.78 -0.01 0.00 -0.86 0.00 0.00 30.24 28.15 2qgx n GLN 145 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2qgx s TYR 146 N -3.26 2.81 -0.24 2.61 2.02 -1.26 -4.24 117.35 115.79 2qgx s TYR 146 Ca 0.04 1.56 -0.26 0.00 -0.37 0.00 0.00 57.07 58.03 2qgx s TYR 146 Cb 0.09 -3.22 0.11 0.00 -0.40 0.00 0.00 41.96 38.53 2qgx s TYR 146 CO 0.32 -1.30 0.94 0.45 -1.57 0.00 0.00 175.55 174.39 2qgx s SER 147 N -1.79 -0.50 0.09 2.29 0.15 0.16 -4.98 113.70 109.11 2qgx s SER 147 Ca 0.70 0.87 -0.20 0.00 0.70 0.00 0.00 55.95 58.02 2qgx s SER 147 Cb -0.22 0.85 -0.08 0.00 -1.71 0.00 0.00 66.02 64.86 2qgx s SER 147 CO 0.25 -0.24 1.63 0.25 1.20 0.00 0.00 173.24 176.33 2qgx h LEU 148 N 3.94 0.29 -1.55 3.45 5.85 -1.97 0.22 115.31 125.54 2qgx h LEU 148 Ca -0.26 -0.17 -0.03 0.00 0.84 0.00 0.00 57.88 58.26 2qgx h LEU 148 Cb 1.17 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 2qgx h LEU 148 CO 0.16 0.38 -0.02 0.00 -0.34 0.00 0.00 178.44 178.62 2qgx h THR 149 N 0.18 1.13 0.07 1.05 1.03 -1.97 0.16 112.91 114.57 2qgx h THR 149 Ca 0.07 -0.51 -0.00 0.00 -0.01 0.00 0.00 66.41 65.95 2qgx h THR 149 Cb 0.18 1.02 0.00 0.00 -1.07 0.00 0.00 68.15 68.29 2qgx h THR 149 CO -0.01 0.17 -0.03 0.03 -0.01 0.00 0.00 175.52 175.67 2qgx h ARG 150 N 0.26 -0.09 -0.18 0.00 3.08 -1.80 -3.02 114.38 112.63 2qgx h ARG 150 Ca 0.06 0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 2qgx h ARG 150 Cb 0.21 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 2qgx h ARG 150 CO 0.01 0.46 -0.13 0.00 -1.07 0.00 0.00 179.97 179.23 2qgx h ALA 151 N 0.05 1.46 -0.07 0.04 0.00 -0.38 -2.85 119.26 117.51 2qgx h ALA 151 Ca -0.01 -0.22 -0.16 0.00 0.00 0.00 0.00 54.91 54.52 2qgx h ALA 151 Cb 0.59 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2qgx h ALA 151 CO 0.02 0.38 -0.67 0.37 0.00 0.00 0.00 179.25 179.35 2qgx h GLN 152 N 0.27 0.31 -0.47 0.00 4.15 -0.77 -1.68 115.11 116.92 2qgx h GLN 152 Ca 0.05 -0.23 0.02 0.00 0.77 0.00 0.00 58.65 59.26 2qgx h GLN 152 Cb 0.40 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 28.10 2qgx h GLN 152 CO 0.02 0.87 0.28 1.96 -1.93 0.00 0.00 178.83 180.03 2qgx h GLN 153 N 0.22 0.55 -0.23 1.69 4.20 -1.37 -0.94 115.11 119.24 2qgx h GLN 153 Ca -0.02 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2qgx h GLN 153 Cb 1.21 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.86 2qgx h GLN 153 CO 0.11 0.36 0.12 0.77 -0.67 0.00 0.00 178.83 179.52 2qgx h SER 154 N 0.57 0.29 -0.33 1.46 0.02 -1.43 -2.31 113.55 111.82 2qgx h SER 154 Ca 0.19 -0.10 0.03 0.00 -0.84 0.00 0.00 61.79 61.07 2qgx h SER 154 Cb 0.01 -0.07 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 2qgx h SER 154 CO -0.08 0.31 0.13 0.22 -1.14 0.00 0.00 176.83 176.26 2qgx h TYR 155 N 0.25 0.23 0.00 3.45 5.03 -1.01 0.38 116.97 125.29 2qgx h TYR 155 Ca 0.08 0.02 -0.04 0.00 2.58 0.00 0.00 58.73 61.37 2qgx h TYR 155 Cb 0.09 -0.05 -0.01 0.00 1.55 0.00 0.00 36.73 38.31 2qgx h TYR 155 CO -0.03 0.10 -0.19 0.87 -1.32 0.00 0.00 178.16 177.59 2qgx h LYS 156 N 0.27 0.00 0.11 1.82 1.57 -1.12 0.54 116.57 119.77 2qgx h LYS 156 Ca 0.15 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.66 2qgx h LYS 156 Cb 0.10 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.42 2qgx h LYS 156 CO -0.14 0.19 -1.19 1.03 -0.57 0.00 0.00 179.45 178.77 2qgx h SER 157 N 0.00 0.52 -0.36 0.86 0.87 -0.75 -0.70 113.55 113.98 2qgx h SER 157 Ca -0.00 -0.51 -0.09 0.00 -1.23 0.00 0.00 61.79 59.95 2qgx h SER 157 Cb 0.37 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 2qgx h SER 157 CO 0.02 1.37 -0.14 -0.07 -0.53 0.00 0.00 176.83 177.49 2qgx h LEU 158 N 0.13 0.76 -2.67 2.23 3.38 0.56 -3.33 115.31 116.37 2qgx h LEU 158 Ca -0.14 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.44 2qgx h LEU 158 Cb 1.89 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 42.44 2qgx h LEU 158 CO 0.20 0.98 0.00 1.33 0.09 0.00 0.00 178.44 181.04 2qgx n VAL 159 N -4.33 0.84 -0.23 1.22 0.24 0.10 -4.38 118.33 111.79 2qgx n VAL 159 Ca -0.02 -0.92 0.00 0.00 -2.04 0.00 0.00 64.34 61.36 2qgx n VAL 159 Cb 0.38 0.59 0.00 0.00 -1.47 0.00 0.00 33.84 33.35 2qgx n VAL 159 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69