#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qhb s ILE 3 N 0.00 4.76 0.36 -0.61 1.01 -1.26 -4.99 121.20 120.46 1qhb s ILE 3 Ca 0.00 2.00 -0.26 0.00 0.00 0.00 0.00 60.65 62.39 1qhb s ILE 3 Cb 0.00 -4.28 -0.12 0.00 0.01 0.00 0.00 42.46 38.07 1qhb s ILE 3 CO 0.00 0.08 1.05 -2.65 0.00 0.00 0.00 174.94 173.42 1qhb n PRO 4 N 4.45 1.48 -4.01 2.79 -0.02 -1.26 -4.99 135.00 133.44 1qhb n PRO 4 Ca 0.08 0.52 -0.12 0.00 -2.02 0.00 0.00 63.50 61.95 1qhb n PRO 4 Cb 0.50 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.94 1qhb n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qhb s ALA 5 N -1.17 0.25 0.20 3.55 0.00 -1.26 -5.16 121.76 118.17 1qhb s ALA 5 Ca 0.60 -1.23 0.11 0.00 0.00 0.00 0.00 51.96 51.44 1qhb s ALA 5 Cb -0.61 1.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.50 1qhb s ALA 5 CO 0.59 -0.85 -0.22 0.34 0.00 0.00 0.00 175.76 175.63 1qhb s ASP 6 N -3.16 3.25 0.21 0.00 -1.08 -1.26 -5.15 116.67 109.49 1qhb s ASP 6 Ca 0.26 -0.89 0.08 0.00 -0.52 0.00 0.00 52.55 51.47 1qhb s ASP 6 Cb -0.02 -0.23 -0.04 0.00 -1.46 0.00 0.00 42.92 41.17 1qhb s ASP 6 CO 0.16 0.07 0.02 0.54 0.52 0.00 0.00 175.17 176.48 1qhb s ASN 7 N -2.80 4.79 0.50 -0.34 4.22 -1.26 -5.13 114.94 114.92 1qhb s ASN 7 Ca 0.21 -0.46 -0.03 0.00 -2.14 0.00 0.00 52.86 50.44 1qhb s ASN 7 Cb -0.07 -1.01 -0.01 0.00 1.28 0.00 0.00 41.25 41.44 1qhb s ASN 7 CO 0.10 0.05 0.77 -0.76 -2.04 0.00 0.00 177.10 175.22 1qhb s LEU 8 N -3.27 3.53 0.32 3.54 1.43 -1.26 -5.11 118.68 117.86 1qhb s LEU 8 Ca 0.29 0.62 0.04 0.00 -1.03 0.00 0.00 54.13 54.05 1qhb s LEU 8 Cb -0.08 -3.50 -0.04 0.00 0.03 0.00 0.00 46.19 42.60 1qhb s LEU 8 CO 0.20 -0.76 0.16 0.00 0.23 0.00 0.00 176.35 176.17 1qhb s GLN 9 N -4.74 1.67 0.58 1.70 -2.07 -1.26 -5.13 119.66 110.41 1qhb s GLN 9 Ca 0.49 -1.96 -0.19 0.00 -1.82 0.00 0.00 55.36 51.88 1qhb s GLN 9 Cb -0.10 -0.19 -0.04 0.00 -1.09 0.00 0.00 33.01 31.59 1qhb s GLN 9 CO 0.42 -0.46 1.23 -1.54 -1.32 0.00 0.00 175.29 173.62 1qhb s SER 10 N -3.42 5.21 0.26 12.60 1.04 -1.26 -4.83 113.70 123.29 1qhb s SER 10 Ca 0.34 2.44 -0.02 0.00 0.48 0.00 0.00 55.95 59.19 1qhb s SER 10 Cb 0.05 -2.60 0.51 0.00 0.10 0.00 0.00 66.02 64.07 1qhb s SER 10 CO 0.18 -1.58 1.75 -0.09 0.98 0.00 0.00 173.24 174.47 1qhb h ARG 11 N 0.99 0.54 -0.81 4.02 9.65 -2.00 -1.87 114.38 124.90 1qhb h ARG 11 Ca -0.50 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.34 1qhb h ARG 11 Cb 1.30 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 29.72 1qhb h ARG 11 CO 0.55 0.35 0.48 0.00 2.80 0.00 0.00 179.97 184.16 1qhb h ALA 12 N 1.55 1.03 -0.34 2.80 0.00 -1.99 -0.60 119.26 121.71 1qhb h ALA 12 Ca 0.45 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 55.13 1qhb h ALA 12 Cb 0.65 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1qhb h ALA 12 CO -0.38 0.50 -0.30 -0.22 0.00 0.00 0.00 179.25 178.86 1qhb h LYS 13 N 1.11 0.71 -0.45 0.00 1.63 -1.77 -1.92 116.57 115.89 1qhb h LYS 13 Ca 0.29 -0.32 -0.12 0.00 -0.85 0.00 0.00 60.65 59.65 1qhb h LYS 13 Cb -0.03 -0.02 -0.01 0.00 -0.60 0.00 0.00 32.23 31.57 1qhb h LYS 13 CO -0.05 0.92 -0.19 0.00 -3.45 0.00 0.00 179.45 176.68 1qhb h ALA 14 N 1.06 0.81 -0.51 5.00 0.00 -1.03 -0.58 119.26 124.02 1qhb h ALA 14 Ca 0.07 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 1qhb h ALA 14 Cb 0.81 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1qhb h ALA 14 CO 0.07 0.65 0.00 1.03 0.00 0.00 0.00 179.25 181.00 1qhb h SER 15 N 0.78 0.88 0.17 0.00 0.87 -0.93 0.37 113.55 115.69 1qhb h SER 15 Ca 0.11 -0.31 -0.01 0.00 -1.23 0.00 0.00 61.79 60.36 1qhb h SER 15 Cb 0.73 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.46 1qhb h SER 15 CO 0.06 0.97 -0.08 0.15 -0.53 0.00 0.00 176.83 177.40 1qhb h PHE 16 N 0.76 -0.21 -0.33 2.24 3.57 -1.08 -2.36 116.94 119.53 1qhb h PHE 16 Ca 0.14 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.62 1qhb h PHE 16 Cb 0.52 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1qhb h PHE 16 CO 0.04 -0.09 0.14 -0.44 -2.23 0.00 0.00 178.31 175.72 1qhb h ASP 17 N -0.26 0.41 -0.36 0.41 3.32 -0.99 -0.99 116.42 117.96 1qhb h ASP 17 Ca -0.02 -0.03 -0.04 0.00 0.02 0.00 0.00 57.03 56.95 1qhb h ASP 17 Cb 0.20 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1qhb h ASP 17 CO 0.04 0.37 0.07 0.74 -1.72 0.00 0.00 179.24 178.74 1qhb h THR 18 N 0.46 1.23 -0.59 0.35 2.02 -0.68 -0.45 112.91 115.26 1qhb h THR 18 Ca 0.12 -0.80 -0.08 0.00 0.77 0.00 0.00 66.41 66.41 1qhb h THR 18 Cb 0.09 1.07 -0.02 0.00 -1.74 0.00 0.00 68.15 67.54 1qhb h THR 18 CO -0.01 0.27 0.04 0.03 0.37 0.00 0.00 175.52 176.22 1qhb h ARG 19 N 0.43 0.99 -0.33 6.66 3.08 -0.99 -1.73 114.38 122.49 1qhb h ARG 19 Ca 0.11 -0.28 -0.10 0.00 0.07 0.00 0.00 59.98 59.78 1qhb h ARG 19 Cb 0.33 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1qhb h ARG 19 CO 0.00 0.95 -0.18 0.28 -1.07 0.00 0.00 179.97 179.95 1qhb h VAL 20 N 0.92 1.29 -0.64 2.04 2.07 -1.12 -2.32 116.25 118.49 1qhb h VAL 20 Ca 0.17 -1.31 0.02 0.00 0.82 0.00 0.00 66.70 66.41 1qhb h VAL 20 Cb 0.48 1.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 1qhb h VAL 20 CO 0.02 0.42 0.42 0.00 0.02 0.00 0.00 177.57 178.46 1qhb h ALA 21 N 0.76 1.60 -0.35 1.67 0.00 -0.94 0.57 119.26 122.56 1qhb h ALA 21 Ca 0.07 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1qhb h ALA 21 Cb 0.73 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1qhb h ALA 21 CO 0.05 0.35 -0.33 0.00 0.00 0.00 0.00 179.25 179.32 1qhb h ALA 22 N 1.61 0.74 -0.53 0.00 0.00 -1.22 0.96 119.26 120.84 1qhb h ALA 22 Ca 0.25 -0.42 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1qhb h ALA 22 Cb -0.01 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 1qhb h ALA 22 CO -0.06 0.66 -0.06 0.00 0.00 0.00 0.00 179.25 179.78 1qhb h ALA 23 N 0.96 0.90 -0.55 0.00 0.00 -0.75 -1.85 119.26 117.97 1qhb h ALA 23 Ca 0.07 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1qhb h ALA 23 Cb 0.88 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1qhb h ALA 23 CO 0.08 0.64 0.06 0.93 0.00 0.00 0.00 179.25 180.96 1qhb h GLU 24 N 0.85 0.92 -0.48 0.00 5.08 -0.54 0.39 114.58 120.81 1qhb h GLU 24 Ca 0.15 -0.26 0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1qhb h GLU 24 Cb 0.59 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.70 1qhb h GLU 24 CO 0.04 0.91 0.27 1.25 -1.00 0.00 0.00 179.01 180.47 1qhb h LEU 25 N 0.81 0.41 -0.71 1.33 6.46 -0.56 0.50 115.31 123.55 1qhb h LEU 25 Ca 0.16 0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.84 1qhb h LEU 25 Cb 0.45 -0.07 -0.02 0.00 -0.73 0.00 0.00 40.66 40.29 1qhb h LEU 25 CO 0.02 0.29 -0.03 0.00 -0.62 0.00 0.00 178.44 178.10 1qhb h ALA 26 N 1.23 0.91 -0.72 1.25 0.00 -1.09 -2.66 119.26 118.19 1qhb h ALA 26 Ca 0.20 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1qhb h ALA 26 Cb 0.06 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1qhb h ALA 26 CO -0.12 0.64 0.40 1.25 0.00 0.00 0.00 179.25 181.43 1qhb h LEU 27 N 0.89 0.89 -1.70 0.00 5.85 -0.50 -2.68 115.31 118.06 1qhb h LEU 27 Ca 0.16 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1qhb h LEU 27 Cb 0.55 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1qhb h LEU 27 CO 0.03 0.73 0.00 0.00 -0.34 0.00 0.00 178.44 178.86 1qhb h ALA 28 N 1.20 1.00 0.00 1.25 0.00 -0.57 -2.63 119.26 119.51 1qhb h ALA 28 Ca 0.25 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.14 1qhb h ALA 28 Cb 0.03 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1qhb h ALA 28 CO -0.04 0.00 -0.10 0.00 0.00 0.00 0.00 179.25 179.10 1qhb h ARG 29 N 0.00 0.00 0.00 0.00 3.08 -1.22 -3.49 114.38 112.76 1qhb h ARG 29 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1qhb h ARG 29 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1qhb h ARG 29 CO 0.00 0.10 0.00 0.41 -1.07 0.00 0.00 179.97 179.41 1qhb n GLY 30 N -0.91 0.37 3.19 0.04 0.00 -0.99 -4.99 105.19 101.89 1qhb n GLY 30 Ca -0.02 -1.81 -0.25 0.00 0.00 0.00 0.00 46.02 43.93 1qhb n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qhb s ALA 31 N -2.28 1.55 0.05 4.61 0.00 -1.26 -4.95 121.76 119.48 1qhb s ALA 31 Ca 0.00 -0.84 0.06 0.00 0.00 0.00 0.00 51.96 51.18 1qhb s ALA 31 Cb 0.00 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.71 1qhb s ALA 31 CO 0.00 0.37 -0.11 0.14 0.00 0.00 0.00 175.76 176.16 1qhb s VAL 32 N -0.51 3.29 0.79 0.00 -7.23 -0.55 -5.04 120.40 111.15 1qhb s VAL 32 Ca 0.07 -1.06 -0.11 0.00 -1.81 0.00 0.00 61.98 59.07 1qhb s VAL 32 Cb -0.07 -2.45 0.07 0.00 0.56 0.00 0.00 36.38 34.48 1qhb s VAL 32 CO -0.00 0.28 1.09 -2.16 -0.31 0.00 0.00 175.10 174.00 1qhb s PRO 33 N -1.68 2.14 -0.12 4.82 0.04 -1.26 -4.48 135.00 134.45 1qhb s PRO 33 Ca 0.18 1.01 0.03 0.00 0.04 0.00 0.00 61.00 62.26 1qhb s PRO 33 Cb -0.11 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.54 1qhb s PRO 33 CO 0.09 -1.68 -0.23 -1.12 0.04 0.00 0.00 177.00 174.10 1qhb s SER 34 N -3.52 3.15 -0.11 6.66 0.01 -1.26 -4.73 113.70 113.91 1qhb s SER 34 Ca 0.61 -0.57 -0.03 0.00 1.31 0.00 0.00 55.95 57.28 1qhb s SER 34 Cb -0.17 -1.44 -0.03 0.00 0.21 0.00 0.00 66.02 64.60 1qhb s SER 34 CO 0.56 0.13 0.01 -0.36 0.41 0.00 0.00 173.24 173.98 1qhb s PHE 35 N 0.55 3.17 0.60 2.43 0.08 -1.26 -5.10 117.98 118.44 1qhb s PHE 35 Ca -0.13 0.13 0.04 0.00 0.12 0.00 0.00 56.93 57.08 1qhb s PHE 35 Cb -0.17 -1.85 0.08 0.00 -0.57 0.00 0.00 43.02 40.51 1qhb s PHE 35 CO 0.04 0.38 0.83 0.00 -0.10 0.00 0.00 175.22 176.37 1qhb s ALA 36 N -0.59 4.16 -1.10 5.36 0.00 -1.26 -3.39 121.76 124.93 1qhb s ALA 36 Ca 0.10 -1.75 0.28 0.00 0.00 0.00 0.00 51.96 50.58 1qhb s ALA 36 Cb -0.12 -1.81 1.03 0.00 0.00 0.00 0.00 23.12 22.22 1qhb s ALA 36 CO 0.02 -0.96 1.77 0.27 0.00 0.00 0.00 175.76 176.87 1qhb n ASN 37 N -2.41 0.21 0.00 0.00 0.23 -1.26 -4.81 115.26 107.21 1qhb n ASN 37 Ca 0.13 0.11 0.00 0.00 -0.53 0.00 0.00 54.58 54.28 1qhb n ASN 37 Cb 0.60 -0.21 0.00 0.00 -2.08 0.00 0.00 39.78 38.09 1qhb n ASN 37 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1qhb n GLY 38 N 1.46 0.78 0.16 4.83 0.00 -1.26 -4.96 105.19 106.19 1qhb n GLY 38 Ca 0.08 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.12 1qhb n GLY 38 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1qhb h GLU 39 N 3.67 0.00 -0.65 1.61 5.08 -1.97 -3.33 114.58 118.99 1qhb h GLU 39 Ca 0.00 0.00 0.14 0.00 -1.00 0.00 0.00 59.36 58.50 1qhb h GLU 39 Cb 0.00 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 29.13 1qhb h GLU 39 CO 0.00 0.51 -0.06 1.49 -1.00 0.00 0.00 179.01 179.95 1qhb h GLU 40 N 0.00 0.07 -0.07 2.33 4.81 -1.93 -2.33 114.58 117.46 1qhb h GLU 40 Ca -0.01 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1qhb h GLU 40 Cb 1.04 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1qhb h GLU 40 CO 0.07 0.04 0.00 1.28 -0.73 0.00 0.00 179.01 179.67 1qhb n LEU 41 N -5.35 2.60 -0.02 1.64 4.77 -1.26 -4.39 117.00 114.99 1qhb n LEU 41 Ca 0.09 -1.08 -0.13 0.00 -0.03 0.00 0.00 56.01 54.86 1qhb n LEU 41 Cb 0.37 -0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.34 1qhb n LEU 41 CO 0.07 0.48 0.64 0.25 -1.33 0.00 0.00 177.39 177.50 1qhb h LEU 42 N 3.56 0.07 -9.54 2.23 5.85 -1.53 -3.44 115.31 112.52 1qhb h LEU 42 Ca 0.00 -0.47 -0.53 0.00 0.84 0.00 0.00 57.88 57.72 1qhb h LEU 42 Cb 0.77 -0.02 0.02 0.00 0.37 0.00 0.00 40.66 41.80 1qhb h LEU 42 CO 0.00 0.52 0.69 -0.31 -0.34 0.00 0.00 178.44 179.01 1qhb s TYR 43 N -4.33 3.28 0.23 1.25 2.02 -1.25 -4.98 117.35 113.57 1qhb s TYR 43 Ca -0.15 1.02 0.11 0.00 -0.37 0.00 0.00 57.07 57.68 1qhb s TYR 43 Cb 0.02 -3.63 -0.05 0.00 -0.40 0.00 0.00 41.96 37.91 1qhb s TYR 43 CO 0.69 -2.17 -0.21 1.03 -1.57 0.00 0.00 175.55 173.33 1qhb s ARG 44 N 1.08 1.65 -0.13 -0.62 1.81 -1.26 -1.96 118.95 119.52 1qhb s ARG 44 Ca 0.63 -1.61 -0.24 0.00 -1.72 0.00 0.00 55.73 52.80 1qhb s ARG 44 Cb -0.35 -1.84 -0.03 0.00 -0.45 0.00 0.00 34.95 32.28 1qhb s ARG 44 CO 0.30 0.37 0.75 1.21 -0.68 0.00 0.00 175.30 177.25 1qhb s ASN 45 N -3.07 6.94 0.23 0.23 3.84 0.18 -4.68 114.94 118.60 1qhb s ASN 45 Ca 0.25 1.14 -0.08 0.00 0.21 0.00 0.00 52.86 54.38 1qhb s ASN 45 Cb -0.07 -2.42 0.20 0.00 -0.55 0.00 0.00 41.25 38.41 1qhb s ASN 45 CO 0.13 -0.26 1.87 0.28 -2.79 0.00 0.00 177.10 176.33 1qhb h SER 46 N 7.11 1.04 -0.04 -4.21 0.02 -1.95 0.92 113.55 116.43 1qhb h SER 46 Ca -0.35 -0.07 -0.04 0.00 -0.84 0.00 0.00 61.79 60.49 1qhb h SER 46 Cb 1.16 -0.26 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1qhb h SER 46 CO 0.79 0.80 -0.14 -0.33 -1.14 0.00 0.00 176.83 176.81 1qhb h GLU 47 N 1.19 0.17 0.00 3.45 5.08 -1.97 -3.36 114.58 119.14 1qhb h GLU 47 Ca 0.31 -0.13 -0.16 0.00 -1.00 0.00 0.00 59.36 58.38 1qhb h GLU 47 Cb -0.05 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.20 1qhb h GLU 47 CO -0.06 0.75 -1.54 0.25 -1.00 0.00 0.00 179.01 177.42 1qhb n THR 48 N -4.62 1.05 -0.17 1.13 -2.24 -1.23 -4.98 114.28 103.23 1qhb n THR 48 Ca -0.08 -0.68 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 1qhb n THR 48 Cb 0.39 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 68.01 1qhb n THR 48 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1qhb n GLY 49 N 1.40 1.46 3.82 3.38 0.00 0.31 -5.02 105.19 110.54 1qhb n GLY 49 Ca -0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 1qhb n GLY 49 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qhb s ASP 50 N -3.11 5.03 0.42 1.61 1.01 -1.26 -4.59 116.67 115.79 1qhb s ASP 50 Ca 0.00 1.46 -0.25 0.00 0.71 0.00 0.00 52.55 54.47 1qhb s ASP 50 Cb 0.00 -2.28 -0.08 0.00 1.01 0.00 0.00 42.92 41.57 1qhb s ASP 50 CO 0.00 -1.64 1.28 -2.16 0.21 0.00 0.00 175.17 172.85 1qhb s PRO 51 N -5.11 3.89 -0.03 8.23 0.04 -1.26 0.47 135.00 141.23 1qhb s PRO 51 Ca 0.59 2.09 0.19 0.00 0.04 0.00 0.00 61.00 63.91 1qhb s PRO 51 Cb -0.14 -2.67 -0.29 0.00 0.04 0.00 0.00 34.50 31.44 1qhb s PRO 51 CO 0.55 -0.53 0.42 -1.13 0.04 0.00 0.00 177.00 176.34 1qhb n SER 52 N -0.03 0.68 -1.98 6.66 3.41 -0.83 -4.65 113.62 116.88 1qhb n SER 52 Ca 0.05 -0.01 -0.18 0.00 -0.26 0.00 0.00 58.87 58.47 1qhb n SER 52 Cb 0.44 1.86 -0.02 0.00 -0.26 0.00 0.00 64.21 66.23 1qhb n SER 52 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1qhb n PHE 53 N -2.15 -0.74 0.28 7.33 3.72 -1.26 -4.37 117.46 120.27 1qhb n PHE 53 Ca -0.03 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.54 1qhb n PHE 53 Cb 0.49 -3.53 0.74 0.00 -0.94 0.00 0.00 39.48 36.24 1qhb n PHE 53 CO 0.00 0.00 0.00 -0.84 -0.05 0.00 0.00 176.76 175.87 1qhb h ILE 54 N 0.00 0.02 -0.62 4.37 3.07 -1.90 -2.55 117.51 119.90 1qhb h ILE 54 Ca -0.43 -0.47 0.00 0.00 1.55 0.00 0.00 64.86 65.51 1qhb h ILE 54 Cb 1.30 1.46 0.00 0.00 -0.27 0.00 0.00 36.82 39.31 1qhb h ILE 54 CO 0.52 0.01 0.00 0.61 -1.05 0.00 0.00 178.15 178.23 1qhb n GLY 55 N -0.09 2.28 3.48 0.16 0.00 -1.26 -4.95 105.19 104.80 1qhb n GLY 55 Ca 0.00 -0.74 -0.25 0.00 0.00 0.00 0.00 46.02 45.04 1qhb n GLY 55 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qhb s SER 56 N -0.92 3.67 -0.08 1.61 0.01 -0.96 -3.27 113.70 113.75 1qhb s SER 56 Ca 0.45 -0.95 -0.30 0.00 1.31 0.00 0.00 55.95 56.47 1qhb s SER 56 Cb 0.27 -0.35 -0.04 0.00 0.21 0.00 0.00 66.02 66.10 1qhb s SER 56 CO 0.26 0.05 1.54 0.12 0.41 0.00 0.00 173.24 175.62 1qhb s PHE 57 N -2.30 2.24 -0.04 2.43 5.36 -0.26 -4.38 117.98 121.02 1qhb s PHE 57 Ca 0.28 0.43 0.05 0.00 -0.96 0.00 0.00 56.93 56.73 1qhb s PHE 57 Cb -0.06 -3.80 0.08 0.00 -0.34 0.00 0.00 43.02 38.90 1qhb s PHE 57 CO 0.14 -3.23 1.02 0.25 -1.46 0.00 0.00 175.22 171.94 1qhb n THR 58 N 5.43 0.53 -1.69 0.12 -2.24 -1.26 -4.97 114.28 110.19 1qhb n THR 58 Ca 0.16 -0.64 -0.44 0.00 -2.27 0.00 0.00 64.05 60.87 1qhb n THR 58 Cb 0.43 0.31 -0.03 0.00 -2.10 0.00 0.00 70.33 68.94 1qhb n THR 58 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1qhb n LYS 59 N -0.40 2.57 0.00 -0.78 4.81 -1.26 -1.70 118.16 121.40 1qhb n LYS 59 Ca 0.04 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.42 1qhb n LYS 59 Cb 0.67 -2.78 0.00 0.00 0.02 0.00 0.00 35.03 32.94 1qhb n LYS 59 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1qhb n GLY 60 N 3.96 2.45 3.80 3.14 0.00 0.14 -4.94 105.19 113.73 1qhb n GLY 60 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 1qhb n GLY 60 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qhb s LEU 61 N 0.00 4.41 0.10 0.99 1.43 -0.69 -0.70 118.68 124.23 1qhb s LEU 61 Ca 0.00 1.50 -0.34 0.00 -1.03 0.00 0.00 54.13 54.26 1qhb s LEU 61 Cb 0.00 -3.52 -0.14 0.00 0.03 0.00 0.00 46.19 42.56 1qhb s LEU 61 CO 0.00 0.08 1.61 -2.65 0.23 0.00 0.00 176.35 175.62 1qhb n PRO 62 N 0.96 2.02 -4.23 1.29 -0.02 -1.26 -4.59 135.00 129.17 1qhb n PRO 62 Ca -0.03 0.73 -0.28 0.00 -2.02 0.00 0.00 63.50 61.90 1qhb n PRO 62 Cb 0.50 -2.50 -0.09 0.00 -0.02 0.00 0.00 33.50 31.40 1qhb n PRO 62 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1qhb s HIS 63 N 1.48 2.76 0.34 6.00 3.76 -1.26 -2.07 115.29 126.29 1qhb s HIS 63 Ca 0.82 -0.16 -0.04 0.00 -0.15 0.00 0.00 55.06 55.53 1qhb s HIS 63 Cb -0.72 -1.37 0.07 0.00 1.11 0.00 0.00 32.58 31.67 1qhb s HIS 63 CO 0.42 0.49 0.46 -0.40 -0.85 0.00 0.00 174.74 174.86 1qhb n ASP 64 N 0.18 0.22 0.15 1.40 5.68 0.59 -4.82 116.55 119.96 1qhb n ASP 64 Ca -0.11 -1.28 0.13 0.00 -0.50 0.00 0.00 54.79 53.03 1qhb n ASP 64 Cb 0.54 -0.34 0.52 0.00 -1.14 0.00 0.00 41.12 40.71 1qhb n ASP 64 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1qhb h ASP 65 N -0.51 0.00 -0.02 -1.12 3.32 -2.01 -1.29 116.42 114.79 1qhb h ASP 65 Ca -0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.90 1qhb h ASP 65 Cb 0.46 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.01 1qhb h ASP 65 CO 0.12 0.00 -0.15 0.59 -1.72 0.00 0.00 179.24 178.09 1qhb n ASN 66 N -2.35 2.53 0.00 6.45 5.03 -1.26 -4.96 115.26 120.70 1qhb n ASN 66 Ca 0.02 -1.76 0.00 0.00 0.87 0.00 0.00 54.58 53.70 1qhb n ASN 66 Cb 0.23 0.16 0.00 0.00 -1.02 0.00 0.00 39.78 39.15 1qhb n ASN 66 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1qhb n GLY 67 N 1.28 0.73 3.86 7.41 0.00 -0.49 -4.85 105.19 113.13 1qhb n GLY 67 Ca 0.11 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 1qhb n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qhb s ALA 68 N -2.14 3.75 0.57 4.61 0.00 -1.26 -4.77 121.76 122.52 1qhb s ALA 68 Ca 0.00 -0.38 -0.20 0.00 0.00 0.00 0.00 51.96 51.38 1qhb s ALA 68 Cb 0.00 -2.25 -0.04 0.00 0.00 0.00 0.00 23.12 20.83 1qhb s ALA 68 CO 0.00 0.56 1.25 0.96 0.00 0.00 0.00 175.76 178.53 1qhb s ILE 69 N -1.23 2.48 0.06 0.00 -4.36 -1.26 -0.30 121.20 116.59 1qhb s ILE 69 Ca 0.27 0.32 -0.12 0.00 -0.26 0.00 0.00 60.65 60.86 1qhb s ILE 69 Cb -0.15 -3.15 -0.30 0.00 1.25 0.00 0.00 42.46 40.12 1qhb s ILE 69 CO 0.15 -0.04 1.10 0.40 0.24 0.00 0.00 174.94 176.78 1qhb h ILE 70 N 1.13 1.33 -3.39 8.37 2.04 -1.73 -3.44 117.51 121.83 1qhb h ILE 70 Ca -0.50 -2.64 -0.57 0.00 1.00 0.00 0.00 64.86 62.15 1qhb h ILE 70 Cb 1.30 2.82 -0.38 0.00 -0.74 0.00 0.00 36.82 39.82 1qhb h ILE 70 CO 0.56 0.79 -0.79 -0.62 0.00 0.00 0.00 178.15 178.09 1qhb s ASP 71 N -7.40 3.07 0.50 1.72 -1.08 -1.26 -5.02 116.67 107.20 1qhb s ASP 71 Ca -0.08 -0.79 0.22 0.00 -0.52 0.00 0.00 52.55 51.38 1qhb s ASP 71 Cb 0.06 -0.96 1.30 0.00 -1.46 0.00 0.00 42.92 41.85 1qhb s ASP 71 CO 0.92 -0.20 1.99 1.55 0.52 0.00 0.00 175.17 179.96 1qhb h PRO 72 N 8.09 0.10 0.00 4.34 0.13 -1.87 0.13 132.00 142.92 1qhb h PRO 72 Ca -0.23 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.89 1qhb h PRO 72 Cb 1.10 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 1qhb h PRO 72 CO 0.40 0.07 -0.02 -0.44 -0.23 0.00 0.00 178.00 177.78 1qhb h ASP 73 N 0.11 0.00 -0.26 1.44 3.32 -1.97 -2.15 116.42 116.91 1qhb h ASP 73 Ca 0.26 0.00 -0.11 0.00 0.02 0.00 0.00 57.03 57.20 1qhb h ASP 73 Cb 0.87 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.41 1qhb h ASP 73 CO -0.03 0.02 -0.21 0.44 -1.72 0.00 0.00 179.24 177.75 1qhb h ASP 74 N 0.00 0.73 0.00 6.45 3.32 -1.16 -0.02 116.42 125.74 1qhb h ASP 74 Ca -0.00 -0.25 -0.17 0.00 0.02 0.00 0.00 57.03 56.62 1qhb h ASP 74 Cb 0.05 -0.20 0.01 0.00 0.22 0.00 0.00 39.33 39.41 1qhb h ASP 74 CO 0.00 0.92 -0.68 0.15 -1.72 0.00 0.00 179.24 177.91 1qhb h PHE 75 N 0.64 0.69 -0.84 4.55 3.57 -1.51 -2.66 116.94 121.37 1qhb h PHE 75 Ca 0.09 -0.37 0.05 0.00 3.53 0.00 0.00 57.97 61.27 1qhb h PHE 75 Cb 0.69 -0.08 -0.06 0.00 2.79 0.00 0.00 35.95 39.30 1qhb h PHE 75 CO 0.03 1.20 0.53 -0.07 -2.23 0.00 0.00 178.31 177.77 1qhb h LEU 76 N -0.02 0.85 -0.74 0.59 3.38 -1.39 0.03 115.31 118.01 1qhb h LEU 76 Ca -0.09 0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1qhb h LEU 76 Cb 1.39 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.94 1qhb h LEU 76 CO 0.13 0.56 0.10 0.00 0.09 0.00 0.00 178.44 179.33 1qhb h ALA 77 N 1.38 0.95 -0.55 1.53 0.00 -1.03 -2.56 119.26 118.98 1qhb h ALA 77 Ca 0.35 -0.27 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1qhb h ALA 77 Cb 0.10 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1qhb h ALA 77 CO -0.15 0.65 0.35 0.35 0.00 0.00 0.00 179.25 180.46 1qhb h PHE 78 N 0.99 0.70 -0.82 0.00 3.57 -0.97 -1.53 116.94 118.87 1qhb h PHE 78 Ca 0.20 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 1qhb h PHE 78 Cb 0.44 -0.23 -0.04 0.00 2.79 0.00 0.00 35.95 38.90 1qhb h PHE 78 CO 0.03 0.45 0.41 0.28 -2.23 0.00 0.00 178.31 177.26 1qhb h VAL 79 N 0.74 1.25 -0.41 1.41 2.07 -0.69 -1.75 116.25 118.88 1qhb h VAL 79 Ca 0.20 -0.68 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 1qhb h VAL 79 Cb -0.06 0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.87 1qhb h VAL 79 CO -0.04 0.29 0.17 0.03 0.02 0.00 0.00 177.57 178.04 1qhb h ARG 80 N 1.16 0.60 -0.88 1.57 3.08 -1.28 -1.78 114.38 116.86 1qhb h ARG 80 Ca 0.28 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 1qhb h ARG 80 Cb 0.09 -0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.00 1qhb h ARG 80 CO -0.04 0.56 0.47 0.00 -1.07 0.00 0.00 179.97 179.89 1qhb h ALA 81 N 1.01 1.18 -0.38 0.04 0.00 -0.97 -1.09 119.26 119.04 1qhb h ALA 81 Ca 0.14 -0.14 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1qhb h ALA 81 Cb 0.18 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.58 1qhb h ALA 81 CO -0.01 0.66 0.15 0.82 0.00 0.00 0.00 179.25 180.86 1qhb h ILE 82 N 1.23 0.91 0.00 0.00 2.04 -1.00 -1.30 117.51 119.40 1qhb h ILE 82 Ca 0.31 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 66.05 1qhb h ILE 82 Cb 0.04 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 1qhb h ILE 82 CO -0.05 0.06 -0.06 0.78 0.00 0.00 0.00 178.15 178.88 1qhb h ASN 83 N 0.32 0.00 0.08 1.72 2.35 -0.79 -3.32 115.58 115.94 1qhb h ASN 83 Ca 0.17 0.00 -0.37 0.00 -0.55 0.00 0.00 56.30 55.55 1qhb h ASN 83 Cb 0.13 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.45 1qhb h ASN 83 CO -0.16 0.06 -2.27 -1.54 -1.65 0.00 0.00 177.43 171.87 1qhb n SER 84 N -3.13 1.61 0.00 5.81 3.41 -0.46 -4.98 113.62 115.87 1qhb n SER 84 Ca 0.02 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 1qhb n SER 84 Cb 0.45 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.12 1qhb n SER 84 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1qhb n GLY 85 N 2.05 1.43 3.69 5.00 0.00 -0.51 -4.98 105.19 111.87 1qhb n GLY 85 Ca -0.38 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.22 1qhb n GLY 85 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1qhb s ASP 86 N -3.22 6.53 0.18 1.61 2.15 -1.26 -4.90 116.67 117.76 1qhb s ASP 86 Ca 0.00 2.61 -0.12 0.00 0.43 0.00 0.00 52.55 55.47 1qhb s ASP 86 Cb 0.00 -2.57 0.10 0.00 -0.30 0.00 0.00 42.92 40.15 1qhb s ASP 86 CO 0.00 -0.93 1.80 -0.33 -0.17 0.00 0.00 175.17 175.53 1qhb h GLU 87 N 8.30 0.88 -0.63 4.34 3.07 -1.96 -1.20 114.58 127.37 1qhb h GLU 87 Ca -0.44 -0.10 -0.08 0.00 -0.50 0.00 0.00 59.36 58.24 1qhb h GLU 87 Cb 1.21 -0.17 -0.03 0.00 -0.84 0.00 0.00 28.75 28.92 1qhb h GLU 87 CO 0.94 0.66 0.09 0.87 -1.40 0.00 0.00 179.01 180.17 1qhb h LYS 88 N 0.86 1.05 -0.60 2.33 1.57 -1.99 -1.14 116.57 118.65 1qhb h LYS 88 Ca 0.22 -0.28 -0.03 0.00 -1.87 0.00 0.00 60.65 58.69 1qhb h LYS 88 Cb 0.04 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.20 1qhb h LYS 88 CO -0.04 0.97 0.26 1.49 -0.57 0.00 0.00 179.45 181.57 1qhb h GLU 89 N 0.98 0.88 -0.64 3.15 4.81 -1.84 -1.39 114.58 120.54 1qhb h GLU 89 Ca 0.19 -0.15 -0.04 0.00 -0.13 0.00 0.00 59.36 59.24 1qhb h GLU 89 Cb 0.45 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1qhb h GLU 89 CO 0.01 0.73 0.24 0.82 -0.73 0.00 0.00 179.01 180.09 1qhb h ILE 90 N 0.83 1.23 0.00 2.32 2.04 -0.96 -2.61 117.51 120.35 1qhb h ILE 90 Ca 0.20 -0.72 -0.05 0.00 1.00 0.00 0.00 64.86 65.29 1qhb h ILE 90 Cb 0.16 0.48 -0.01 0.00 -0.74 0.00 0.00 36.82 36.71 1qhb h ILE 90 CO -0.02 0.29 -0.23 0.00 0.00 0.00 0.00 178.15 178.19 1qhb h ALA 91 N 1.35 1.08 -0.09 1.87 0.00 -0.58 -3.00 119.26 119.90 1qhb h ALA 91 Ca 0.21 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1qhb h ALA 91 Cb 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1qhb h ALA 91 CO -0.02 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.52 1qhb n ALA 92 N -2.25 2.56 -1.68 0.00 0.00 -0.58 -4.91 120.51 113.65 1qhb n ALA 92 Ca -0.00 -0.38 -0.31 0.00 0.00 0.00 0.00 53.44 52.75 1qhb n ALA 92 Cb 0.40 -1.19 0.04 0.00 0.00 0.00 0.00 19.45 18.70 1qhb n ALA 92 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1qhb s LEU 93 N -1.66 3.13 -0.22 0.00 1.43 -1.13 -5.01 118.68 115.22 1qhb s LEU 93 Ca 0.33 1.52 -0.23 0.00 -1.03 0.00 0.00 54.13 54.72 1qhb s LEU 93 Cb 0.17 -4.44 -0.02 0.00 0.03 0.00 0.00 46.19 41.93 1qhb s LEU 93 CO 0.27 -1.27 0.73 -0.89 0.23 0.00 0.00 176.35 175.42 1qhb s THR 94 N -3.11 4.93 -0.07 5.49 2.01 -1.26 -5.04 115.64 118.59 1qhb s THR 94 Ca 0.57 1.38 0.01 0.00 0.31 0.00 0.00 61.69 63.95 1qhb s THR 94 Cb -0.13 -4.03 0.02 0.00 0.01 0.00 0.00 72.50 68.37 1qhb s THR 94 CO 0.55 0.01 -0.06 -0.22 -0.69 0.00 0.00 174.62 174.21 1qhb s LEU 95 N 2.41 1.25 0.00 4.42 2.96 -1.26 -4.60 118.68 123.86 1qhb s LEU 95 Ca 0.32 -0.21 0.00 0.00 -0.22 0.00 0.00 54.13 54.02 1qhb s LEU 95 Cb -0.16 -0.64 0.00 0.00 0.50 0.00 0.00 46.19 45.90 1qhb s LEU 95 CO 0.09 -0.07 0.00 0.61 -1.32 0.00 0.00 176.35 175.66 1qhb n GLY 96 N 4.39 -0.79 3.74 7.98 0.00 0.13 -4.99 105.19 115.65 1qhb n GLY 96 Ca -0.18 -1.68 -0.28 0.00 0.00 0.00 0.00 46.02 43.87 1qhb n GLY 96 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1qhb n PRO 97 N -0.91 -1.22 -1.69 1.61 -0.04 -1.26 -4.23 135.00 127.27 1qhb n PRO 97 Ca 0.00 -2.01 -0.45 0.00 -0.04 0.00 0.00 63.50 61.00 1qhb n PRO 97 Cb 0.00 -1.30 -0.04 0.00 -0.04 0.00 0.00 33.50 32.12 1qhb n PRO 97 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1qhb n ALA 98 N -3.80 1.91 -2.57 0.55 0.00 -1.26 -4.71 120.51 110.62 1qhb n ALA 98 Ca -0.21 0.43 -0.21 0.00 0.00 0.00 0.00 53.44 53.46 1qhb n ALA 98 Cb 0.56 -2.41 -0.01 0.00 0.00 0.00 0.00 19.45 17.59 1qhb n ALA 98 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1qhb s ARG 99 N 1.00 3.21 0.15 0.00 0.52 -1.26 -1.13 118.95 121.44 1qhb s ARG 99 Ca 0.77 -0.79 -0.24 0.00 -0.52 0.00 0.00 55.73 54.95 1qhb s ARG 99 Cb -0.62 -2.77 -0.08 0.00 0.52 0.00 0.00 34.95 32.01 1qhb s ARG 99 CO 0.36 0.09 0.73 0.34 0.02 0.00 0.00 175.30 176.84 1qhb s ASP 100 N -4.13 7.31 0.24 0.23 2.15 -0.08 -4.88 116.67 117.52 1qhb s ASP 100 Ca 0.43 1.56 -0.06 0.00 0.43 0.00 0.00 52.55 54.91 1qhb s ASP 100 Cb -0.09 -2.47 0.28 0.00 -0.30 0.00 0.00 42.92 40.33 1qhb s ASP 100 CO 0.32 0.22 1.90 -0.65 -0.17 0.00 0.00 175.17 176.79 1qhb h PRO 101 N 4.32 1.17 0.03 4.34 0.11 -1.96 0.54 132.00 140.55 1qhb h PRO 101 Ca -0.48 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.56 1qhb h PRO 101 Cb 1.21 -0.26 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1qhb h PRO 101 CO 0.65 0.77 -0.01 0.93 -0.21 0.00 0.00 178.00 180.13 1qhb h GLU 102 N 1.20 -0.03 0.50 1.05 3.07 -1.99 -3.38 114.58 114.99 1qhb h GLU 102 Ca 0.36 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.20 1qhb h GLU 102 Cb -0.04 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 1qhb h GLU 102 CO -0.11 -0.02 -0.24 1.79 -1.40 0.00 0.00 179.01 179.03 1qhb h THR 103 N -0.44 0.46 0.00 1.13 1.35 -1.98 -3.47 112.91 109.96 1qhb h THR 103 Ca -0.00 -0.30 0.00 0.00 -0.55 0.00 0.00 66.41 65.56 1qhb h THR 103 Cb 0.03 0.58 0.00 0.00 -1.73 0.00 0.00 68.15 67.03 1qhb h THR 103 CO 0.01 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 175.93 1qhb n GLY 104 N -0.83 0.80 3.91 5.82 0.00 0.19 -4.96 105.19 110.11 1qhb n GLY 104 Ca -0.11 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.63 1qhb n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qhb s LEU 105 N 0.00 4.03 0.54 0.99 1.43 -1.26 -4.61 118.68 119.80 1qhb s LEU 105 Ca 0.00 0.69 -0.22 0.00 -1.03 0.00 0.00 54.13 53.58 1qhb s LEU 105 Cb 0.00 -3.52 -0.05 0.00 0.03 0.00 0.00 46.19 42.65 1qhb s LEU 105 CO 0.00 -0.23 1.33 -2.84 0.23 0.00 0.00 176.35 174.84 1qhb s PRO 106 N -3.73 3.17 -0.36 1.29 0.02 -1.26 -0.90 135.00 133.23 1qhb s PRO 106 Ca 0.44 2.17 -0.11 0.00 0.02 0.00 0.00 61.00 63.51 1qhb s PRO 106 Cb -0.10 -2.24 0.01 0.00 0.02 0.00 0.00 34.50 32.18 1qhb s PRO 106 CO 0.32 -1.15 0.21 0.42 -0.33 0.00 0.00 177.00 176.47 1qhb s ILE 107 N -1.34 4.77 0.57 2.83 1.01 -0.29 -4.85 121.20 123.91 1qhb s ILE 107 Ca 0.71 -0.63 -0.00 0.00 0.00 0.00 0.00 60.65 60.73 1qhb s ILE 107 Cb -0.39 -3.57 0.03 0.00 0.01 0.00 0.00 42.46 38.54 1qhb s ILE 107 CO 0.46 -0.14 0.81 0.26 0.00 0.00 0.00 174.94 176.33 1qhb s TRP 108 N 1.61 2.92 -0.04 3.97 0.52 -1.26 -4.67 118.94 121.99 1qhb s TRP 108 Ca 0.04 0.12 -0.07 0.00 0.02 0.00 0.00 56.10 56.20 1qhb s TRP 108 Cb -0.18 -2.78 -0.29 0.00 -1.15 0.00 0.00 33.47 29.06 1qhb s TRP 108 CO 0.07 -0.91 0.70 0.00 0.02 0.00 0.00 176.95 176.83 1qhb h ARG 109 N -0.02 0.33 -6.62 4.98 3.08 -1.97 -3.47 114.38 110.69 1qhb h ARG 109 Ca -0.43 -0.56 -0.51 0.00 0.07 0.00 0.00 59.98 58.55 1qhb h ARG 109 Cb 1.29 0.21 -0.03 0.00 0.08 0.00 0.00 29.97 31.52 1qhb h ARG 109 CO 0.54 1.22 0.05 -1.54 -1.07 0.00 0.00 179.97 179.18 1qhb s SER 110 N -7.13 6.82 0.22 7.04 1.04 -1.26 -4.96 113.70 115.46 1qhb s SER 110 Ca -0.14 1.24 -0.08 0.00 0.48 0.00 0.00 55.95 57.45 1qhb s SER 110 Cb 0.06 -2.35 0.17 0.00 0.10 0.00 0.00 66.02 63.99 1qhb s SER 110 CO 0.85 -0.11 1.80 0.44 0.98 0.00 0.00 173.24 177.19 1qhb h ASP 111 N 2.64 1.09 0.03 7.02 3.32 -1.96 -1.56 116.42 127.00 1qhb h ASP 111 Ca -0.48 -0.15 0.02 0.00 0.02 0.00 0.00 57.03 56.45 1qhb h ASP 111 Cb 1.18 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 40.42 1qhb h ASP 111 CO 0.66 0.94 -0.17 0.25 -1.72 0.00 0.00 179.24 179.20 1qhb h LEU 112 N 1.17 -0.48 -0.68 1.55 5.85 -1.97 0.35 115.31 121.10 1qhb h LEU 112 Ca 0.28 0.07 -0.08 0.00 0.84 0.00 0.00 57.88 58.98 1qhb h LEU 112 Cb 0.15 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1qhb h LEU 112 CO -0.03 -0.23 0.12 0.00 -0.34 0.00 0.00 178.44 177.95 1qhb h ALA 113 N 0.61 0.91 -0.49 1.25 0.00 -1.92 -2.28 119.26 117.34 1qhb h ALA 113 Ca 0.04 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 1qhb h ALA 113 Cb 0.34 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1qhb h ALA 113 CO -0.14 0.67 0.07 -0.91 0.00 0.00 0.00 179.25 178.94 1qhb h ASN 114 N 1.06 0.79 0.07 0.00 2.35 -0.97 -2.69 115.58 116.19 1qhb h ASN 114 Ca 0.21 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 1qhb h ASN 114 Cb 0.44 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.60 1qhb h ASN 114 CO 0.01 0.86 -0.07 0.77 -1.65 0.00 0.00 177.43 177.35 1qhb h SER 115 N 0.70 0.00 0.50 5.81 4.64 -0.13 -1.10 113.55 123.96 1qhb h SER 115 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1qhb h SER 115 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 1qhb h SER 115 CO 0.01 0.07 -0.26 0.18 -0.87 0.00 0.00 176.83 175.96 1qhb n LEU 116 N -4.44 0.50 -3.63 5.97 4.77 -0.87 -4.95 117.00 114.34 1qhb n LEU 116 Ca -0.03 0.04 -0.23 0.00 -0.03 0.00 0.00 56.01 55.77 1qhb n LEU 116 Cb 0.15 -0.25 0.06 0.00 -2.33 0.00 0.00 43.42 41.05 1qhb n LEU 116 CO 0.35 0.10 0.12 0.47 -1.33 0.00 0.00 177.39 177.10 1qhb n ASP 117 N -1.19 -3.77 -4.77 -1.43 8.00 -0.42 -4.90 116.55 108.07 1qhb n ASP 117 Ca 0.09 -0.67 -0.38 0.00 0.71 0.00 0.00 54.79 54.55 1qhb n ASP 117 Cb 0.32 -4.64 0.00 0.00 -0.02 0.00 0.00 41.12 36.79 1qhb n ASP 117 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1qhb s LEU 118 N -6.91 4.00 0.57 0.64 1.43 -1.15 -5.03 118.68 112.23 1qhb s LEU 118 Ca 0.32 2.44 0.08 0.00 -1.03 0.00 0.00 54.13 55.93 1qhb s LEU 118 Cb -0.15 -4.22 0.07 0.00 0.03 0.00 0.00 46.19 41.93 1qhb s LEU 118 CO 0.77 -1.05 0.62 -1.61 0.23 0.00 0.00 176.35 175.30 1qhb s GLU 119 N -2.70 2.26 0.40 1.70 0.41 -1.26 -4.61 118.70 114.91 1qhb s GLU 119 Ca 0.65 -1.84 -0.08 0.00 -0.41 0.00 0.00 54.97 53.28 1qhb s GLU 119 Cb -0.32 -2.38 -0.06 0.00 -1.78 0.00 0.00 34.13 29.59 1qhb s GLU 119 CO 0.39 -0.77 0.73 0.14 -0.49 0.00 0.00 175.26 175.25 1qhb s VAL 120 N -2.73 4.86 0.13 2.63 -7.23 -1.26 -1.13 120.40 115.67 1qhb s VAL 120 Ca 0.49 0.42 0.09 0.00 -1.81 0.00 0.00 61.98 61.16 1qhb s VAL 120 Cb -0.04 -3.76 -0.04 0.00 0.56 0.00 0.00 36.38 33.10 1qhb s VAL 120 CO 0.31 -0.55 -0.16 0.00 -0.31 0.00 0.00 175.10 174.38 1qhb s ARG 121 N -3.98 1.84 0.43 4.82 1.70 -0.83 -4.80 118.95 118.14 1qhb s ARG 121 Ca 0.49 -1.21 0.08 0.00 -0.47 0.00 0.00 55.73 54.62 1qhb s ARG 121 Cb -0.10 -2.12 -0.00 0.00 -0.57 0.00 0.00 34.95 32.16 1qhb s ARG 121 CO 0.34 0.47 0.46 0.20 -1.08 0.00 0.00 175.30 175.69 1qhb s GLY 122 N -2.32 2.07 0.37 3.88 0.00 -1.26 -4.89 107.32 105.18 1qhb s GLY 122 Ca 0.20 -1.81 -0.27 0.00 0.00 0.00 0.00 44.72 42.84 1qhb s GLY 122 CO 0.11 -1.65 1.30 -0.98 0.00 0.00 0.00 173.10 171.89 1qhb s TRP 123 N -2.46 2.91 -0.47 1.90 0.51 -1.26 -4.80 118.94 115.27 1qhb s TRP 123 Ca 0.50 1.41 -0.19 0.00 -2.12 0.00 0.00 56.10 55.70 1qhb s TRP 123 Cb -0.05 -3.67 0.04 0.00 -0.81 0.00 0.00 33.47 28.98 1qhb s TRP 123 CO 0.30 -1.99 0.59 -1.21 -0.51 0.00 0.00 176.95 174.13 1qhb s GLU 124 N -2.06 3.15 -1.02 4.98 2.02 -1.04 -4.60 118.70 120.13 1qhb s GLU 124 Ca 0.53 -0.74 -0.15 0.00 0.02 0.00 0.00 54.97 54.64 1qhb s GLU 124 Cb -0.39 -4.03 -0.00 0.00 0.10 0.00 0.00 34.13 29.81 1qhb s GLU 124 CO 0.50 -1.09 0.74 0.09 0.02 0.00 0.00 175.26 175.52 1qhb n ASN 125 N 6.07 -5.55 0.09 -0.19 4.13 -1.26 -4.85 115.26 113.70 1qhb n ASN 125 Ca -0.05 -0.88 0.10 0.00 1.68 0.00 0.00 54.58 55.42 1qhb n ASN 125 Cb 0.46 -3.23 0.43 0.00 -1.54 0.00 0.00 39.78 35.90 1qhb n ASN 125 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1qhb n SER 126 N -2.49 0.46 -0.41 6.41 3.41 -1.26 -2.92 113.62 116.81 1qhb n SER 126 Ca -0.12 0.62 0.07 0.00 -0.26 0.00 0.00 58.87 59.19 1qhb n SER 126 Cb 0.59 -0.72 0.16 0.00 -0.26 0.00 0.00 64.21 63.99 1qhb n SER 126 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1qhb n SER 127 N -2.02 1.88 0.29 4.04 7.64 -1.26 -4.70 113.62 119.49 1qhb n SER 127 Ca 0.02 -3.41 0.18 0.00 1.01 0.00 0.00 58.87 56.67 1qhb n SER 127 Cb 0.19 -0.47 0.83 0.00 -1.01 0.00 0.00 64.21 63.75 1qhb n SER 127 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1qhb h ALA 128 N 0.54 1.05 0.00 -0.43 0.00 -1.90 -1.62 119.26 116.89 1qhb h ALA 128 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1qhb h ALA 128 Cb 1.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1qhb h ALA 128 CO 0.00 0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.71 1qhb n GLY 129 N -0.38 -0.79 0.02 0.00 0.00 -1.26 -2.69 105.19 100.09 1qhb n GLY 129 Ca -0.01 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.01 1qhb n GLY 129 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1qhb n LEU 130 N -1.14 0.66 -4.74 0.99 4.77 -0.61 -4.66 117.00 112.27 1qhb n LEU 130 Ca 0.12 -0.11 -0.41 0.00 -0.03 0.00 0.00 56.01 55.58 1qhb n LEU 130 Cb 0.11 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.04 1qhb n LEU 130 CO 0.13 0.11 0.81 -0.89 -1.33 0.00 0.00 177.39 176.23 1qhb s THR 131 N -3.10 3.84 0.87 -5.08 2.01 -1.09 -5.04 115.64 108.04 1qhb s THR 131 Ca 0.07 1.55 -0.09 0.00 0.31 0.00 0.00 61.69 63.53 1qhb s THR 131 Cb 0.16 -3.99 0.18 0.00 0.01 0.00 0.00 72.50 68.86 1qhb s THR 131 CO 0.79 0.25 1.19 -0.36 -0.69 0.00 0.00 174.62 175.80 1qhb s PHE 132 N -0.10 1.35 0.02 4.92 0.08 -1.26 -4.67 117.98 118.32 1qhb s PHE 132 Ca 0.51 -0.05 -0.09 0.00 0.12 0.00 0.00 56.93 57.41 1qhb s PHE 132 Cb -0.30 -3.62 0.01 0.00 -0.57 0.00 0.00 43.02 38.54 1qhb s PHE 132 CO 0.35 -2.32 0.19 0.34 -0.10 0.00 0.00 175.22 173.67 1qhb s ASP 133 N -4.87 0.00 0.26 1.36 -1.08 -1.26 -5.04 116.67 106.04 1qhb s ASP 133 Ca 0.72 -0.25 0.25 0.00 -0.52 0.00 0.00 52.55 52.75 1qhb s ASP 133 Cb -0.03 0.26 0.91 0.00 -1.46 0.00 0.00 42.92 42.59 1qhb s ASP 133 CO 0.49 -0.47 1.75 -0.07 0.52 0.00 0.00 175.17 177.39 1qhb h LEU 134 N 3.81 0.00 -7.93 -1.34 3.38 -2.00 -3.45 115.31 107.78 1qhb h LEU 134 Ca -0.31 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.54 1qhb h LEU 134 Cb 1.19 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.77 1qhb h LEU 134 CO 0.44 0.00 -0.53 -1.83 0.09 0.00 0.00 178.44 176.62 1qhb s GLU 135 N -3.24 0.61 0.00 1.13 -1.05 -1.26 -5.03 118.70 109.86 1qhb s GLU 135 Ca 0.07 -0.83 0.00 0.00 -0.15 0.00 0.00 54.97 54.06 1qhb s GLU 135 Cb 0.10 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 34.03 1qhb s GLU 135 CO 0.49 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 176.96 1qhb n GLY 136 N 0.62 -1.03 3.77 -3.83 0.00 -1.26 -4.90 105.19 98.56 1qhb n GLY 136 Ca -0.18 -1.64 -0.40 0.00 0.00 0.00 0.00 46.02 43.79 1qhb n GLY 136 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1qhb s PRO 137 N -1.83 3.89 0.58 1.61 0.02 -1.26 -4.94 135.00 133.07 1qhb s PRO 137 Ca 0.00 2.52 -0.20 0.00 0.02 0.00 0.00 61.00 63.34 1qhb s PRO 137 Cb 0.00 -2.82 -0.04 0.00 0.02 0.00 0.00 34.50 31.67 1qhb s PRO 137 CO 0.00 -0.69 1.29 0.34 -0.33 0.00 0.00 177.00 177.61 1qhb s ASP 138 N -0.29 5.16 0.50 2.53 2.15 -1.26 -4.89 116.67 120.56 1qhb s ASP 138 Ca 0.57 2.60 0.24 0.00 0.43 0.00 0.00 52.55 56.39 1qhb s ASP 138 Cb -0.46 -2.62 1.30 0.00 -0.30 0.00 0.00 42.92 40.85 1qhb s ASP 138 CO 0.61 -1.63 1.94 0.00 -0.17 0.00 0.00 175.17 175.91 1qhb h ALA 139 N 1.14 2.46 -0.52 3.66 0.00 -1.90 -1.38 119.26 122.72 1qhb h ALA 139 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1qhb h ALA 139 Cb 1.30 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1qhb h ALA 139 CO 0.56 -0.66 0.00 1.04 0.00 0.00 0.00 179.25 180.19 1qhb n GLN 140 N -4.39 2.33 0.01 0.00 6.02 -1.26 -4.23 117.38 115.85 1qhb n GLN 140 Ca 0.14 -2.05 0.11 0.00 -0.01 0.00 0.00 57.00 55.19 1qhb n GLN 140 Cb 0.68 -1.46 0.03 0.00 1.02 0.00 0.00 30.24 30.51 1qhb n GLN 140 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1qhb n SER 141 N 1.18 0.71 -4.61 1.08 3.41 -0.52 -4.67 113.62 110.20 1qhb n SER 141 Ca 0.19 -0.52 -0.25 0.00 -0.26 0.00 0.00 58.87 58.03 1qhb n SER 141 Cb 0.50 0.75 -0.09 0.00 -0.26 0.00 0.00 64.21 65.11 1qhb n SER 141 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 1qhb s VAL 142 N -3.07 2.45 0.07 -3.33 -7.23 -1.26 -1.49 120.40 106.54 1qhb s VAL 142 Ca 0.07 -2.02 -0.01 0.00 -1.81 0.00 0.00 61.98 58.21 1qhb s VAL 142 Cb 0.16 -2.78 -0.04 0.00 0.56 0.00 0.00 36.38 34.28 1qhb s VAL 142 CO 0.80 -0.17 -0.01 0.00 -0.31 0.00 0.00 175.10 175.41 1qhb s ALA 143 N -2.56 0.63 0.06 1.32 0.00 -1.26 -4.89 121.76 115.05 1qhb s ALA 143 Ca 0.35 -1.28 0.09 0.00 0.00 0.00 0.00 51.96 51.11 1qhb s ALA 143 Cb 0.02 0.40 -0.03 0.00 0.00 0.00 0.00 23.12 23.50 1qhb s ALA 143 CO 0.19 -0.39 -0.22 -1.64 0.00 0.00 0.00 175.76 173.70 1qhb s MET 144 N -3.94 1.85 0.86 0.00 -1.94 -1.26 -4.93 119.30 109.94 1qhb s MET 144 Ca 0.11 -1.10 -0.12 0.00 -1.71 0.00 0.00 55.69 52.88 1qhb s MET 144 Cb 0.08 -2.07 0.10 0.00 2.01 0.00 0.00 34.83 34.95 1qhb s MET 144 CO -0.07 0.51 1.10 -1.25 -0.01 0.00 0.00 175.02 175.30 1qhb s PRO 145 N -1.54 1.60 0.32 2.03 0.04 -1.26 -4.49 135.00 131.70 1qhb s PRO 145 Ca 0.14 0.74 -0.27 0.00 0.04 0.00 0.00 61.00 61.64 1qhb s PRO 145 Cb -0.10 -1.86 -0.13 0.00 0.04 0.00 0.00 34.50 32.45 1qhb s PRO 145 CO 0.05 -1.98 1.05 -2.30 0.04 0.00 0.00 177.00 173.85 1qhb n PRO 146 N -3.69 1.46 -1.66 0.56 -0.02 -1.22 -4.97 135.00 125.46 1qhb n PRO 146 Ca 0.07 0.51 -0.31 0.00 -2.02 0.00 0.00 63.50 61.76 1qhb n PRO 146 Cb 0.56 -1.94 0.05 0.00 -0.02 0.00 0.00 33.50 32.15 1qhb n PRO 146 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1qhb s ALA 147 N -1.10 2.71 0.50 3.55 0.00 -1.26 -4.91 121.76 121.25 1qhb s ALA 147 Ca 0.59 -0.04 -0.23 0.00 0.00 0.00 0.00 51.96 52.28 1qhb s ALA 147 Cb -0.66 -3.13 -0.07 0.00 0.00 0.00 0.00 23.12 19.26 1qhb s ALA 147 CO 0.60 -1.19 1.29 -2.30 0.00 0.00 0.00 175.76 174.15 1qhb n PRO 148 N -3.09 1.73 -2.51 0.00 -0.02 -1.26 -4.67 135.00 125.17 1qhb n PRO 148 Ca 0.07 0.63 -0.25 0.00 -2.02 0.00 0.00 63.50 61.92 1qhb n PRO 148 Cb 0.54 -2.46 0.03 0.00 -0.02 0.00 0.00 33.50 31.59 1qhb n PRO 148 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1qhb s VAL 149 N -1.27 3.51 0.52 -1.45 -7.23 -1.26 -4.98 120.40 108.24 1qhb s VAL 149 Ca 0.67 -0.17 0.16 0.00 -1.81 0.00 0.00 61.98 60.84 1qhb s VAL 149 Cb -0.45 -3.38 0.27 0.00 0.56 0.00 0.00 36.38 33.38 1qhb s VAL 149 CO 0.53 -0.36 2.15 -0.07 -0.31 0.00 0.00 175.10 177.04 1qhb h LEU 150 N -0.09 0.00 -3.10 1.32 3.38 -1.96 -2.23 115.31 112.63 1qhb h LEU 150 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1qhb h LEU 150 Cb 1.26 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.01 1qhb h LEU 150 CO 0.59 0.00 0.00 0.35 0.09 0.00 0.00 178.44 179.47 1qhb n THR 151 N -4.53 1.85 -3.16 0.22 -2.24 -1.26 -4.81 114.28 100.35 1qhb n THR 151 Ca -0.03 -1.18 -0.25 0.00 -2.27 0.00 0.00 64.05 60.32 1qhb n THR 151 Cb 0.10 0.10 -0.01 0.00 -2.10 0.00 0.00 70.33 68.42 1qhb n THR 151 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1qhb s SER 152 N -0.88 6.31 0.26 3.42 1.04 -0.84 -4.98 113.70 118.02 1qhb s SER 152 Ca 0.51 0.62 -0.05 0.00 0.48 0.00 0.00 55.95 57.52 1qhb s SER 152 Cb 0.33 -2.11 0.30 0.00 0.10 0.00 0.00 66.02 64.65 1qhb s SER 152 CO 0.24 -0.36 1.92 -0.65 0.98 0.00 0.00 173.24 175.37 1qhb h PRO 153 N 0.74 1.28 -0.85 4.02 0.11 -1.93 -2.33 132.00 133.03 1qhb h PRO 153 Ca -0.49 -0.08 0.00 0.00 0.11 0.00 0.00 66.00 65.55 1qhb h PRO 153 Cb 1.21 -0.29 -0.04 0.00 0.11 0.00 0.00 31.00 31.99 1qhb h PRO 153 CO 0.62 0.84 0.54 1.49 -0.21 0.00 0.00 178.00 181.29 1qhb h GLU 154 N 1.31 1.13 -0.01 1.05 4.81 -1.94 -1.09 114.58 119.86 1qhb h GLU 154 Ca 0.38 -0.08 -0.19 0.00 -0.13 0.00 0.00 59.36 59.35 1qhb h GLU 154 Cb -0.08 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.04 1qhb h GLU 154 CO -0.10 0.77 -0.83 1.25 -0.73 0.00 0.00 179.01 179.37 1qhb h LEU 155 N 1.16 0.21 -0.20 1.64 7.12 -1.67 -0.84 115.31 122.73 1qhb h LEU 155 Ca 0.31 -0.16 -0.01 0.00 0.13 0.00 0.00 57.88 58.15 1qhb h LEU 155 Cb -0.10 -0.06 -0.01 0.00 -0.53 0.00 0.00 40.66 39.96 1qhb h LEU 155 CO -0.06 0.94 0.09 0.40 -0.13 0.00 0.00 178.44 179.69 1qhb h ILE 156 N 0.10 1.14 -0.79 4.05 2.04 -1.12 -0.90 117.51 122.02 1qhb h ILE 156 Ca -0.03 -0.40 -0.04 0.00 1.00 0.00 0.00 64.86 65.38 1qhb h ILE 156 Cb 1.44 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 38.52 1qhb h ILE 156 CO 0.12 0.13 0.34 0.00 0.00 0.00 0.00 178.15 178.74 1qhb h ALA 157 N 0.95 1.09 -0.59 1.87 0.00 -1.05 -1.68 119.26 119.86 1qhb h ALA 157 Ca 0.07 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 54.74 1qhb h ALA 157 Cb 0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1qhb h ALA 157 CO -0.01 0.65 0.17 0.93 0.00 0.00 0.00 179.25 181.00 1qhb h GLU 158 N 1.15 0.93 -0.47 0.00 5.08 -0.93 -2.09 114.58 118.26 1qhb h GLU 158 Ca 0.27 -0.21 -0.13 0.00 -1.00 0.00 0.00 59.36 58.28 1qhb h GLU 158 Cb 0.18 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1qhb h GLU 158 CO -0.03 0.84 -0.24 0.52 -1.00 0.00 0.00 179.01 179.11 1qhb h MET 159 N 0.85 0.97 -0.65 2.33 2.86 -0.93 -1.97 114.93 118.39 1qhb h MET 159 Ca 0.19 -0.42 -0.02 0.00 -2.06 0.00 0.00 59.70 57.39 1qhb h MET 159 Cb 0.31 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1qhb h MET 159 CO -0.00 1.10 0.34 0.00 1.06 0.00 0.00 176.91 179.41 1qhb h ALA 160 N 0.88 0.83 -0.56 6.32 0.00 -1.21 -0.91 119.26 124.62 1qhb h ALA 160 Ca 0.10 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1qhb h ALA 160 Cb 0.81 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1qhb h ALA 160 CO 0.07 0.36 0.31 1.49 0.00 0.00 0.00 179.25 181.48 1qhb h GLU 161 N 0.89 0.78 -0.49 0.00 4.81 -1.35 -1.92 114.58 117.30 1qhb h GLU 161 Ca 0.23 -0.09 -0.12 0.00 -0.13 0.00 0.00 59.36 59.25 1qhb h GLU 161 Cb 0.06 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.27 1qhb h GLU 161 CO -0.03 0.60 -0.15 -0.07 -0.73 0.00 0.00 179.01 178.63 1qhb h LEU 162 N 0.75 0.98 -0.81 1.64 3.38 -0.79 -0.34 115.31 120.13 1qhb h LEU 162 Ca 0.20 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1qhb h LEU 162 Cb 0.05 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 1qhb h LEU 162 CO -0.03 1.13 0.50 1.88 0.09 0.00 0.00 178.44 182.01 1qhb h TYR 163 N 0.82 1.04 -0.17 1.13 0.05 -1.10 -2.02 116.97 116.73 1qhb h TYR 163 Ca 0.12 0.01 -0.08 0.00 0.05 0.00 0.00 58.73 58.83 1qhb h TYR 163 Cb 0.71 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 38.09 1qhb h TYR 163 CO 0.05 0.68 -0.26 -0.07 -1.05 0.00 0.00 178.16 177.51 1qhb h LEU 164 N 1.10 0.30 -0.66 3.88 3.38 -1.09 -0.40 115.31 121.83 1qhb h LEU 164 Ca 0.29 -0.10 -0.11 0.00 0.09 0.00 0.00 57.88 58.05 1qhb h LEU 164 Cb -0.07 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1qhb h LEU 164 CO -0.06 0.57 -0.17 0.24 0.09 0.00 0.00 178.44 179.11 1qhb h MET 165 N 0.28 0.86 -0.25 1.13 2.86 -0.86 -0.23 114.93 118.71 1qhb h MET 165 Ca 0.04 -0.33 -0.01 0.00 -2.06 0.00 0.00 59.70 57.34 1qhb h MET 165 Cb 0.61 -0.05 -0.01 0.00 0.06 0.00 0.00 31.60 32.21 1qhb h MET 165 CO 0.04 0.97 0.13 0.00 1.06 0.00 0.00 176.91 179.11 1qhb h ALA 166 N 1.04 0.33 -0.01 6.32 0.00 -0.94 -2.21 119.26 123.79 1qhb h ALA 166 Ca 0.11 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 1qhb h ALA 166 Cb 0.70 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 1qhb h ALA 166 CO 0.05 -0.12 -0.40 -0.07 0.00 0.00 0.00 179.25 178.71 1qhb h LEU 167 N 0.28 0.02 -2.84 0.00 3.38 -0.72 -2.99 115.31 112.45 1qhb h LEU 167 Ca 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1qhb h LEU 167 Cb 0.10 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.84 1qhb h LEU 167 CO -0.01 0.42 0.00 0.61 0.09 0.00 0.00 178.44 179.55 1qhb n GLY 168 N -0.37 2.47 0.35 0.83 0.00 -0.13 -4.64 105.19 103.70 1qhb n GLY 168 Ca -0.02 -0.72 0.12 0.00 0.00 0.00 0.00 46.02 45.41 1qhb n GLY 168 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1qhb h ARG 169 N 3.27 0.30 -0.65 1.61 3.08 -1.24 -1.91 114.38 118.85 1qhb h ARG 169 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1qhb h ARG 169 Cb 1.47 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.45 1qhb h ARG 169 CO 0.30 0.20 0.00 -0.25 -1.07 0.00 0.00 179.97 179.15 1qhb n ASP 170 N -4.46 4.54 -4.78 7.04 8.00 -1.26 -0.74 116.55 124.89 1qhb n ASP 170 Ca 0.08 -2.46 -0.39 0.00 0.71 0.00 0.00 54.79 52.73 1qhb n ASP 170 Cb 0.37 -0.57 -0.06 0.00 -0.02 0.00 0.00 41.12 40.84 1qhb n ASP 170 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1qhb s ILE 171 N -1.91 4.34 0.08 0.53 1.01 -0.72 -4.87 121.20 119.67 1qhb s ILE 171 Ca 0.48 1.73 -0.26 0.00 0.00 0.00 0.00 60.65 62.60 1qhb s ILE 171 Cb 0.31 -4.15 -0.06 0.00 0.01 0.00 0.00 42.46 38.58 1qhb s ILE 171 CO 0.22 0.50 0.82 -1.61 0.00 0.00 0.00 174.94 174.87 1qhb s GLU 172 N -1.20 4.56 0.25 2.79 2.02 -1.26 -2.46 118.70 123.40 1qhb s GLU 172 Ca 0.37 1.18 -0.04 0.00 0.02 0.00 0.00 54.97 56.50 1qhb s GLU 172 Cb -0.23 -3.35 0.45 0.00 0.10 0.00 0.00 34.13 31.11 1qhb s GLU 172 CO 0.27 0.32 1.75 0.74 0.02 0.00 0.00 175.26 178.36 1qhb h PHE 173 N 5.40 0.63 0.00 1.61 0.04 -1.52 0.69 116.94 123.78 1qhb h PHE 173 Ca -0.44 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.36 1qhb h PHE 173 Cb 1.21 -0.16 0.00 0.00 2.20 0.00 0.00 35.95 39.19 1qhb h PHE 173 CO 0.65 0.14 0.00 0.43 -0.60 0.00 0.00 178.31 178.93 1qhb n SER 174 N -4.92 0.00 -0.47 2.17 7.64 -1.26 -3.17 113.62 113.61 1qhb n SER 174 Ca 0.14 -0.47 0.07 0.00 1.01 0.00 0.00 58.87 59.62 1qhb n SER 174 Cb 0.39 -0.07 0.17 0.00 -1.01 0.00 0.00 64.21 63.69 1qhb n SER 174 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1qhb n GLU 175 N -1.07 1.37 -0.20 1.43 1.02 0.23 -4.75 120.64 118.67 1qhb n GLU 175 Ca 0.14 -2.96 -0.05 0.00 -0.02 0.00 0.00 57.16 54.27 1qhb n GLU 175 Cb 0.09 -1.48 0.11 0.00 -0.02 0.00 0.00 31.44 30.15 1qhb n GLU 175 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1qhb h PHE 176 N 0.65 1.05 -0.67 -0.32 -1.00 -1.54 -2.53 116.94 112.58 1qhb h PHE 176 Ca -0.01 -0.11 0.00 0.00 2.81 0.00 0.00 57.97 60.66 1qhb h PHE 176 Cb 1.05 -0.30 0.00 0.00 3.61 0.00 0.00 35.95 40.31 1qhb h PHE 176 CO 0.47 0.86 0.00 -3.47 -1.61 0.00 0.00 178.31 174.56 1qhb n ASP 177 N -4.25 4.06 -4.79 2.17 -0.08 -1.26 -4.80 116.55 107.60 1qhb n ASP 177 Ca 0.05 -2.16 -0.39 0.00 -1.51 0.00 0.00 54.79 50.78 1qhb n ASP 177 Cb 0.24 -0.51 -0.06 0.00 2.34 0.00 0.00 41.12 43.14 1qhb n ASP 177 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1qhb s SER 178 N -0.95 7.28 0.47 1.67 0.15 -0.95 -4.97 113.70 116.40 1qhb s SER 178 Ca 0.48 1.54 0.23 0.00 0.70 0.00 0.00 55.95 58.90 1qhb s SER 178 Cb 0.27 -2.46 1.26 0.00 -1.71 0.00 0.00 66.02 63.38 1qhb s SER 178 CO 0.29 0.20 1.87 -0.65 1.20 0.00 0.00 173.24 176.15 1qhb h PRO 179 N 4.24 0.22 0.00 5.44 0.11 -1.92 0.55 132.00 140.63 1qhb h PRO 179 Ca -0.48 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1qhb h PRO 179 Cb 1.21 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1qhb h PRO 179 CO 0.65 0.14 -0.04 1.57 -0.21 0.00 0.00 178.00 180.12 1qhb h LYS 180 N 0.22 0.00 -0.02 1.05 2.10 -1.93 -2.59 116.57 115.41 1qhb h LYS 180 Ca 0.44 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.09 1qhb h LYS 180 Cb 1.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.71 1qhb h LYS 180 CO -0.11 0.04 -0.01 0.09 -2.00 0.00 0.00 179.45 177.47 1qhb n ASN 181 N -3.30 2.26 -0.25 7.07 3.02 0.16 -4.69 115.26 119.53 1qhb n ASN 181 Ca -0.02 -1.63 0.04 0.00 -0.03 0.00 0.00 54.58 52.94 1qhb n ASN 181 Cb 0.19 0.01 0.17 0.00 -0.61 0.00 0.00 39.78 39.54 1qhb n ASN 181 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qhb h ALA 182 N 3.00 1.00 -0.08 5.41 0.00 -1.19 0.57 119.26 127.97 1qhb h ALA 182 Ca 0.00 0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.05 1qhb h ALA 182 Cb 0.64 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1qhb h ALA 182 CO 0.00 -0.21 -0.11 0.00 0.00 0.00 0.00 179.25 178.93 1qhb h ALA 183 N 1.52 -0.06 -0.14 0.00 0.00 -1.84 0.12 119.26 118.86 1qhb h ALA 183 Ca 0.39 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.30 1qhb h ALA 183 Cb 0.57 0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1qhb h ALA 183 CO -0.39 -0.58 -0.03 0.35 0.00 0.00 0.00 179.25 178.60 1qhb h PHE 184 N -0.16 0.30 -0.44 0.00 3.57 -1.71 -2.22 116.94 116.28 1qhb h PHE 184 Ca 0.07 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1qhb h PHE 184 Cb 0.25 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.90 1qhb h PHE 184 CO -0.21 0.55 0.28 0.82 -2.23 0.00 0.00 178.31 177.52 1qhb h ILE 185 N -0.04 1.13 -0.20 1.41 1.08 -0.73 -0.78 117.51 119.38 1qhb h ILE 185 Ca 0.04 -0.25 -0.02 0.00 -0.39 0.00 0.00 64.86 64.23 1qhb h ILE 185 Cb 0.45 0.50 -0.01 0.00 -3.07 0.00 0.00 36.82 34.69 1qhb h ILE 185 CO 0.01 0.12 0.04 0.03 -0.69 0.00 0.00 178.15 177.66 1qhb h ARG 186 N 0.60 0.33 -0.27 2.37 2.47 -0.82 -1.61 114.38 117.45 1qhb h ARG 186 Ca 0.16 -0.09 -0.07 0.00 -1.26 0.00 0.00 59.98 58.72 1qhb h ARG 186 Cb -0.04 -0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.22 1qhb h ARG 186 CO -0.03 0.48 -0.14 1.03 0.56 0.00 0.00 179.97 181.87 1qhb h SER 187 N 0.13 0.44 -0.09 7.04 0.87 -1.31 -0.37 113.55 120.26 1qhb h SER 187 Ca 0.06 -0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.50 1qhb h SER 187 Cb 0.30 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 62.14 1qhb h SER 187 CO 0.00 0.61 0.04 0.00 -0.53 0.00 0.00 176.83 176.96 1qhb h ALA 188 N 1.44 0.12 -0.28 6.23 0.00 -0.88 -0.93 119.26 124.96 1qhb h ALA 188 Ca 0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1qhb h ALA 188 Cb 0.49 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1qhb h ALA 188 CO 0.03 -0.33 0.12 0.82 0.00 0.00 0.00 179.25 179.90 1qhb h ILE 189 N 0.02 1.17 -0.03 0.00 2.04 -1.01 -2.20 117.51 117.50 1qhb h ILE 189 Ca 0.03 -0.50 0.01 0.00 1.00 0.00 0.00 64.86 65.40 1qhb h ILE 189 Cb 0.12 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 1qhb h ILE 189 CO -0.00 0.17 -0.01 -0.08 0.00 0.00 0.00 178.15 178.23 1qhb h GLU 190 N 0.31 -0.01 -0.23 2.37 4.22 -1.04 0.09 114.58 120.28 1qhb h GLU 190 Ca 0.09 0.00 -0.08 0.00 0.08 0.00 0.00 59.36 59.46 1qhb h GLU 190 Cb 0.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1qhb h GLU 190 CO -0.01 -0.01 -0.19 0.00 -2.18 0.00 0.00 179.01 176.62 1qhb h ARG 191 N -0.01 0.41 -0.26 1.92 3.08 -1.16 -2.57 114.38 115.80 1qhb h ARG 191 Ca 0.02 -0.13 -0.17 0.00 0.07 0.00 0.00 59.98 59.76 1qhb h ARG 191 Cb 0.03 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 1qhb h ARG 191 CO -0.03 0.60 -0.53 -0.07 -1.07 0.00 0.00 179.97 178.87 1qhb h LEU 192 N 0.38 0.82 0.00 3.04 3.38 -1.14 -2.56 115.31 119.23 1qhb h LEU 192 Ca 0.06 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1qhb h LEU 192 Cb 0.56 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1qhb h LEU 192 CO 0.04 1.19 0.00 0.59 0.09 0.00 0.00 178.44 180.35 1qhb n ASN 193 N -3.99 0.00 -0.27 -0.43 3.02 -0.00 -1.43 115.26 112.15 1qhb n ASN 193 Ca -0.04 0.43 0.15 0.00 -0.03 0.00 0.00 54.58 55.09 1qhb n ASN 193 Cb 0.61 -0.47 0.71 0.00 -0.61 0.00 0.00 39.78 40.02 1qhb n ASN 193 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qhb n GLY 194 N 0.56 -0.44 3.79 7.41 0.00 -0.96 -4.45 105.19 111.10 1qhb n GLY 194 Ca 0.06 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.38 1qhb n GLY 194 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1qhb s LEU 195 N -2.00 4.29 0.32 0.99 1.43 -0.51 -4.99 118.68 118.20 1qhb s LEU 195 Ca 0.42 0.34 0.06 0.00 -1.03 0.00 0.00 54.13 53.93 1qhb s LEU 195 Cb 0.21 -2.09 0.73 0.00 0.03 0.00 0.00 46.19 45.08 1qhb s LEU 195 CO 0.35 0.27 1.82 -0.08 0.23 0.00 0.00 176.35 178.94 1qhb h GLU 196 N 5.97 0.76 -0.48 1.70 4.81 -1.87 -0.91 114.58 124.55 1qhb h GLU 196 Ca -0.47 -0.05 0.09 0.00 -0.13 0.00 0.00 59.36 58.81 1qhb h GLU 196 Cb 1.18 -0.17 -0.08 0.00 0.63 0.00 0.00 28.75 30.31 1qhb h GLU 196 CO 0.69 0.50 -0.06 2.35 -0.73 0.00 0.00 179.01 181.76 1qhb h TRP 197 N 0.79 -0.14 0.06 0.92 2.91 -1.85 -2.03 115.95 116.61 1qhb h TRP 197 Ca 0.52 0.04 -0.26 0.00 1.13 0.00 0.00 58.89 60.32 1qhb h TRP 197 Cb 0.78 0.14 -0.02 0.00 -0.51 0.00 0.00 29.16 29.55 1qhb h TRP 197 CO -0.00 -0.16 -1.30 0.74 -1.03 0.00 0.00 178.44 176.69 1qhb h PHE 198 N 0.05 0.24 -0.36 2.65 0.04 -1.52 -3.37 116.94 114.68 1qhb h PHE 198 Ca 0.24 -0.18 0.00 0.00 2.80 0.00 0.00 57.97 60.83 1qhb h PHE 198 Cb 0.36 -0.01 0.00 0.00 2.20 0.00 0.00 35.95 38.50 1qhb h PHE 198 CO -0.35 1.17 0.00 0.27 -0.60 0.00 0.00 178.31 178.80 1qhb n ASN 199 N -3.38 2.67 -3.97 2.17 0.23 -0.43 -3.51 115.26 109.04 1qhb n ASN 199 Ca -0.09 -1.90 -0.17 0.00 -0.53 0.00 0.00 54.58 51.89 1qhb n ASN 199 Cb 1.00 -0.23 -0.15 0.00 -2.08 0.00 0.00 39.78 38.32 1qhb n ASN 199 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1qhb s THR 200 N -1.53 0.51 0.74 5.53 2.01 -0.78 -5.00 115.64 117.12 1qhb s THR 200 Ca 0.35 -0.26 -0.12 0.00 0.31 0.00 0.00 61.69 61.98 1qhb s THR 200 Cb 0.20 -0.44 0.04 0.00 0.01 0.00 0.00 72.50 72.31 1qhb s THR 200 CO 0.27 0.15 1.13 -2.16 -0.69 0.00 0.00 174.62 173.32 1qhb s PRO 201 N -0.06 2.53 1.03 4.92 0.04 -1.26 -4.74 135.00 137.46 1qhb s PRO 201 Ca 0.01 0.34 -0.12 0.00 0.04 0.00 0.00 61.00 61.27 1qhb s PRO 201 Cb -0.04 -1.99 0.21 0.00 0.04 0.00 0.00 34.50 32.72 1qhb s PRO 201 CO -0.00 -1.24 1.07 0.00 0.04 0.00 0.00 177.00 176.87 1qhb s ALA 202 N -3.43 0.54 0.08 8.56 0.00 -1.26 -5.04 121.76 121.20 1qhb s ALA 202 Ca 0.60 0.03 0.07 0.00 0.00 0.00 0.00 51.96 52.65 1qhb s ALA 202 Cb -0.11 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 1qhb s ALA 202 CO 0.51 -3.18 -0.19 0.15 0.00 0.00 0.00 175.76 173.05 1qhb s LYS 203 N -4.66 1.07 0.08 0.00 -0.14 -1.26 -5.07 119.74 109.76 1qhb s LYS 203 Ca 0.67 -1.05 -0.36 0.00 -1.36 0.00 0.00 55.97 53.87 1qhb s LYS 203 Cb -0.22 -1.24 -0.15 0.00 -1.68 0.00 0.00 37.83 34.54 1qhb s LYS 203 CO 0.61 0.29 1.51 -0.11 -0.76 0.00 0.00 175.35 176.89 1qhb n LEU 204 N 1.32 2.44 0.00 3.17 7.94 -1.26 -1.39 117.00 129.21 1qhb n LEU 204 Ca -0.19 1.09 0.00 0.00 -1.11 0.00 0.00 56.01 55.80 1qhb n LEU 204 Cb 0.54 -1.30 0.00 0.00 0.53 0.00 0.00 43.42 43.19 1qhb n LEU 204 CO 0.22 -0.61 0.00 0.61 -1.11 0.00 0.00 177.39 176.50 1qhb n GLY 205 N 3.16 1.57 3.77 -3.96 0.00 -1.26 -5.08 105.19 103.38 1qhb n GLY 205 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1qhb n GLY 205 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qhb s ASP 206 N -0.66 5.66 0.19 1.61 1.01 -0.49 -4.94 116.67 119.07 1qhb s ASP 206 Ca 0.00 2.32 -0.33 0.00 0.71 0.00 0.00 52.55 55.25 1qhb s ASP 206 Cb 0.00 -2.60 -0.13 0.00 1.01 0.00 0.00 42.92 41.20 1qhb s ASP 206 CO 0.00 -1.27 1.57 -2.65 0.21 0.00 0.00 175.17 173.03 1qhb n PRO 207 N -1.14 2.26 -0.34 8.23 -0.02 -1.26 -4.84 135.00 137.90 1qhb n PRO 207 Ca 0.11 0.81 0.22 0.00 -2.02 0.00 0.00 63.50 62.62 1qhb n PRO 207 Cb 0.49 -2.58 0.47 0.00 -0.02 0.00 0.00 33.50 31.86 1qhb n PRO 207 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1qhb h PRO 208 N 5.66 0.43 -0.14 0.52 0.11 -1.99 0.11 132.00 136.70 1qhb h PRO 208 Ca -0.45 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.56 1qhb h PRO 208 Cb 1.25 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.25 1qhb h PRO 208 CO 0.87 0.28 -0.26 0.00 -0.21 0.00 0.00 178.00 178.68 1qhb h ALA 209 N 1.68 1.30 -0.33 -0.75 0.00 -2.00 -1.43 119.26 117.73 1qhb h ALA 209 Ca 0.64 -0.31 -0.14 0.00 0.00 0.00 0.00 54.91 55.10 1qhb h ALA 209 Cb 1.48 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 1qhb h ALA 209 CO -0.40 0.48 -0.35 0.93 0.00 0.00 0.00 179.25 179.91 1qhb h GLU 210 N 0.23 0.82 -0.60 0.00 5.08 -1.16 -2.57 114.58 116.38 1qhb h GLU 210 Ca 0.04 -0.44 -0.01 0.00 -1.00 0.00 0.00 59.36 57.95 1qhb h GLU 210 Cb 0.59 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.84 1qhb h GLU 210 CO 0.04 1.08 0.35 0.82 -1.00 0.00 0.00 179.01 180.30 1qhb h ILE 211 N 0.60 1.18 -0.08 3.13 2.04 -1.14 -0.33 117.51 122.90 1qhb h ILE 211 Ca 0.05 -0.43 -0.07 0.00 1.00 0.00 0.00 64.86 65.42 1qhb h ILE 211 Cb 0.94 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.39 1qhb h ILE 211 CO 0.09 0.19 -0.25 -0.09 0.00 0.00 0.00 178.15 178.09 1qhb h ARG 212 N 0.81 0.15 -0.02 2.37 2.43 -1.11 -3.14 114.38 115.86 1qhb h ARG 212 Ca 0.21 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 1qhb h ARG 212 Cb 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1qhb h ARG 212 CO -0.04 0.39 -0.27 2.89 -1.51 0.00 0.00 179.97 181.43 1qhb n ARG 213 N -4.19 1.65 -2.10 0.20 1.85 -0.98 -4.96 116.66 108.13 1qhb n ARG 213 Ca -0.01 -1.34 -0.41 0.00 -1.00 0.00 0.00 57.85 55.09 1qhb n ARG 213 Cb 0.34 -1.44 -0.02 0.00 -1.05 0.00 0.00 32.46 30.28 1qhb n ARG 213 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1qhb s ARG 214 N -2.18 4.33 0.19 2.89 3.52 -0.17 -5.01 118.95 122.51 1qhb s ARG 214 Ca 0.21 2.20 0.06 0.00 -0.13 0.00 0.00 55.73 58.08 1qhb s ARG 214 Cb 0.18 -3.13 -0.04 0.00 -1.56 0.00 0.00 34.95 30.40 1qhb s ARG 214 CO 0.44 -0.31 0.08 1.03 -0.81 0.00 0.00 175.30 175.73 1qhb s ARG 215 N -0.59 2.68 0.00 5.12 0.52 -1.26 -5.04 118.95 120.38 1qhb s ARG 215 Ca 0.56 -1.02 0.00 0.00 -0.52 0.00 0.00 55.73 54.75 1qhb s ARG 215 Cb -0.40 -2.50 0.00 0.00 0.52 0.00 0.00 34.95 32.58 1qhb s ARG 215 CO 0.44 0.45 0.00 0.41 0.02 0.00 0.00 175.30 176.62 1qhb n GLY 216 N -0.41 1.89 3.64 -3.53 0.00 -1.26 -4.29 105.19 101.23 1qhb n GLY 216 Ca -0.09 -1.95 -0.49 0.00 0.00 0.00 0.00 46.02 43.49 1qhb n GLY 216 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1qhb n GLU 217 N 0.00 1.74 -2.84 1.61 2.13 -1.23 -4.80 120.64 117.25 1qhb n GLU 217 Ca 0.00 0.63 -0.41 0.00 0.66 0.00 0.00 57.16 58.04 1qhb n GLU 217 Cb 0.00 -2.35 -0.04 0.00 0.27 0.00 0.00 31.44 29.32 1qhb n GLU 217 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1qhb s VAL 218 N 1.05 4.88 0.36 6.31 1.01 -1.26 -4.97 120.40 127.77 1qhb s VAL 218 Ca 0.83 1.84 0.04 0.00 0.00 0.00 0.00 61.98 64.68 1qhb s VAL 218 Cb -0.80 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.33 1qhb s VAL 218 CO 0.43 0.22 0.13 0.42 0.00 0.00 0.00 175.10 176.30 1qhb s THR 219 N 0.76 0.62 0.42 3.92 -4.23 -1.26 -4.95 115.64 110.92 1qhb s THR 219 Ca 0.46 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 59.10 1qhb s THR 219 Cb -0.20 -2.49 0.16 0.00 1.34 0.00 0.00 72.50 71.30 1qhb s THR 219 CO 0.25 0.00 1.94 0.58 -0.54 0.00 0.00 174.62 176.85 1qhb h VAL 220 N 2.00 1.17 0.00 2.29 2.07 -1.96 -1.10 116.25 120.72 1qhb h VAL 220 Ca -0.36 -0.81 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 1qhb h VAL 220 Cb 1.26 1.40 -0.00 0.00 -1.52 0.00 0.00 31.29 32.42 1qhb h VAL 220 CO 0.57 0.23 -0.05 1.23 0.02 0.00 0.00 177.57 179.58 1qhb h GLY 221 N 0.71 0.00 -0.22 2.17 0.00 -1.99 -3.27 103.07 100.48 1qhb h GLY 221 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1qhb h GLY 221 CO 0.03 0.00 0.00 1.16 0.00 0.00 0.00 176.54 177.73 1qhb n ASN 222 N -3.13 1.40 -4.69 0.19 0.23 -0.96 -4.92 115.26 103.37 1qhb n ASN 222 Ca 0.02 -1.27 -0.42 0.00 -0.53 0.00 0.00 54.58 52.38 1qhb n ASN 222 Cb 0.44 -0.01 -0.03 0.00 -2.08 0.00 0.00 39.78 38.10 1qhb n ASN 222 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 1qhb s LEU 223 N -0.36 4.40 -0.79 -4.53 2.96 -0.45 -1.96 118.68 117.94 1qhb s LEU 223 Ca 0.03 2.79 0.00 0.00 -0.22 0.00 0.00 54.13 56.73 1qhb s LEU 223 Cb 0.02 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.15 1qhb s LEU 223 CO 0.03 -1.02 0.00 0.49 -1.32 0.00 0.00 176.35 174.53 1qhb n PHE 224 N 5.73 0.00 -3.43 5.38 3.72 -1.26 -5.00 117.46 122.60 1qhb n PHE 224 Ca 0.18 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.38 1qhb n PHE 224 Cb 0.38 -1.95 -0.00 0.00 -0.94 0.00 0.00 39.48 36.97 1qhb n PHE 224 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1qhb s ARG 225 N -2.32 3.15 0.27 -1.08 0.52 -0.83 -5.02 118.95 113.64 1qhb s ARG 225 Ca 0.00 -0.86 0.01 0.00 -0.52 0.00 0.00 55.73 54.36 1qhb s ARG 225 Cb 0.00 -2.77 0.05 0.00 0.52 0.00 0.00 34.95 32.75 1qhb s ARG 225 CO 0.00 0.04 0.38 0.41 0.02 0.00 0.00 175.30 176.15 1qhb n GLY 226 N -1.70 1.12 0.03 -3.53 0.00 -1.26 -5.05 105.19 94.79 1qhb n GLY 226 Ca -0.01 -2.05 0.02 0.00 0.00 0.00 0.00 46.02 43.99 1qhb n GLY 226 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1qhb n ILE 227 N -1.82 1.16 -2.02 -0.61 -5.35 -1.26 -4.70 119.36 104.76 1qhb n ILE 227 Ca 0.07 -1.26 -0.37 0.00 -0.27 0.00 0.00 62.75 60.92 1qhb n ILE 227 Cb 0.24 0.34 0.02 0.00 -1.74 0.00 0.00 39.64 38.50 1qhb n ILE 227 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1qhb s LEU 228 N -1.41 3.79 0.04 7.28 1.43 -1.26 -4.87 118.68 123.68 1qhb s LEU 228 Ca 0.08 2.45 -0.33 0.00 -1.03 0.00 0.00 54.13 55.30 1qhb s LEU 228 Cb 0.07 -4.44 -0.12 0.00 0.03 0.00 0.00 46.19 41.73 1qhb s LEU 228 CO 0.01 -1.43 1.80 -2.65 0.23 0.00 0.00 176.35 174.31 1qhb n PRO 229 N -1.20 2.38 0.00 1.29 -0.02 -1.26 -1.33 135.00 134.87 1qhb n PRO 229 Ca 0.11 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.46 1qhb n PRO 229 Cb 0.48 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.25 1qhb n PRO 229 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qhb n GLY 230 N 4.12 1.83 0.27 -1.23 0.00 -1.26 -4.58 105.19 104.33 1qhb n GLY 230 Ca 0.20 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.38 1qhb n GLY 230 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1qhb h SER 231 N 0.85 0.00 -0.33 1.61 0.02 -1.40 -2.76 113.55 111.54 1qhb h SER 231 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1qhb h SER 231 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1qhb h SER 231 CO 0.00 0.02 0.00 -0.62 -1.14 0.00 0.00 176.83 175.09 1qhb n GLU 232 N -3.11 2.35 -3.67 3.45 1.02 -1.26 -4.85 120.64 114.57 1qhb n GLU 232 Ca 0.01 -2.03 -0.36 0.00 -0.02 0.00 0.00 57.16 54.76 1qhb n GLU 232 Cb 0.35 -1.49 -0.08 0.00 -0.02 0.00 0.00 31.44 30.20 1qhb n GLU 232 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1qhb s VAL 233 N -1.57 5.37 0.00 2.62 1.01 -1.04 -4.99 120.40 121.79 1qhb s VAL 233 Ca 0.37 0.29 0.00 0.00 0.00 0.00 0.00 61.98 62.64 1qhb s VAL 233 Cb 0.22 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 33.08 1qhb s VAL 233 CO 0.30 0.41 0.00 0.61 0.00 0.00 0.00 175.10 176.43 1qhb n GLY 234 N 3.60 -1.16 3.62 4.51 0.00 -1.26 -4.89 105.19 109.61 1qhb n GLY 234 Ca -0.15 -1.23 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 1qhb n GLY 234 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1qhb n PRO 235 N -0.14 -0.46 0.29 1.61 -0.02 -1.26 -4.97 135.00 130.04 1qhb n PRO 235 Ca 0.00 -0.07 -0.15 0.00 -2.02 0.00 0.00 63.50 61.25 1qhb n PRO 235 Cb 0.00 -2.29 -0.08 0.00 -0.02 0.00 0.00 33.50 31.11 1qhb n PRO 235 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 1qhb h TYR 236 N -1.86 -0.67 -3.59 6.00 5.03 -1.90 -3.43 116.97 116.56 1qhb h TYR 236 Ca -0.43 -0.02 -0.51 0.00 2.58 0.00 0.00 58.73 60.35 1qhb h TYR 236 Cb 1.27 0.22 -0.02 0.00 1.55 0.00 0.00 36.73 39.75 1qhb h TYR 236 CO 0.48 -0.35 0.33 -0.51 -1.32 0.00 0.00 178.16 176.79 1qhb s LEU 237 N -9.77 4.53 0.49 2.82 1.43 -1.26 -4.93 118.68 111.98 1qhb s LEU 237 Ca -0.16 1.78 -0.23 0.00 -1.03 0.00 0.00 54.13 54.50 1qhb s LEU 237 Cb 0.03 -3.55 -0.08 0.00 0.03 0.00 0.00 46.19 42.62 1qhb s LEU 237 CO 0.55 -0.01 1.22 -0.24 0.23 0.00 0.00 176.35 178.11 1qhb n SER 238 N 2.51 2.16 -0.11 2.29 2.88 -1.26 -4.88 113.62 117.20 1qhb n SER 238 Ca 0.01 1.01 0.11 0.00 -1.33 0.00 0.00 58.87 58.67 1qhb n SER 238 Cb 0.49 -1.49 0.47 0.00 -0.75 0.00 0.00 64.21 62.92 1qhb n SER 238 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1qhb h GLN 239 N 1.56 0.48 0.00 -1.46 1.08 -1.90 -2.27 115.11 112.60 1qhb h GLN 239 Ca -0.48 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 1qhb h GLN 239 Cb 1.31 -0.11 0.00 0.00 -0.05 0.00 0.00 27.48 28.64 1qhb h GLN 239 CO 0.57 0.32 0.00 1.19 -0.95 0.00 0.00 178.83 179.96 1qhb n PHE 240 N -4.48 0.00 0.49 2.96 3.72 -1.26 -0.38 117.46 118.51 1qhb n PHE 240 Ca 0.10 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.57 1qhb n PHE 240 Cb 0.35 -0.43 0.07 0.00 -0.94 0.00 0.00 39.48 38.54 1qhb n PHE 240 CO 0.00 0.00 0.00 1.51 -0.05 0.00 0.00 176.76 178.22 1qhb n ILE 241 N -1.43 0.11 0.00 4.37 3.06 -0.85 -4.65 119.36 119.97 1qhb n ILE 241 Ca 0.04 -0.56 0.00 0.00 -2.50 0.00 0.00 62.75 59.74 1qhb n ILE 241 Cb 0.14 1.20 0.00 0.00 0.54 0.00 0.00 39.64 41.52 1qhb n ILE 241 CO 0.00 0.00 0.00 2.30 -2.50 0.00 0.00 176.55 176.35 1qhb n ILE 242 N 0.78 0.00 -2.14 9.51 -5.35 -1.03 -4.77 119.36 116.36 1qhb n ILE 242 Ca 0.09 0.00 -0.28 0.00 -0.27 0.00 0.00 62.75 62.28 1qhb n ILE 242 Cb 0.36 -0.37 0.04 0.00 -1.74 0.00 0.00 39.64 37.93 1qhb n ILE 242 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1qhb s VAL 243 N -1.42 3.68 0.00 7.28 -7.23 0.49 -4.30 120.40 118.89 1qhb s VAL 243 Ca 0.00 0.28 0.00 0.00 -1.81 0.00 0.00 61.98 60.45 1qhb s VAL 243 Cb 0.00 -3.50 0.00 0.00 0.56 0.00 0.00 36.38 33.44 1qhb s VAL 243 CO 0.00 -0.59 0.00 0.61 -0.31 0.00 0.00 175.10 174.81 1qhb n GLY 244 N -2.78 1.60 3.47 2.32 0.00 -0.22 -4.70 105.19 104.89 1qhb n GLY 244 Ca 0.06 -2.05 -0.23 0.00 0.00 0.00 0.00 46.02 43.80 1qhb n GLY 244 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qhb s SER 245 N -1.00 2.43 0.66 1.61 1.04 -0.65 -4.89 113.70 112.90 1qhb s SER 245 Ca 0.00 -1.50 -0.17 0.00 0.48 0.00 0.00 55.95 54.75 1qhb s SER 245 Cb 0.00 0.20 -0.02 0.00 0.10 0.00 0.00 66.02 66.30 1qhb s SER 245 CO 0.00 -0.76 1.05 1.17 0.98 0.00 0.00 173.24 175.69 1qhb n LYS 246 N -0.76 0.80 -4.31 4.02 4.81 -1.26 -3.94 118.16 117.52 1qhb n LYS 246 Ca -0.04 0.33 -0.25 0.00 -0.87 0.00 0.00 58.31 57.48 1qhb n LYS 246 Cb 0.66 -2.29 -0.09 0.00 0.02 0.00 0.00 35.03 33.34 1qhb n LYS 246 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1qhb s GLN 247 N -3.14 2.11 0.29 1.64 -1.52 -1.26 -4.42 119.66 113.36 1qhb s GLN 247 Ca 0.77 -1.38 -0.29 0.00 -1.95 0.00 0.00 55.36 52.51 1qhb s GLN 247 Cb -0.38 -2.12 -0.13 0.00 -0.22 0.00 0.00 33.01 30.16 1qhb s GLN 247 CO 0.46 0.40 1.27 -0.89 -0.25 0.00 0.00 175.29 176.27 1qhb n ILE 248 N -0.38 1.63 0.00 1.08 2.08 -1.26 -1.94 119.36 120.56 1qhb n ILE 248 Ca -0.09 -0.41 0.00 0.00 0.56 0.00 0.00 62.75 62.82 1qhb n ILE 248 Cb 0.57 -1.40 0.00 0.00 -0.75 0.00 0.00 39.64 38.06 1qhb n ILE 248 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1qhb n GLY 249 N 1.33 2.37 3.52 7.39 0.00 -1.26 -4.61 105.19 113.93 1qhb n GLY 249 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1qhb n GLY 249 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1qhb s SER 250 N -1.46 6.26 0.24 1.61 0.01 -0.82 -2.91 113.70 116.63 1qhb s SER 250 Ca 0.00 -0.34 -0.21 0.00 1.31 0.00 0.00 55.95 56.71 1qhb s SER 250 Cb 0.00 -2.25 0.03 0.00 0.21 0.00 0.00 66.02 64.01 1qhb s SER 250 CO 0.00 -0.56 0.66 0.00 0.41 0.00 0.00 173.24 173.75 1qhb s ALA 251 N 2.34 -1.23 -0.21 1.44 0.00 -0.89 -4.91 121.76 118.31 1qhb s ALA 251 Ca 0.16 -0.13 -0.02 0.00 0.00 0.00 0.00 51.96 51.97 1qhb s ALA 251 Cb -0.16 0.87 0.00 0.00 0.00 0.00 0.00 23.12 23.83 1qhb s ALA 251 CO 0.14 -0.94 -0.09 0.99 0.00 0.00 0.00 175.76 175.87 1qhb s THR 252 N -3.88 2.98 -0.50 0.00 2.01 -1.26 0.11 115.64 115.10 1qhb s THR 252 Ca 0.09 -0.63 0.01 0.00 0.31 0.00 0.00 61.69 61.47 1qhb s THR 252 Cb -0.04 -2.33 0.13 0.00 0.01 0.00 0.00 72.50 70.27 1qhb s THR 252 CO 0.01 0.46 0.26 -0.69 -0.69 0.00 0.00 174.62 173.97 1qhb s VAL 253 N 1.42 2.96 0.00 3.82 1.01 0.69 -4.98 120.40 125.32 1qhb s VAL 253 Ca 0.06 -2.86 0.00 0.00 0.00 0.00 0.00 61.98 59.18 1qhb s VAL 253 Cb -0.14 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.22 1qhb s VAL 253 CO -0.06 -0.77 0.00 0.61 0.00 0.00 0.00 175.10 174.88 1qhb n GLY 254 N 3.64 2.76 1.02 4.51 0.00 -1.26 -1.81 105.19 114.05 1qhb n GLY 254 Ca 0.05 0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.25 1qhb n GLY 254 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1qhb n ASN 255 N 10.02 3.09 -4.62 1.61 0.23 -1.26 -4.92 115.26 119.43 1qhb n ASN 255 Ca 0.00 -1.95 -0.34 0.00 -0.53 0.00 0.00 54.58 51.76 1qhb n ASN 255 Cb 0.00 -0.16 -0.10 0.00 -2.08 0.00 0.00 39.78 37.44 1qhb n ASN 255 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1qhb s LYS 256 N -1.68 3.65 -0.25 -3.83 2.20 -0.75 -5.09 119.74 114.00 1qhb s LYS 256 Ca 0.35 -0.40 -0.10 0.00 -0.36 0.00 0.00 55.97 55.46 1qhb s LYS 256 Cb 0.22 -3.03 -0.05 0.00 -1.51 0.00 0.00 37.83 33.45 1qhb s LYS 256 CO 0.31 0.39 0.16 0.99 -0.36 0.00 0.00 175.35 176.83 1qhb s THR 257 N 0.02 5.27 0.03 3.43 2.01 -1.26 -0.22 115.64 124.91 1qhb s THR 257 Ca 0.04 0.15 0.01 0.00 0.31 0.00 0.00 61.69 62.19 1qhb s THR 257 Cb -0.13 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 1qhb s THR 257 CO 0.02 0.33 0.11 -0.76 -0.69 0.00 0.00 174.62 173.62 1qhb s LEU 258 N 1.23 3.97 -0.12 4.42 1.43 0.12 -4.97 118.68 124.75 1qhb s LEU 258 Ca 0.07 0.13 0.03 0.00 -1.03 0.00 0.00 54.13 53.33 1qhb s LEU 258 Cb -0.14 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.61 1qhb s LEU 258 CO 0.06 0.22 -0.21 -0.69 0.23 0.00 0.00 176.35 175.96 1qhb s VAL 259 N -1.31 2.23 0.51 -1.59 1.01 -1.23 -2.09 120.40 117.92 1qhb s VAL 259 Ca 0.27 -0.95 -0.22 0.00 0.00 0.00 0.00 61.98 61.08 1qhb s VAL 259 Cb -0.12 -1.88 -0.06 0.00 0.00 0.00 0.00 36.38 34.32 1qhb s VAL 259 CO 0.19 0.55 1.28 -0.55 0.00 0.00 0.00 175.10 176.57 1qhb s SER 260 N 0.51 5.66 0.08 3.32 0.15 -1.14 -4.71 113.70 117.57 1qhb s SER 260 Ca -0.14 2.58 0.18 0.00 0.70 0.00 0.00 55.95 59.27 1qhb s SER 260 Cb -0.17 -2.62 0.75 0.00 -1.71 0.00 0.00 66.02 62.27 1qhb s SER 260 CO 0.05 -1.29 1.56 -0.81 1.20 0.00 0.00 173.24 173.95 1qhb n PRO 261 N -0.78 0.06 -0.49 5.44 -0.05 -1.26 -1.64 135.00 136.28 1qhb n PRO 261 Ca 0.09 0.29 0.05 0.00 -0.05 0.00 0.00 63.50 63.88 1qhb n PRO 261 Cb 0.46 -1.62 0.22 0.00 -0.05 0.00 0.00 33.50 32.51 1qhb n PRO 261 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 175.50 175.54 1qhb n ASN 262 N -1.74 3.13 0.08 3.54 3.02 -1.26 -4.79 115.26 117.24 1qhb n ASN 262 Ca 0.03 -3.29 0.19 0.00 -0.03 0.00 0.00 54.58 51.49 1qhb n ASN 262 Cb 0.20 -0.55 0.73 0.00 -0.61 0.00 0.00 39.78 39.55 1qhb n ASN 262 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1qhb h ALA 263 N 1.22 2.24 0.00 5.41 0.00 -1.67 -1.30 119.26 125.16 1qhb h ALA 263 Ca 0.07 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1qhb h ALA 263 Cb 1.42 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.24 1qhb h ALA 263 CO 0.23 -0.55 -0.14 0.00 0.00 0.00 0.00 179.25 178.78 1qhb h ALA 264 N 1.69 1.14 -0.32 0.00 0.00 -1.86 -2.85 119.26 117.06 1qhb h ALA 264 Ca 0.19 -0.13 0.09 0.00 0.00 0.00 0.00 54.91 55.06 1qhb h ALA 264 Cb 0.88 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1qhb h ALA 264 CO -0.00 0.18 0.26 -0.44 0.00 0.00 0.00 179.25 179.25 1qhb h ASP 265 N 0.00 0.00 -0.92 0.00 3.32 -1.60 -1.09 116.42 116.13 1qhb h ASP 265 Ca -0.00 0.00 0.06 0.00 0.02 0.00 0.00 57.03 57.11 1qhb h ASP 265 Cb 0.49 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 39.98 1qhb h ASP 265 CO 0.02 0.00 0.58 -0.08 -1.72 0.00 0.00 179.24 178.04 1qhb h GLU 266 N 0.00 1.04 -0.55 3.56 4.81 -1.62 -1.06 114.58 120.75 1qhb h GLU 266 Ca 0.15 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1qhb h GLU 266 Cb 0.68 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1qhb h GLU 266 CO -0.00 0.69 0.00 1.19 -0.73 0.00 0.00 179.01 180.16 1qhb n PHE 267 N -4.56 0.84 -1.23 0.92 3.72 -0.42 -1.05 117.46 115.67 1qhb n PHE 267 Ca 0.13 -0.36 0.09 0.00 -0.05 0.00 0.00 57.45 57.26 1qhb n PHE 267 Cb 0.16 -0.11 0.14 0.00 -0.94 0.00 0.00 39.48 38.74 1qhb n PHE 267 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1qhb n ASP 268 N 0.74 2.08 0.00 4.37 2.03 -0.45 -4.36 116.55 120.96 1qhb n ASP 268 Ca 0.16 -3.14 0.00 0.00 0.52 0.00 0.00 54.79 52.33 1qhb n ASP 268 Cb 0.53 -0.43 0.00 0.00 -0.72 0.00 0.00 41.12 40.50 1qhb n ASP 268 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1qhb n GLY 269 N -1.27 0.50 3.44 0.27 0.00 -1.18 -4.87 105.19 102.08 1qhb n GLY 269 Ca 0.15 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.90 1qhb n GLY 269 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qhb s GLU 270 N -2.15 3.47 -0.13 1.61 0.41 -0.91 -0.69 118.70 120.32 1qhb s GLU 270 Ca 0.00 -0.61 -0.20 0.00 -0.41 0.00 0.00 54.97 53.74 1qhb s GLU 270 Cb 0.00 -3.45 -0.04 0.00 -1.78 0.00 0.00 34.13 28.86 1qhb s GLU 270 CO 0.00 -0.31 0.57 0.42 -0.49 0.00 0.00 175.26 175.45 1qhb s ILE 271 N 1.61 5.11 -0.06 -1.63 1.01 0.10 -1.64 121.20 125.70 1qhb s ILE 271 Ca 0.05 1.14 -0.30 0.00 0.00 0.00 0.00 60.65 61.54 1qhb s ILE 271 Cb -0.16 -3.91 -0.05 0.00 0.01 0.00 0.00 42.46 38.35 1qhb s ILE 271 CO 0.05 0.25 1.54 0.00 0.00 0.00 0.00 174.94 176.78 1qhb s ALA 272 N 1.03 3.63 -0.63 9.38 0.00 -1.26 -0.99 121.76 132.92 1qhb s ALA 272 Ca 0.30 0.86 0.05 0.00 0.00 0.00 0.00 51.96 53.16 1qhb s ALA 272 Cb -0.16 -3.69 0.16 0.00 0.00 0.00 0.00 23.12 19.42 1qhb s ALA 272 CO 0.12 -1.26 0.41 -0.47 0.00 0.00 0.00 175.76 174.57 1qhb s TYR 273 N 3.57 3.27 0.00 0.00 5.04 -0.01 -4.85 117.35 124.38 1qhb s TYR 273 Ca 0.68 -3.21 0.00 0.00 -2.44 0.00 0.00 57.07 52.11 1qhb s TYR 273 Cb -0.31 -2.62 0.00 0.00 0.35 0.00 0.00 41.96 39.38 1qhb s TYR 273 CO 0.26 -0.62 0.00 0.41 -1.34 0.00 0.00 175.55 174.26 1qhb n GLY 274 N 2.41 2.44 0.88 8.97 0.00 -1.26 -1.97 105.19 116.66 1qhb n GLY 274 Ca 0.15 -0.33 0.12 0.00 0.00 0.00 0.00 46.02 45.97 1qhb n GLY 274 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1qhb n SER 275 N 7.73 2.82 -0.85 1.61 7.64 -1.26 -4.93 113.62 126.39 1qhb n SER 275 Ca 0.00 -1.91 0.00 0.00 1.01 0.00 0.00 58.87 57.97 1qhb n SER 275 Cb 0.00 0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.28 1qhb n SER 275 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1qhb n ILE 276 N 1.11 0.00 -4.08 0.44 -5.35 -0.83 -5.10 119.36 105.55 1qhb n ILE 276 Ca 0.13 0.00 -0.10 0.00 -0.27 0.00 0.00 62.75 62.52 1qhb n ILE 276 Cb 0.57 -0.17 -0.10 0.00 -1.74 0.00 0.00 39.64 38.20 1qhb n ILE 276 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1qhb s THR 277 N 0.40 0.39 -0.10 7.28 -4.23 -1.26 -0.83 115.64 117.29 1qhb s THR 277 Ca 0.00 -1.51 -0.00 0.00 -1.18 0.00 0.00 61.69 59.00 1qhb s THR 277 Cb 0.00 -1.11 -0.03 0.00 1.34 0.00 0.00 72.50 72.70 1qhb s THR 277 CO 0.00 -0.74 -0.07 -0.63 -0.54 0.00 0.00 174.62 172.64 1qhb s ILE 278 N -2.81 3.66 -0.11 2.99 1.01 -0.16 -4.85 121.20 120.93 1qhb s ILE 278 Ca 0.00 -0.47 -0.11 0.00 0.00 0.00 0.00 60.65 60.07 1qhb s ILE 278 Cb -0.00 -2.53 -0.05 0.00 0.01 0.00 0.00 42.46 39.89 1qhb s ILE 278 CO -0.05 0.56 0.24 -0.55 0.00 0.00 0.00 174.94 175.15 1qhb s SER 279 N -0.35 6.49 0.00 3.58 0.15 -1.26 0.00 113.70 122.30 1qhb s SER 279 Ca 0.05 0.58 0.30 0.00 0.70 0.00 0.00 55.95 57.58 1qhb s SER 279 Cb -0.12 -2.15 1.51 0.00 -1.71 0.00 0.00 66.02 63.55 1qhb s SER 279 CO 0.02 0.29 2.03 0.00 1.20 0.00 0.00 173.24 176.78 1qhb n GLN 280 N 2.51 0.59 -2.56 5.44 1.13 0.14 -4.84 117.38 119.78 1qhb n GLN 280 Ca -0.16 -0.06 -0.42 0.00 -1.94 0.00 0.00 57.00 54.42 1qhb n GLN 280 Cb 0.53 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.35 1qhb n GLN 280 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1qhb s ARG 281 N -2.46 4.48 0.11 -1.09 0.52 -1.26 -4.58 118.95 114.67 1qhb s ARG 281 Ca 0.32 1.60 0.00 0.00 -0.52 0.00 0.00 55.73 57.13 1qhb s ARG 281 Cb 0.20 -3.42 -0.04 0.00 0.52 0.00 0.00 34.95 32.22 1qhb s ARG 281 CO 0.45 -0.18 0.27 0.54 0.02 0.00 0.00 175.30 176.39 1qhb s VAL 282 N 1.15 5.33 0.62 3.52 0.11 0.01 -4.68 120.40 126.46 1qhb s VAL 282 Ca 0.55 -0.45 -0.18 0.00 -2.93 0.00 0.00 61.98 58.97 1qhb s VAL 282 Cb -0.25 -3.68 -0.02 0.00 -1.53 0.00 0.00 36.38 30.90 1qhb s VAL 282 CO 0.28 0.02 1.21 -0.13 -3.33 0.00 0.00 175.10 173.15 1qhb s ARG 283 N -2.85 2.81 -0.42 1.54 1.81 -1.26 -1.72 118.95 118.87 1qhb s ARG 283 Ca 0.36 1.82 -0.10 0.00 -1.72 0.00 0.00 55.73 56.08 1qhb s ARG 283 Cb -0.12 -1.91 0.07 0.00 -0.45 0.00 0.00 34.95 32.54 1qhb s ARG 283 CO 0.28 -1.33 0.26 0.42 -0.68 0.00 0.00 175.30 174.25 1qhb s ILE 284 N -1.67 4.37 0.38 1.52 1.01 -1.26 -4.88 121.20 120.67 1qhb s ILE 284 Ca 0.77 -1.28 -0.25 0.00 0.00 0.00 0.00 60.65 59.88 1qhb s ILE 284 Cb -0.30 -3.63 -0.09 0.00 0.01 0.00 0.00 42.46 38.45 1qhb s ILE 284 CO 0.36 -0.47 1.10 0.00 0.00 0.00 0.00 174.94 175.93 1qhb s ALA 285 N 1.46 3.17 -0.33 9.38 0.00 -1.26 -0.88 121.76 133.29 1qhb s ALA 285 Ca 0.03 0.83 -0.40 0.00 0.00 0.00 0.00 51.96 52.42 1qhb s ALA 285 Cb -0.22 -3.32 -0.16 0.00 0.00 0.00 0.00 23.12 19.42 1qhb s ALA 285 CO 0.03 -0.32 1.84 2.41 0.00 0.00 0.00 175.76 179.72 1qhb n THR 286 N 0.21 0.24 -1.81 0.00 -1.04 -0.81 -4.79 114.28 106.28 1qhb n THR 286 Ca 0.04 -0.08 -0.41 0.00 -2.04 0.00 0.00 64.05 61.56 1qhb n THR 286 Cb 0.48 -1.17 -0.00 0.00 -1.82 0.00 0.00 70.33 67.82 1qhb n THR 286 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 1qhb s PRO 287 N 4.13 4.12 0.00 -2.82 0.02 -1.26 -2.76 135.00 136.43 1qhb s PRO 287 Ca 1.03 2.56 0.00 0.00 0.02 0.00 0.00 61.00 64.61 1qhb s PRO 287 Cb -1.11 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 30.43 1qhb s PRO 287 CO 0.65 -0.53 0.00 0.41 -0.33 0.00 0.00 177.00 177.20 1qhb n GLY 288 N 0.51 0.73 3.46 0.52 0.00 -1.26 -4.99 105.19 104.16 1qhb n GLY 288 Ca 0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1qhb n GLY 288 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1qhb s ARG 289 N -0.25 3.58 0.31 1.61 3.52 -1.11 -5.02 118.95 121.59 1qhb s ARG 289 Ca 0.00 -0.54 0.09 0.00 -0.13 0.00 0.00 55.73 55.15 1qhb s ARG 289 Cb 0.00 -3.43 -0.06 0.00 -1.56 0.00 0.00 34.95 29.90 1qhb s ARG 289 CO 0.00 -0.26 -0.10 -0.51 -0.81 0.00 0.00 175.30 173.62 1qhb s ASP 290 N 1.63 3.42 0.34 -2.12 1.01 -1.26 -4.94 116.67 114.75 1qhb s ASP 290 Ca 0.06 -1.17 0.06 0.00 0.71 0.00 0.00 52.55 52.22 1qhb s ASP 290 Cb -0.16 -0.29 -0.07 0.00 1.01 0.00 0.00 42.92 43.42 1qhb s ASP 290 CO 0.05 -0.20 -0.01 -0.36 0.21 0.00 0.00 175.17 174.85 1qhb s PHE 291 N -2.71 2.21 -1.42 4.23 0.08 0.34 -4.84 117.98 115.87 1qhb s PHE 291 Ca 0.31 -0.72 -0.06 0.00 0.12 0.00 0.00 56.93 56.57 1qhb s PHE 291 Cb 0.02 -1.42 0.04 0.00 -0.57 0.00 0.00 43.02 41.09 1qhb s PHE 291 CO 0.15 0.32 0.81 -1.33 -0.10 0.00 0.00 175.22 175.06 1qhb n MET 292 N -0.77 -5.06 0.00 0.44 2.81 -1.26 -1.52 117.12 111.76 1qhb n MET 292 Ca -0.04 0.59 0.09 0.00 -1.81 0.00 0.00 57.70 56.53 1qhb n MET 292 Cb 0.65 -5.27 -0.02 0.00 -0.71 0.00 0.00 33.22 27.88 1qhb n MET 292 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1qhb n THR 293 N -4.47 0.00 -4.46 2.03 -2.24 -1.26 -4.71 114.28 99.17 1qhb n THR 293 Ca -0.14 -0.27 -0.34 0.00 -2.27 0.00 0.00 64.05 61.03 1qhb n THR 293 Cb 0.61 1.20 -0.12 0.00 -2.10 0.00 0.00 70.33 69.91 1qhb n THR 293 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1qhb s ASP 294 N -2.24 4.75 0.19 3.42 2.15 -1.26 -4.81 116.67 118.87 1qhb s ASP 294 Ca 0.15 -0.11 -0.13 0.00 0.43 0.00 0.00 52.55 52.89 1qhb s ASP 294 Cb 0.15 -1.65 0.20 0.00 -0.30 0.00 0.00 42.92 41.33 1qhb s ASP 294 CO 0.52 0.22 1.71 0.25 -0.17 0.00 0.00 175.17 177.70 1qhb h LEU 295 N 6.35 -0.01 -0.75 -1.34 5.85 -1.94 -0.44 115.31 123.03 1qhb h LEU 295 Ca -0.35 0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.37 1qhb h LEU 295 Cb 1.19 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.33 1qhb h LEU 295 CO 0.60 0.02 -0.04 0.11 -0.34 0.00 0.00 178.44 178.79 1qhb h LYS 296 N 0.23 0.91 -0.42 1.25 1.57 -1.95 0.33 116.57 118.49 1qhb h LYS 296 Ca 0.26 -0.29 -0.06 0.00 -1.87 0.00 0.00 60.65 58.69 1qhb h LYS 296 Cb 0.35 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 1qhb h LYS 296 CO -0.34 0.93 0.04 0.28 -0.57 0.00 0.00 179.45 179.79 1qhb h VAL 297 N 0.84 1.25 -0.97 0.50 2.07 -1.84 -2.06 116.25 116.04 1qhb h VAL 297 Ca 0.15 -0.94 0.01 0.00 0.82 0.00 0.00 66.70 66.74 1qhb h VAL 297 Cb 0.55 1.04 -0.05 0.00 -1.52 0.00 0.00 31.29 31.31 1qhb h VAL 297 CO 0.03 0.32 0.64 0.15 0.02 0.00 0.00 177.57 178.73 1qhb h PHE 298 N 0.56 1.21 -0.40 1.57 3.57 -0.74 -1.49 116.94 121.23 1qhb h PHE 298 Ca 0.12 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.54 1qhb h PHE 298 Cb 0.42 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.74 1qhb h PHE 298 CO 0.03 0.75 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.59 1qhb h LEU 299 N 1.29 0.80 -0.63 0.59 3.38 -0.79 -1.50 115.31 118.45 1qhb h LEU 299 Ca 0.36 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1qhb h LEU 299 Cb -0.13 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.38 1qhb h LEU 299 CO -0.08 0.99 0.33 0.44 0.09 0.00 0.00 178.44 180.20 1qhb h ASP 300 N 0.69 0.80 -0.75 -0.43 3.32 -1.01 -0.36 116.42 118.68 1qhb h ASP 300 Ca 0.10 -0.11 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1qhb h ASP 300 Cb 0.72 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 40.03 1qhb h ASP 300 CO 0.06 0.69 0.42 0.58 -1.72 0.00 0.00 179.24 179.26 1qhb h VAL 301 N 0.86 1.22 0.00 -1.35 2.07 -0.95 -0.34 116.25 117.76 1qhb h VAL 301 Ca 0.22 -0.55 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 1qhb h VAL 301 Cb 0.08 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.07 1qhb h VAL 301 CO -0.03 0.25 -0.21 1.56 0.02 0.00 0.00 177.57 179.15 1qhb h GLN 302 N 1.03 0.00 -0.50 1.57 1.08 -0.76 -1.31 115.11 116.23 1qhb h GLN 302 Ca 0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 1qhb h GLN 302 Cb 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1qhb h GLN 302 CO -0.04 0.21 0.00 -0.25 -0.95 0.00 0.00 178.83 177.80 1qhb n ASP 303 N -3.96 2.23 0.00 1.46 8.00 -0.19 0.26 116.55 124.34 1qhb n ASP 303 Ca -0.02 -2.14 0.00 0.00 0.71 0.00 0.00 54.79 53.34 1qhb n ASP 303 Cb 0.29 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 1qhb n ASP 303 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1qhb n ALA 304 N 0.40 0.00 -1.67 2.24 0.00 -0.49 -3.85 120.51 117.13 1qhb n ALA 304 Ca 0.11 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 53.10 1qhb n ALA 304 Cb 0.41 -0.25 -0.04 0.00 0.00 0.00 0.00 19.45 19.57 1qhb n ALA 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1qhb n ALA 305 N 0.42 1.41 -2.77 0.00 0.00 -0.23 -1.96 120.51 117.39 1qhb n ALA 305 Ca 0.00 0.42 -0.43 0.00 0.00 0.00 0.00 53.44 53.43 1qhb n ALA 305 Cb 0.00 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 17.03 1qhb n ALA 305 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1qhb s ASP 306 N 1.44 6.53 -0.02 0.00 2.15 -0.28 -4.68 116.67 121.81 1qhb s ASP 306 Ca 0.81 -1.69 0.15 0.00 0.43 0.00 0.00 52.55 52.24 1qhb s ASP 306 Cb -0.66 -2.47 0.47 0.00 -0.30 0.00 0.00 42.92 39.95 1qhb s ASP 306 CO 0.39 -1.28 1.38 0.49 -0.17 0.00 0.00 175.17 175.97 1qhb n PHE 307 N 7.61 0.77 -1.73 -5.34 3.72 -1.26 -4.79 117.46 116.45 1qhb n PHE 307 Ca 0.25 -0.36 -0.42 0.00 -0.05 0.00 0.00 57.45 56.87 1qhb n PHE 307 Cb 0.50 -0.05 -0.01 0.00 -0.94 0.00 0.00 39.48 38.98 1qhb n PHE 307 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1qhb n ARG 308 N 0.93 2.42 -0.51 -1.08 1.74 -1.26 -2.46 116.66 116.45 1qhb n ARG 308 Ca 0.17 0.85 0.00 0.00 -0.77 0.00 0.00 57.85 58.11 1qhb n ARG 308 Cb 0.49 -2.53 0.00 0.00 -1.02 0.00 0.00 32.46 29.39 1qhb n ARG 308 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1qhb n GLY 309 N 1.14 0.75 0.06 -0.13 0.00 -1.26 -4.96 105.19 100.80 1qhb n GLY 309 Ca 0.05 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.21 1qhb n GLY 309 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1qhb n PHE 310 N -2.27 0.00 -1.23 1.61 7.35 -1.03 -4.92 117.46 116.98 1qhb n PHE 310 Ca 0.00 0.00 -0.31 0.00 -0.76 0.00 0.00 57.45 56.38 1qhb n PHE 310 Cb 0.00 -0.27 0.10 0.00 0.35 0.00 0.00 39.48 39.66 1qhb n PHE 310 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1qhb s GLU 311 N -2.68 2.11 0.12 -4.13 8.01 -1.26 -5.01 118.70 115.85 1qhb s GLU 311 Ca 0.23 1.28 0.09 0.00 0.01 0.00 0.00 54.97 56.57 1qhb s GLU 311 Cb 0.19 -1.87 -0.04 0.00 -4.31 0.00 0.00 34.13 28.10 1qhb s GLU 311 CO 0.52 -1.77 -0.19 -1.54 0.01 0.00 0.00 175.26 172.30 1qhb s SER 312 N -3.14 3.82 0.18 -0.19 1.04 -1.26 -5.07 113.70 109.08 1qhb s SER 312 Ca 0.63 -0.58 0.07 0.00 0.48 0.00 0.00 55.95 56.55 1qhb s SER 312 Cb -0.19 -0.51 -0.04 0.00 0.10 0.00 0.00 66.02 65.38 1qhb s SER 312 CO 0.54 0.18 -0.14 -0.31 0.98 0.00 0.00 173.24 174.50 1qhb s TYR 313 N -1.13 1.57 0.17 5.02 2.02 -1.26 -1.93 117.35 121.81 1qhb s TYR 313 Ca 0.17 -0.60 -0.07 0.00 -0.37 0.00 0.00 57.07 56.20 1qhb s TYR 313 Cb -0.10 -0.76 -0.06 0.00 -0.40 0.00 0.00 41.96 40.63 1qhb s TYR 313 CO 0.10 0.26 0.45 -1.21 -1.57 0.00 0.00 175.55 173.57 1qhb s GLU 314 N -3.43 3.71 0.73 -0.62 2.02 -0.06 -4.81 118.70 116.24 1qhb s GLU 314 Ca 0.18 0.09 -0.16 0.00 0.02 0.00 0.00 54.97 55.11 1qhb s GLU 314 Cb -0.01 -2.80 0.01 0.00 0.10 0.00 0.00 34.13 31.43 1qhb s GLU 314 CO 0.05 0.43 0.98 -2.30 0.02 0.00 0.00 175.26 174.43 1qhb n PRO 315 N 0.13 0.49 0.00 0.39 -0.02 -1.26 -4.38 135.00 130.35 1qhb n PRO 315 Ca -0.02 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 1qhb n PRO 315 Cb 0.52 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 1qhb n PRO 315 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qhb n GLY 316 N 1.07 -0.90 3.51 -1.23 0.00 -1.26 -4.90 105.19 101.48 1qhb n GLY 316 Ca 0.13 -1.46 -0.11 0.00 0.00 0.00 0.00 46.02 44.59 1qhb n GLY 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1qhb s ALA 317 N -1.36 -1.82 0.08 4.61 0.00 -1.26 -4.34 121.76 117.67 1qhb s ALA 317 Ca 0.00 1.13 -0.10 0.00 0.00 0.00 0.00 51.96 52.99 1qhb s ALA 317 Cb 0.00 0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.27 1qhb s ALA 317 CO 0.00 -0.57 0.23 -0.98 0.00 0.00 0.00 175.76 174.44 1qhb s ARG 318 N -2.47 0.85 0.61 0.00 1.70 -0.70 -4.82 118.95 114.12 1qhb s ARG 318 Ca 0.01 -0.84 -0.18 0.00 -0.47 0.00 0.00 55.73 54.25 1qhb s ARG 318 Cb -0.01 0.35 -0.05 0.00 -0.57 0.00 0.00 34.95 34.68 1qhb s ARG 318 CO -0.05 -0.28 0.96 1.28 -1.08 0.00 0.00 175.30 176.14 1qhb n LEU 319 N 0.07 3.74 -4.68 -1.89 4.77 -1.26 -0.81 117.00 116.94 1qhb n LEU 319 Ca -0.16 0.80 -0.46 0.00 -0.03 0.00 0.00 56.01 56.16 1qhb n LEU 319 Cb 0.62 -1.39 -0.04 0.00 -2.33 0.00 0.00 43.42 40.28 1qhb n LEU 319 CO 0.21 -1.87 1.29 -0.38 -1.33 0.00 0.00 177.39 175.32 1qhb n ILE 320 N -1.77 0.17 -0.03 -0.08 5.41 -1.26 -4.83 119.36 116.96 1qhb n ILE 320 Ca 0.14 -0.03 -0.07 0.00 1.00 0.00 0.00 62.75 63.79 1qhb n ILE 320 Cb 0.47 -1.68 -0.02 0.00 -0.71 0.00 0.00 39.64 37.70 1qhb n ILE 320 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1qhb n ARG 321 N 4.37 0.14 -4.15 0.38 0.63 -1.26 -4.88 116.66 111.90 1qhb n ARG 321 Ca 0.18 0.06 -0.27 0.00 -0.92 0.00 0.00 57.85 56.91 1qhb n ARG 321 Cb 0.30 -0.74 -0.05 0.00 0.45 0.00 0.00 32.46 32.42 1qhb n ARG 321 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1qhb s THR 322 N -2.12 1.88 0.24 5.15 -4.23 -1.26 -1.28 115.64 114.02 1qhb s THR 322 Ca -0.09 -1.67 -0.06 0.00 -1.18 0.00 0.00 61.69 58.68 1qhb s THR 322 Cb 0.04 -2.56 0.24 0.00 1.34 0.00 0.00 72.50 71.56 1qhb s THR 322 CO 0.12 0.00 1.90 0.40 -0.54 0.00 0.00 174.62 176.50 1qhb h ILE 323 N 1.17 1.26 -0.54 2.99 2.04 -1.29 -0.73 117.51 122.41 1qhb h ILE 323 Ca -0.41 -0.53 -0.01 0.00 1.00 0.00 0.00 64.86 64.91 1qhb h ILE 323 Cb 1.28 -0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1qhb h ILE 323 CO 0.66 0.26 0.30 -0.09 0.00 0.00 0.00 178.15 179.28 1qhb h ARG 324 N 1.32 0.73 -0.54 2.37 2.43 -1.24 -1.86 114.38 117.58 1qhb h ARG 324 Ca 0.35 -0.07 -0.05 0.00 -0.81 0.00 0.00 59.98 59.40 1qhb h ARG 324 Cb -0.09 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.28 1qhb h ARG 324 CO -0.07 0.53 0.13 -0.44 -1.51 0.00 0.00 179.97 178.62 1qhb h ASP 325 N 0.74 0.83 -0.49 -3.80 3.32 -1.41 0.29 116.42 115.90 1qhb h ASP 325 Ca 0.19 -0.23 -0.02 0.00 0.02 0.00 0.00 57.03 56.99 1qhb h ASP 325 Cb 0.01 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 1qhb h ASP 325 CO -0.03 0.84 0.24 0.25 -1.72 0.00 0.00 179.24 178.82 1qhb h LEU 326 N 0.77 0.64 -0.51 1.55 5.85 -1.19 -1.27 115.31 121.15 1qhb h LEU 326 Ca 0.17 -0.12 0.07 0.00 0.84 0.00 0.00 57.88 58.84 1qhb h LEU 326 Cb 0.34 -0.16 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 1qhb h LEU 326 CO 0.00 0.58 0.17 0.00 -0.34 0.00 0.00 178.44 178.86 1qhb h ALA 327 N 1.08 0.62 -0.41 1.25 0.00 -1.09 -0.58 119.26 120.13 1qhb h ALA 327 Ca 0.17 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1qhb h ALA 327 Cb 0.11 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1qhb h ALA 327 CO -0.02 -0.22 0.23 1.15 0.00 0.00 0.00 179.25 180.39 1qhb h THR 328 N 0.35 1.12 -0.57 0.00 2.02 -0.70 -2.10 112.91 113.04 1qhb h THR 328 Ca 0.25 -0.30 -0.06 0.00 0.77 0.00 0.00 66.41 67.07 1qhb h THR 328 Cb 0.27 0.57 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1qhb h THR 328 CO -0.26 0.13 0.13 -0.25 0.37 0.00 0.00 175.52 175.64 1qhb h TRP 329 N 0.56 0.97 -0.07 3.16 7.01 0.10 -2.71 115.95 124.96 1qhb h TRP 329 Ca 0.15 -0.12 0.00 0.00 2.11 0.00 0.00 58.89 61.03 1qhb h TRP 329 Cb 0.00 -0.27 0.00 0.00 -2.10 0.00 0.00 29.16 26.79 1qhb h TRP 329 CO 0.00 0.84 0.00 1.33 -2.79 0.00 0.00 178.44 177.82 1qhb n VAL 330 N -4.37 0.09 0.06 2.65 0.24 -0.93 -2.98 118.33 113.08 1qhb n VAL 330 Ca 0.03 -0.19 -0.17 0.00 -2.04 0.00 0.00 64.34 61.97 1qhb n VAL 330 Cb 0.24 0.10 -0.08 0.00 -1.47 0.00 0.00 33.84 32.63 1qhb n VAL 330 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 1qhb h HIS 331 N 1.33 0.84 0.00 6.34 6.17 -1.04 -3.39 115.15 125.40 1qhb h HIS 331 Ca 0.00 -0.46 0.00 0.00 0.71 0.00 0.00 60.37 60.62 1qhb h HIS 331 Cb 0.29 -0.09 0.00 0.00 2.52 0.00 0.00 27.41 30.13 1qhb h HIS 331 CO 0.04 1.29 0.00 1.19 0.71 0.00 0.00 177.93 181.17 1qhb n PHE 332 N -3.80 0.00 -1.74 5.26 3.72 -1.24 -5.07 117.46 114.59 1qhb n PHE 332 Ca -0.09 -0.03 -0.41 0.00 -0.05 0.00 0.00 57.45 56.88 1qhb n PHE 332 Cb 0.87 -0.00 0.01 0.00 -0.94 0.00 0.00 39.48 39.42 1qhb n PHE 332 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1qhb n ASP 333 N -0.03 3.16 -4.76 4.37 5.75 -1.16 -4.94 116.55 118.95 1qhb n ASP 333 Ca 0.00 1.15 -0.38 0.00 -0.01 0.00 0.00 54.79 55.55 1qhb n ASP 333 Cb 0.05 -1.57 0.02 0.00 -1.03 0.00 0.00 41.12 38.59 1qhb n ASP 333 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1qhb s SER 334 N -0.40 5.78 0.45 -1.12 0.15 -1.26 -4.92 113.70 112.39 1qhb s SER 334 Ca 0.59 2.63 0.11 0.00 0.70 0.00 0.00 55.95 59.98 1qhb s SER 334 Cb -0.48 -2.63 1.02 0.00 -1.71 0.00 0.00 66.02 62.22 1qhb s SER 334 CO 0.59 -1.21 2.09 -0.07 1.20 0.00 0.00 173.24 175.84 1qhb h LEU 335 N 1.94 0.26 -2.01 3.45 4.07 -1.99 -1.67 115.31 119.36 1qhb h LEU 335 Ca -0.50 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.45 1qhb h LEU 335 Cb 1.27 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 42.95 1qhb h LEU 335 CO 0.59 0.20 0.00 0.00 -1.08 0.00 0.00 178.44 178.16 1qhb n TYR 336 N -4.49 0.54 -0.09 1.13 0.18 -1.26 -4.64 117.16 108.53 1qhb n TYR 336 Ca 0.00 -0.27 -0.08 0.00 1.88 0.00 0.00 57.90 59.44 1qhb n TYR 336 Cb 0.09 0.00 -0.01 0.00 -0.38 0.00 0.00 39.34 39.03 1qhb n TYR 336 CO 0.00 0.00 0.00 1.49 -2.08 0.00 0.00 176.86 176.27 1qhb h GLU 337 N 3.65 -0.24 -0.86 -3.48 4.81 -1.67 -0.58 114.58 116.22 1qhb h GLU 337 Ca 0.00 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.34 1qhb h GLU 337 Cb 0.81 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 30.17 1qhb h GLU 337 CO 0.00 -0.16 0.50 0.00 -0.73 0.00 0.00 179.01 178.62 1qhb h ALA 338 N 0.79 1.24 0.03 2.92 0.00 -1.82 -1.03 119.26 121.39 1qhb h ALA 338 Ca 0.16 0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.88 1qhb h ALA 338 Cb 0.51 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1qhb h ALA 338 CO -0.48 0.13 -1.01 1.88 0.00 0.00 0.00 179.25 179.77 1qhb h TYR 339 N 0.84 0.18 -0.39 0.00 0.05 -1.76 -1.65 116.97 114.25 1qhb h TYR 339 Ca 0.41 -0.12 -0.14 0.00 0.05 0.00 0.00 58.73 58.93 1qhb h TYR 339 Cb 0.37 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.09 1qhb h TYR 339 CO -0.05 1.04 -0.32 1.25 -1.05 0.00 0.00 178.16 179.03 1qhb h LEU 340 N 0.04 0.95 -0.99 3.88 5.85 -0.96 0.60 115.31 124.69 1qhb h LEU 340 Ca -0.05 -0.45 -0.07 0.00 0.84 0.00 0.00 57.88 58.16 1qhb h LEU 340 Cb 1.72 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.46 1qhb h LEU 340 CO 0.15 1.20 0.01 0.78 -0.34 0.00 0.00 178.44 180.24 1qhb h ASN 341 N 0.71 0.70 -0.41 1.25 -0.26 -1.11 -0.44 115.58 116.02 1qhb h ASN 341 Ca 0.07 -0.16 -0.08 0.00 -0.56 0.00 0.00 56.30 55.57 1qhb h ASN 341 Cb 0.91 -0.19 -0.01 0.00 -1.06 0.00 0.00 38.32 37.97 1qhb h ASN 341 CO 0.08 0.77 -0.05 0.00 -1.06 0.00 0.00 177.43 177.17 1qhb h ALA 342 N 1.32 0.56 -0.49 -0.83 0.00 -1.07 -1.58 119.26 117.16 1qhb h ALA 342 Ca 0.14 -0.29 0.06 0.00 0.00 0.00 0.00 54.91 54.81 1qhb h ALA 342 Cb 0.42 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 18.01 1qhb h ALA 342 CO 0.02 0.40 0.21 0.00 0.00 0.00 0.00 179.25 179.88 1qhb h LEU 344 N 0.42 0.86 -0.08 0.00 3.38 -0.61 -0.33 115.31 118.96 1qhb h LEU 344 Ca 0.23 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1qhb h LEU 344 Cb 0.19 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 1qhb h LEU 344 CO -0.20 0.65 -0.01 0.40 0.09 0.00 0.00 178.44 179.36 1qhb h ILE 345 N 1.01 1.28 -0.57 1.22 2.04 -0.84 -1.04 117.51 120.61 1qhb h ILE 345 Ca 0.27 -0.90 0.04 0.00 1.00 0.00 0.00 64.86 65.27 1qhb h ILE 345 Cb -0.08 1.73 -0.04 0.00 -0.74 0.00 0.00 36.82 37.69 1qhb h ILE 345 CO -0.05 0.25 0.32 -0.07 0.00 0.00 0.00 178.15 178.60 1qhb h LEU 346 N -0.18 0.49 -0.42 1.44 3.38 -0.98 0.20 115.31 119.24 1qhb h LEU 346 Ca 0.02 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 1qhb h LEU 346 Cb 0.40 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1qhb h LEU 346 CO 0.01 0.33 0.06 -0.07 0.09 0.00 0.00 178.44 178.86 1qhb h LEU 347 N 0.62 0.68 -0.93 1.67 3.38 -0.87 -2.54 115.31 117.31 1qhb h LEU 347 Ca 0.25 -0.26 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1qhb h LEU 347 Cb 0.11 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1qhb h LEU 347 CO -0.14 0.77 -0.13 0.00 0.09 0.00 0.00 178.44 179.03 1qhb h ALA 348 N 0.93 1.10 0.00 1.53 0.00 -0.91 -2.65 119.26 119.27 1qhb h ALA 348 Ca 0.13 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1qhb h ALA 348 Cb 0.38 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1qhb h ALA 348 CO 0.01 0.56 0.00 0.09 0.00 0.00 0.00 179.25 179.91 1qhb n ASN 349 N -4.17 0.00 -0.14 0.00 3.02 0.69 -4.53 115.26 110.12 1qhb n ASN 349 Ca 0.01 0.21 -0.02 0.00 -0.03 0.00 0.00 54.58 54.75 1qhb n ASN 349 Cb 0.35 -0.40 -0.01 0.00 -0.61 0.00 0.00 39.78 39.12 1qhb n ASN 349 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1qhb n GLY 350 N 1.08 0.51 3.74 7.41 0.00 -1.00 -4.99 105.19 111.94 1qhb n GLY 350 Ca 0.09 -1.00 -0.39 0.00 0.00 0.00 0.00 46.02 44.73 1qhb n GLY 350 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1qhb n VAL 351 N -3.00 3.30 -2.13 1.61 0.31 -0.99 -4.94 118.33 112.49 1qhb n VAL 351 Ca -0.02 -0.50 -0.33 0.00 -0.01 0.00 0.00 64.34 63.48 1qhb n VAL 351 Cb 0.08 -1.71 0.00 0.00 -0.91 0.00 0.00 33.84 31.31 1qhb n VAL 351 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1qhb s PRO 352 N -2.64 3.41 0.74 5.55 0.05 -1.26 -4.85 135.00 136.00 1qhb s PRO 352 Ca 0.67 1.22 -0.11 0.00 0.05 0.00 0.00 61.00 62.82 1qhb s PRO 352 Cb -0.44 -2.04 0.04 0.00 0.05 0.00 0.00 34.50 32.11 1qhb s PRO 352 CO 0.53 -0.74 1.12 -0.06 0.05 0.00 0.00 177.00 177.91 1qhb s PHE 353 N -2.39 3.17 0.09 0.56 0.08 -1.26 -0.97 117.98 117.27 1qhb s PHE 353 Ca 0.64 0.92 -0.35 0.00 0.12 0.00 0.00 56.93 58.25 1qhb s PHE 353 Cb -0.16 -3.23 -0.15 0.00 -0.57 0.00 0.00 43.02 38.91 1qhb s PHE 353 CO 0.34 -1.41 1.50 -3.47 -0.10 0.00 0.00 175.22 172.08 1qhb n ASP 354 N -3.12 2.45 0.07 1.36 -0.08 0.14 -3.77 116.55 113.60 1qhb n ASP 354 Ca 0.07 1.09 0.09 0.00 -1.51 0.00 0.00 54.79 54.54 1qhb n ASP 354 Cb 0.59 -1.31 0.40 0.00 2.34 0.00 0.00 41.12 43.14 1qhb n ASP 354 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1qhb n PRO 355 N 3.34 0.10 -0.01 -0.67 -0.04 -1.26 -2.10 135.00 134.36 1qhb n PRO 355 Ca 0.18 0.35 0.14 0.00 -0.04 0.00 0.00 63.50 64.13 1qhb n PRO 355 Cb 0.24 -1.69 0.66 0.00 -0.04 0.00 0.00 33.50 32.66 1qhb n PRO 355 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1qhb n ASN 356 N -1.88 0.79 -4.85 3.54 3.02 -1.26 -4.82 115.26 109.79 1qhb n ASN 356 Ca 0.03 -1.34 -0.31 0.00 -0.03 0.00 0.00 54.58 52.92 1qhb n ASN 356 Cb 0.19 -0.02 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1qhb n ASN 356 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1qhb s LEU 357 N -1.88 3.34 0.72 3.41 1.43 -0.89 -3.16 118.68 121.64 1qhb s LEU 357 Ca 0.39 1.52 -0.13 0.00 -1.03 0.00 0.00 54.13 54.88 1qhb s LEU 357 Cb 0.20 -4.49 0.03 0.00 0.03 0.00 0.00 46.19 41.96 1qhb s LEU 357 CO 0.32 -0.91 1.10 -2.84 0.23 0.00 0.00 176.35 174.26 1qhb s PRO 358 N -4.79 2.48 -1.51 1.29 0.02 -1.26 -4.06 135.00 127.17 1qhb s PRO 358 Ca 0.57 1.30 -0.13 0.00 0.02 0.00 0.00 61.00 62.76 1qhb s PRO 358 Cb -0.12 -1.92 0.08 0.00 0.02 0.00 0.00 34.50 32.56 1qhb s PRO 358 CO 0.47 -1.48 1.01 1.19 -0.33 0.00 0.00 177.00 177.86 1qhb n PHE 359 N -2.99 -2.38 1.14 6.54 3.72 -1.26 -4.90 117.46 117.32 1qhb n PHE 359 Ca 0.10 0.92 0.13 0.00 -0.05 0.00 0.00 57.45 58.55 1qhb n PHE 359 Cb 0.52 -4.13 0.24 0.00 -0.94 0.00 0.00 39.48 35.18 1qhb n PHE 359 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 1qhb n GLN 360 N -4.73 2.11 -1.68 -1.08 1.13 -1.26 -4.73 117.38 107.15 1qhb n GLN 360 Ca 0.04 -1.62 -0.30 0.00 -1.94 0.00 0.00 57.00 53.18 1qhb n GLN 360 Cb 0.53 -1.47 0.20 0.00 0.11 0.00 0.00 30.24 29.61 1qhb n GLN 360 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1qhb s GLN 361 N -1.98 0.11 0.56 -1.09 -0.21 -1.26 -4.99 119.66 110.80 1qhb s GLN 361 Ca 0.32 -0.29 -0.20 0.00 0.02 0.00 0.00 55.36 55.20 1qhb s GLN 361 Cb 0.20 -1.77 -0.04 0.00 1.00 0.00 0.00 33.01 32.40 1qhb s GLN 361 CO 0.31 -2.79 1.26 -1.21 -2.12 0.00 0.00 175.29 170.74 1qhb s GLU 362 N -5.74 3.10 0.51 2.91 2.02 -1.26 -4.82 118.70 115.42 1qhb s GLU 362 Ca 0.73 1.97 0.21 0.00 0.02 0.00 0.00 54.97 57.90 1qhb s GLU 362 Cb -0.06 -2.09 1.31 0.00 0.10 0.00 0.00 34.13 33.39 1qhb s GLU 362 CO 0.54 -1.15 2.04 -0.44 0.02 0.00 0.00 175.26 176.27 1qhb h ASP 363 N 1.20 0.05 0.30 -0.19 3.32 -1.94 0.40 116.42 119.57 1qhb h ASP 363 Ca -0.50 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.52 1qhb h ASP 363 Cb 1.30 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 40.83 1qhb h ASP 363 CO 0.56 0.03 -0.13 0.07 -1.72 0.00 0.00 179.24 178.06 1qhb h LYS 364 N 0.06 0.00 0.05 3.56 2.10 -1.98 0.45 116.57 120.81 1qhb h LYS 364 Ca 0.18 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.50 1qhb h LYS 364 Cb 0.63 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 31.92 1qhb h LYS 364 CO -0.01 0.13 -1.85 1.28 -2.00 0.00 0.00 179.45 177.00 1qhb n LEU 365 N -3.80 1.60 -0.00 7.07 4.77 0.11 -4.60 117.00 122.15 1qhb n LEU 365 Ca -0.02 0.32 0.00 0.00 -0.03 0.00 0.00 56.01 56.28 1qhb n LEU 365 Cb 0.23 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1qhb n LEU 365 CO 0.31 0.59 0.28 -0.90 -1.33 0.00 0.00 177.39 176.34 1qhb n ASP 366 N -3.22 1.12 -2.50 -1.43 5.68 -1.05 -5.02 116.55 110.13 1qhb n ASP 366 Ca -0.24 -1.12 -0.10 0.00 -0.50 0.00 0.00 54.79 52.83 1qhb n ASP 366 Cb 1.05 -0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 41.03 1qhb n ASP 366 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1qhb n ASN 367 N -0.05 -3.27 -3.61 -1.12 3.02 0.16 -4.94 115.26 105.44 1qhb n ASN 367 Ca 0.00 0.23 -0.15 0.00 -0.03 0.00 0.00 54.58 54.63 1qhb n ASN 367 Cb 0.03 -2.81 -0.13 0.00 -0.61 0.00 0.00 39.78 36.26 1qhb n ASN 367 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1qhb s GLN 368 N -5.07 0.15 0.66 3.52 2.00 -1.26 -5.09 119.66 114.57 1qhb s GLN 368 Ca 0.02 0.61 -0.03 0.00 -2.00 0.00 0.00 55.36 53.96 1qhb s GLN 368 Cb -0.01 -0.32 0.07 0.00 0.80 0.00 0.00 33.01 33.55 1qhb s GLN 368 CO 0.03 -0.38 0.93 0.34 -0.50 0.00 0.00 175.29 175.70 1qhb s ASP 369 N 2.39 4.83 0.10 6.67 -1.08 -1.26 -4.85 116.67 123.47 1qhb s ASP 369 Ca 0.03 0.10 0.09 0.00 -0.52 0.00 0.00 52.55 52.24 1qhb s ASP 369 Cb -0.13 -0.76 -0.04 0.00 -1.46 0.00 0.00 42.92 40.54 1qhb s ASP 369 CO -0.09 -1.52 -0.22 0.68 0.52 0.00 0.00 175.17 174.53 1qhb s VAL 370 N -3.06 1.83 0.00 1.11 -7.23 -1.26 -5.02 120.40 106.77 1qhb s VAL 370 Ca 0.61 -1.57 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 1qhb s VAL 370 Cb -0.09 -1.65 0.00 0.00 0.56 0.00 0.00 36.38 35.20 1qhb s VAL 370 CO 0.42 -0.01 0.00 0.33 -0.31 0.00 0.00 175.10 175.53 1qhb n PHE 371 N 1.09 -0.63 0.23 2.82 7.35 -1.26 -4.50 117.46 122.57 1qhb n PHE 371 Ca -0.19 0.00 -0.17 0.00 -0.76 0.00 0.00 57.45 56.33 1qhb n PHE 371 Cb 0.53 0.13 -0.09 0.00 0.35 0.00 0.00 39.48 40.40 1qhb n PHE 371 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1qhb h VAL 372 N 0.00 0.09 -3.38 -2.13 2.07 -1.94 -2.29 116.25 108.68 1qhb h VAL 372 Ca 0.00 0.00 -0.68 0.00 0.82 0.00 0.00 66.70 66.84 1qhb h VAL 372 Cb 0.00 0.09 -0.15 0.00 -1.52 0.00 0.00 31.29 29.71 1qhb h VAL 372 CO 0.00 0.00 -0.64 0.20 0.02 0.00 0.00 177.57 177.15 1qhb s ASN 373 N -4.50 5.13 0.00 0.57 0.01 -1.26 -3.08 114.94 111.81 1qhb s ASN 373 Ca -0.17 0.08 0.00 0.00 -0.71 0.00 0.00 52.86 52.06 1qhb s ASN 373 Cb 0.05 -1.40 0.00 0.00 0.41 0.00 0.00 41.25 40.32 1qhb s ASN 373 CO 0.62 0.35 0.00 0.49 -1.51 0.00 0.00 177.10 177.05 1qhb n PHE 374 N 1.95 0.00 -3.57 2.20 3.72 -1.26 -4.81 117.46 115.69 1qhb n PHE 374 Ca -0.17 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.23 1qhb n PHE 374 Cb 0.53 -1.62 0.00 0.00 -0.94 0.00 0.00 39.48 37.45 1qhb n PHE 374 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1qhb n GLY 375 N 0.02 5.71 0.33 1.37 0.00 -1.19 -4.73 105.19 106.70 1qhb n GLY 375 Ca 0.00 -2.11 -0.07 0.00 0.00 0.00 0.00 46.02 43.84 1qhb n GLY 375 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1qhb h SER 376 N 0.00 1.09 -0.24 1.61 4.64 -1.78 -2.50 113.55 116.36 1qhb h SER 376 Ca 0.00 -0.22 -0.07 0.00 -0.47 0.00 0.00 61.79 61.02 1qhb h SER 376 Cb 0.00 -0.29 -0.02 0.00 -0.31 0.00 0.00 62.40 61.79 1qhb h SER 376 CO 0.00 1.02 -0.08 0.00 -0.87 0.00 0.00 176.83 176.91 1qhb h ALA 377 N 1.10 1.18 0.31 5.18 0.00 -1.71 -1.65 119.26 123.67 1qhb h ALA 377 Ca 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1qhb h ALA 377 Cb 0.35 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1qhb h ALA 377 CO -0.00 0.52 -0.15 1.25 0.00 0.00 0.00 179.25 180.88 1qhb h HIS 378 N 0.57 -0.38 -0.14 0.00 6.17 -1.07 -2.40 115.15 117.89 1qhb h HIS 378 Ca 0.11 -0.01 -0.06 0.00 0.71 0.00 0.00 60.37 61.12 1qhb h HIS 378 Cb 0.48 0.13 -0.01 0.00 2.52 0.00 0.00 27.41 30.53 1qhb h HIS 378 CO 0.02 -0.13 -0.16 -0.24 0.71 0.00 0.00 177.93 178.13 1qhb h VAL 379 N -0.59 1.19 -0.20 5.26 3.04 -1.41 -1.78 116.25 121.76 1qhb h VAL 379 Ca -0.04 -0.87 -0.08 0.00 -1.01 0.00 0.00 66.70 64.70 1qhb h VAL 379 Cb 0.43 1.27 -0.01 0.00 -2.01 0.00 0.00 31.29 30.96 1qhb h VAL 379 CO 0.07 0.27 -0.25 -0.07 -1.01 0.00 0.00 177.57 176.58 1qhb h LEU 380 N 0.22 0.36 0.17 3.16 3.38 -1.20 -0.94 115.31 120.46 1qhb h LEU 380 Ca 0.04 -0.12 -0.31 0.00 0.09 0.00 0.00 57.88 57.59 1qhb h LEU 380 Cb 0.42 -0.10 0.01 0.00 0.09 0.00 0.00 40.66 41.09 1qhb h LEU 380 CO 0.03 0.62 -1.41 0.28 0.09 0.00 0.00 178.44 178.04 1qhb h SER 381 N 0.33 0.56 0.18 -0.43 0.02 -1.07 -3.35 113.55 109.78 1qhb h SER 381 Ca 0.05 -0.64 -0.11 0.00 -0.84 0.00 0.00 61.79 60.25 1qhb h SER 381 Cb 0.62 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 1qhb h SER 381 CO 0.04 1.51 -0.41 0.25 -1.14 0.00 0.00 176.83 177.09 1qhb h LEU 382 N 0.10 0.32 -1.27 5.07 5.85 -1.25 -0.47 115.31 123.66 1qhb h LEU 382 Ca -0.21 -0.13 -0.08 0.00 0.84 0.00 0.00 57.88 58.30 1qhb h LEU 382 Cb 2.05 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.98 1qhb h LEU 382 CO 0.21 0.70 -0.36 1.62 -0.34 0.00 0.00 178.44 180.27 1qhb h VAL 383 N 0.25 1.26 0.00 1.05 3.04 -1.31 -3.08 116.25 117.46 1qhb h VAL 383 Ca 0.02 -1.25 -0.31 0.00 -1.01 0.00 0.00 66.70 64.15 1qhb h VAL 383 Cb 0.83 1.68 -0.05 0.00 -2.01 0.00 0.00 31.29 31.73 1qhb h VAL 383 CO 0.07 0.36 -1.89 0.35 -1.01 0.00 0.00 177.57 175.45 1qhb n THR 384 N -4.10 1.57 0.18 3.17 -2.24 -1.05 -4.22 114.28 107.59 1qhb n THR 384 Ca -0.02 -0.80 0.02 0.00 -2.27 0.00 0.00 64.05 60.98 1qhb n THR 384 Cb 0.40 -0.94 0.34 0.00 -2.10 0.00 0.00 70.33 68.03 1qhb n THR 384 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1qhb h GLU 385 N 0.00 0.02 0.00 -0.78 4.11 -1.07 -3.08 114.58 113.78 1qhb h GLU 385 Ca -0.36 -0.01 -0.06 0.00 0.07 0.00 0.00 59.36 59.01 1qhb h GLU 385 Cb 2.07 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.31 1qhb h GLU 385 CO 0.07 0.40 -0.27 -0.39 0.07 0.00 0.00 179.01 178.89 1qhb h VAL 386 N 0.02 0.83 -0.57 -1.06 -1.51 -1.71 -3.31 116.25 108.93 1qhb h VAL 386 Ca -0.00 -1.07 0.09 0.00 -1.23 0.00 0.00 66.70 64.49 1qhb h VAL 386 Cb 0.68 1.65 -0.07 0.00 -2.13 0.00 0.00 31.29 31.42 1qhb h VAL 386 CO 0.05 0.26 0.18 0.00 -1.23 0.00 0.00 177.57 176.83 1qhb h ALA 387 N 1.73 0.71 0.00 5.19 0.00 -1.76 -1.71 119.26 123.43 1qhb h ALA 387 Ca -0.00 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 1qhb h ALA 387 Cb 0.62 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1qhb h ALA 387 CO 0.03 -0.24 -0.36 1.79 0.00 0.00 0.00 179.25 180.48 1qhb h THR 388 N 0.34 0.87 -0.41 0.00 1.35 -1.79 -1.92 112.91 111.35 1qhb h THR 388 Ca 0.29 -1.45 -0.14 0.00 -0.55 0.00 0.00 66.41 64.56 1qhb h THR 388 Cb 0.37 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.67 1qhb h THR 388 CO -0.32 0.35 -0.28 0.03 -0.25 0.00 0.00 175.52 175.05 1qhb h ARG 389 N 0.00 0.89 -0.36 4.72 -0.00 -1.63 -2.17 114.38 115.82 1qhb h ARG 389 Ca -0.00 -0.40 -0.07 0.00 -0.50 0.00 0.00 59.98 59.00 1qhb h ARG 389 Cb 0.86 -0.02 -0.01 0.00 0.00 0.00 0.00 29.97 30.80 1qhb h ARG 389 CO 0.05 1.05 -0.06 0.00 0.00 0.00 0.00 179.97 181.01 1qhb h ALA 390 N 0.92 0.49 -0.64 0.04 0.00 -1.12 -3.05 119.26 115.90 1qhb h ALA 390 Ca 0.09 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 1qhb h ALA 390 Cb 0.84 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 1qhb h ALA 390 CO 0.07 0.32 0.24 -0.07 0.00 0.00 0.00 179.25 179.81 1qhb h LEU 391 N 0.48 0.86 -0.61 0.00 3.38 -1.28 -1.68 115.31 116.46 1qhb h LEU 391 Ca 0.10 -0.12 -0.06 0.00 0.09 0.00 0.00 57.88 57.88 1qhb h LEU 391 Cb 0.55 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 1qhb h LEU 391 CO 0.03 0.78 0.15 0.11 0.09 0.00 0.00 178.44 179.60 1qhb h LYS 392 N 0.92 0.98 -0.60 1.13 1.57 -1.29 0.06 116.57 119.34 1qhb h LYS 392 Ca 0.21 -0.23 -0.04 0.00 -1.87 0.00 0.00 60.65 58.72 1qhb h LYS 392 Cb 0.19 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.35 1qhb h LYS 392 CO -0.02 0.89 0.23 0.00 -0.57 0.00 0.00 179.45 179.98 1qhb h ALA 393 N 1.04 0.78 0.00 3.86 0.00 -1.34 -2.62 119.26 120.98 1qhb h ALA 393 Ca 0.19 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1qhb h ALA 393 Cb 0.35 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1qhb h ALA 393 CO 0.00 0.40 -0.31 -0.24 0.00 0.00 0.00 179.25 179.10 1qhb h VAL 394 N 0.83 0.71 -0.38 0.00 3.04 -1.09 -2.74 116.25 116.62 1qhb h VAL 394 Ca 0.20 -1.39 -0.12 0.00 -1.01 0.00 0.00 66.70 64.38 1qhb h VAL 394 Cb 0.22 1.90 -0.01 0.00 -2.01 0.00 0.00 31.29 31.39 1qhb h VAL 394 CO -0.01 0.30 -0.23 0.03 -1.01 0.00 0.00 177.57 176.65 1qhb h ARG 395 N 0.00 0.82 -0.41 4.17 2.47 -0.75 0.22 114.38 120.90 1qhb h ARG 395 Ca -0.00 -0.38 0.06 0.00 -1.26 0.00 0.00 59.98 58.40 1qhb h ARG 395 Cb 0.87 -0.01 -0.05 0.00 -1.65 0.00 0.00 29.97 29.13 1qhb h ARG 395 CO 0.04 1.01 0.11 -0.92 0.56 0.00 0.00 179.97 180.77 1qhb h TYR 396 N 0.62 0.19 0.03 3.04 3.20 -1.30 0.10 116.97 122.86 1qhb h TYR 396 Ca 0.08 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1qhb h TYR 396 Cb 0.79 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 39.04 1qhb h TYR 396 CO 0.06 0.05 -0.01 1.96 -1.64 0.00 0.00 178.16 178.58 1qhb h GLN 397 N 0.25 -0.04 0.17 1.82 1.08 -1.23 -1.73 115.11 115.44 1qhb h GLN 397 Ca 0.20 0.00 0.01 0.00 -1.45 0.00 0.00 58.65 57.41 1qhb h GLN 397 Cb 0.21 0.01 -0.04 0.00 -0.05 0.00 0.00 27.48 27.61 1qhb h GLN 397 CO -0.23 0.10 -0.47 0.87 -0.95 0.00 0.00 178.83 178.15 1qhb h LYS 398 N -0.18 -0.72 0.02 1.46 1.57 -0.21 -0.93 116.57 117.58 1qhb h LYS 398 Ca -0.00 0.05 -0.37 0.00 -1.87 0.00 0.00 60.65 58.45 1qhb h LYS 398 Cb 0.16 0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.58 1qhb h LYS 398 CO 0.01 -0.48 -2.09 1.19 -0.57 0.00 0.00 179.45 177.51 1qhb n PHE 399 N -5.49 0.49 0.13 -1.35 3.72 -0.01 -1.74 117.46 113.22 1qhb n PHE 399 Ca -0.08 0.17 0.01 0.00 -0.05 0.00 0.00 57.45 57.49 1qhb n PHE 399 Cb 0.41 -1.05 0.10 0.00 -0.94 0.00 0.00 39.48 37.99 1qhb n PHE 399 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1qhb h ASN 400 N -0.64 0.00 0.00 4.37 4.21 -1.47 -3.41 115.58 118.64 1qhb h ASN 400 Ca -0.54 0.00 0.00 0.00 1.21 0.00 0.00 56.30 56.97 1qhb h ASN 400 Cb 1.65 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.85 1qhb h ASN 400 CO -0.22 0.60 -0.18 -0.38 -1.29 0.00 0.00 177.43 175.96 1qhb n ILE 401 N -3.42 0.54 -0.01 2.81 2.08 -0.76 -4.96 119.36 115.65 1qhb n ILE 401 Ca 0.00 0.25 -0.16 0.00 0.56 0.00 0.00 62.75 63.41 1qhb n ILE 401 Cb 0.70 -1.50 -0.14 0.00 -0.75 0.00 0.00 39.64 37.95 1qhb n ILE 401 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 1qhb n HIS 402 N -3.07 1.16 -4.30 1.39 8.25 -0.36 -4.83 115.22 113.45 1qhb n HIS 402 Ca -0.02 0.31 -0.35 0.00 -0.26 0.00 0.00 57.72 57.39 1qhb n HIS 402 Cb 0.09 -1.18 -0.06 0.00 1.12 0.00 0.00 29.99 29.97 1qhb n HIS 402 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1qhb n ARG 403 N -3.28 -1.93 -2.38 -0.41 1.74 -0.71 -4.91 116.66 104.78 1qhb n ARG 403 Ca -0.25 0.24 -0.41 0.00 -0.77 0.00 0.00 57.85 56.66 1qhb n ARG 403 Cb 1.05 -4.55 -0.03 0.00 -1.02 0.00 0.00 32.46 27.90 1qhb n ARG 403 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1qhb s ARG 404 N -7.07 4.51 0.43 5.56 3.52 -1.26 -1.11 118.95 123.53 1qhb s ARG 404 Ca 0.49 1.88 -0.25 0.00 -0.13 0.00 0.00 55.73 57.71 1qhb s ARG 404 Cb -0.28 -3.23 -0.08 0.00 -1.56 0.00 0.00 34.95 29.80 1qhb s ARG 404 CO 0.97 -0.05 1.32 -0.48 -0.81 0.00 0.00 175.30 176.25 1qhb s LEU 405 N -0.47 4.15 0.78 -0.88 2.34 -1.20 -1.45 118.68 121.95 1qhb s LEU 405 Ca 0.51 2.69 -0.11 0.00 0.06 0.00 0.00 54.13 57.28 1qhb s LEU 405 Cb -0.33 -3.97 0.06 0.00 -0.56 0.00 0.00 46.19 41.40 1qhb s LEU 405 CO 0.38 -0.98 1.08 -0.13 -1.06 0.00 0.00 176.35 175.64 1qhb s ARG 406 N -2.37 2.20 0.45 1.48 1.81 -1.26 -4.64 118.95 116.62 1qhb s ARG 406 Ca 0.59 0.98 0.16 0.00 -1.72 0.00 0.00 55.73 55.74 1qhb s ARG 406 Cb -0.39 -1.90 1.11 0.00 -0.45 0.00 0.00 34.95 33.31 1qhb s ARG 406 CO 0.49 -1.63 1.99 -1.35 -0.68 0.00 0.00 175.30 174.12 1qhb h PRO 407 N -1.11 0.31 -0.32 3.54 0.11 -1.82 -1.23 132.00 131.49 1qhb h PRO 407 Ca -0.45 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.60 1qhb h PRO 407 Cb 1.24 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1qhb h PRO 407 CO 0.54 0.20 0.01 1.05 -0.21 0.00 0.00 178.00 179.59 1qhb h GLU 408 N 0.32 0.49 -0.18 1.05 4.11 -1.92 -1.17 114.58 117.27 1qhb h GLU 408 Ca 0.26 -0.10 -0.15 0.00 0.07 0.00 0.00 59.36 59.44 1qhb h GLU 408 Cb 0.60 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1qhb h GLU 408 CO -0.06 0.51 -0.53 0.00 0.07 0.00 0.00 179.01 179.01 1qhb h ALA 409 N 1.54 0.75 -0.56 1.06 0.00 -1.58 -1.61 119.26 118.86 1qhb h ALA 409 Ca 0.10 -0.50 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 1qhb h ALA 409 Cb 0.30 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1qhb h ALA 409 CO 0.01 0.68 -0.03 1.15 0.00 0.00 0.00 179.25 181.06 1qhb h THR 410 N 0.41 1.26 0.00 0.00 2.02 -1.33 -1.52 112.91 113.75 1qhb h THR 410 Ca 0.01 -1.15 -0.06 0.00 0.77 0.00 0.00 66.41 65.99 1qhb h THR 410 Cb 1.05 0.86 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 1qhb h THR 410 CO 0.10 0.41 -0.26 1.23 0.37 0.00 0.00 175.52 177.36 1qhb h GLY 411 N 0.99 0.00 1.13 2.16 0.00 -0.94 -1.45 103.07 104.95 1qhb h GLY 411 Ca 0.16 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.36 1qhb h GLY 411 CO 0.03 0.00 -0.20 -1.33 0.00 0.00 0.00 176.54 175.04 1qhb h GLY 412 N 1.01 1.08 0.91 4.60 0.00 -0.53 -0.34 103.07 109.80 1qhb h GLY 412 Ca -0.00 -0.94 -0.06 0.00 0.00 0.00 0.00 47.33 46.33 1qhb h GLY 412 CO 0.03 0.86 -0.03 1.41 0.00 0.00 0.00 176.54 178.81 1qhb h LEU 413 N 0.86 0.60 -0.36 3.11 3.38 -0.40 -1.82 115.31 120.68 1qhb h LEU 413 Ca 0.11 -0.33 0.05 0.00 0.09 0.00 0.00 57.88 57.81 1qhb h LEU 413 Cb 0.78 -0.16 -0.05 0.00 0.09 0.00 0.00 40.66 41.32 1qhb h LEU 413 CO 0.06 0.78 0.08 0.40 0.09 0.00 0.00 178.44 179.86 1qhb h ILE 414 N 0.39 0.83 -0.45 1.22 2.04 -1.17 -1.66 117.51 118.71 1qhb h ILE 414 Ca 0.09 -0.07 -0.06 0.00 1.00 0.00 0.00 64.86 65.82 1qhb h ILE 414 Cb 0.50 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 1qhb h ILE 414 CO 0.02 0.04 0.06 -1.28 0.00 0.00 0.00 178.15 176.99 1qhb h SER 415 N 0.20 0.72 -0.19 1.72 0.87 -0.88 -0.90 113.55 115.10 1qhb h SER 415 Ca 0.17 -0.27 -0.04 0.00 -1.23 0.00 0.00 61.79 60.42 1qhb h SER 415 Cb 0.19 -0.19 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 1qhb h SER 415 CO -0.22 0.81 -0.03 0.58 -0.53 0.00 0.00 176.83 177.44 1qhb h VAL 416 N 0.61 1.28 -0.31 2.23 2.07 -1.28 -2.25 116.25 118.60 1qhb h VAL 416 Ca 0.14 -0.97 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 1qhb h VAL 416 Cb 0.40 1.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 1qhb h VAL 416 CO 0.01 0.29 0.18 -1.13 0.02 0.00 0.00 177.57 176.94 1qhb h ASN 417 N 0.08 0.38 -0.44 0.57 -0.73 -1.19 -0.58 115.58 113.66 1qhb h ASN 417 Ca 0.05 -0.07 -0.05 0.00 1.87 0.00 0.00 56.30 58.10 1qhb h ASN 417 Cb 0.45 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.93 1qhb h ASN 417 CO 0.02 0.34 0.07 0.50 -0.37 0.00 0.00 177.43 177.98 1qhb h LYS 418 N 0.38 0.73 -0.66 6.67 3.64 -1.17 -1.89 116.57 124.28 1qhb h LYS 418 Ca 0.11 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.28 1qhb h LYS 418 Cb 0.04 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 1qhb h LYS 418 CO -0.02 0.76 0.38 -0.91 -2.27 0.00 0.00 179.45 177.38 1qhb h ASN 419 N 0.59 0.81 -0.91 4.20 2.35 -1.37 -1.98 115.58 119.28 1qhb h ASN 419 Ca 0.13 -0.08 0.02 0.00 -0.55 0.00 0.00 56.30 55.83 1qhb h ASN 419 Cb 0.38 -0.20 -0.05 0.00 0.05 0.00 0.00 38.32 38.49 1qhb h ASN 419 CO 0.01 0.65 0.60 0.00 -1.65 0.00 0.00 177.43 177.04 1qhb h ALA 420 N 1.19 1.17 -0.29 -0.83 0.00 -0.83 -1.38 119.26 118.29 1qhb h ALA 420 Ca 0.23 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 1qhb h ALA 420 Cb 0.01 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1qhb h ALA 420 CO -0.04 0.50 0.04 0.35 0.00 0.00 0.00 179.25 180.10 1qhb h PHE 421 N 1.19 0.43 0.00 0.00 3.57 -1.15 0.22 116.94 121.19 1qhb h PHE 421 Ca 0.35 -0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.72 1qhb h PHE 421 Cb -0.08 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.52 1qhb h PHE 421 CO -0.01 0.41 -0.50 -0.07 -2.23 0.00 0.00 178.31 175.91 1qhb h LEU 422 N 0.42 0.00 -3.54 0.59 3.38 -0.48 -2.74 115.31 112.94 1qhb h LEU 422 Ca 0.10 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.90 1qhb h LEU 422 Cb 0.21 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 40.86 1qhb h LEU 422 CO 0.00 0.50 0.21 0.29 0.09 0.00 0.00 178.44 179.53 1qhb n LYS 423 N -3.72 3.75 -3.40 1.13 4.01 -0.82 -4.94 118.16 114.17 1qhb n LYS 423 Ca -0.01 -2.87 -0.17 0.00 -0.51 0.00 0.00 58.31 54.75 1qhb n LYS 423 Cb 0.55 -2.17 0.03 0.00 -0.51 0.00 0.00 35.03 32.93 1qhb n LYS 423 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1qhb n SER 424 N 0.01 -6.37 -3.73 4.39 7.64 -1.03 -5.02 113.62 109.51 1qhb n SER 424 Ca 0.36 -0.66 -0.10 0.00 1.01 0.00 0.00 58.87 59.49 1qhb n SER 424 Cb 1.29 -4.26 -0.06 0.00 -1.01 0.00 0.00 64.21 60.18 1qhb n SER 424 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 1qhb s GLU 425 N -4.57 0.97 -0.23 1.43 2.12 0.70 -4.97 118.70 114.16 1qhb s GLU 425 Ca 0.28 -0.82 0.01 0.00 0.36 0.00 0.00 54.97 54.81 1qhb s GLU 425 Cb -0.07 0.41 0.04 0.00 0.26 0.00 0.00 34.13 34.77 1qhb s GLU 425 CO 0.80 -0.35 -0.14 -1.12 -0.54 0.00 0.00 175.26 173.91 1qhb s SER 426 N -2.83 3.93 -0.05 -1.70 0.01 -1.26 -3.08 113.70 108.72 1qhb s SER 426 Ca 0.04 -1.03 0.02 0.00 1.31 0.00 0.00 55.95 56.29 1qhb s SER 426 Cb 0.03 -1.54 0.02 0.00 0.21 0.00 0.00 66.02 64.73 1qhb s SER 426 CO -0.12 -0.11 -0.09 -0.69 0.41 0.00 0.00 173.24 172.65 1qhb s VAL 427 N 1.21 0.85 -0.91 3.43 1.01 -1.26 -4.88 120.40 119.85 1qhb s VAL 427 Ca -0.02 -0.32 -0.06 0.00 0.00 0.00 0.00 61.98 61.57 1qhb s VAL 427 Cb -0.17 -0.80 -0.01 0.00 0.00 0.00 0.00 36.38 35.40 1qhb s VAL 427 CO -0.08 0.29 0.74 0.49 0.00 0.00 0.00 175.10 176.54 1qhb n PHE 428 N 3.81 -2.45 0.30 5.22 3.72 -1.26 -4.24 117.46 122.57 1qhb n PHE 428 Ca -0.23 0.86 0.19 0.00 -0.05 0.00 0.00 57.45 58.21 1qhb n PHE 428 Cb 0.52 -3.70 0.86 0.00 -0.94 0.00 0.00 39.48 36.21 1qhb n PHE 428 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1qhb h PRO 429 N -0.54 0.00 0.00 -1.08 0.13 -1.99 -1.77 132.00 126.75 1qhb h PRO 429 Ca -0.39 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.74 1qhb h PRO 429 Cb 1.22 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.35 1qhb h PRO 429 CO 0.38 0.00 -0.03 0.93 -0.23 0.00 0.00 178.00 179.05 1qhb h GLU 430 N 0.00 0.00 -0.48 0.86 3.07 -2.02 -1.42 114.58 114.59 1qhb h GLU 430 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1qhb h GLU 430 Cb 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 1qhb h GLU 430 CO 0.00 0.03 0.00 1.33 -1.40 0.00 0.00 179.01 178.97 1qhb n VAL 431 N -3.79 2.02 -0.20 3.13 0.24 -0.67 -4.62 118.33 114.44 1qhb n VAL 431 Ca -0.03 -1.41 0.01 0.00 -2.04 0.00 0.00 64.34 60.88 1qhb n VAL 431 Cb 0.12 -0.00 0.11 0.00 -1.47 0.00 0.00 33.84 32.60 1qhb n VAL 431 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1qhb h ASP 432 N 3.12 0.03 -0.23 -1.34 3.32 -1.40 0.09 116.42 120.01 1qhb h ASP 432 Ca 0.00 0.11 -0.13 0.00 0.02 0.00 0.00 57.03 57.03 1qhb h ASP 432 Cb 1.45 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 41.13 1qhb h ASP 432 CO 0.24 0.02 -0.33 0.58 -1.72 0.00 0.00 179.24 178.03 1qhb h VAL 433 N 0.28 1.28 -0.20 -1.35 2.07 -1.81 0.62 116.25 117.14 1qhb h VAL 433 Ca 0.32 -1.48 -0.01 0.00 0.82 0.00 0.00 66.70 66.35 1qhb h VAL 433 Cb 0.47 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 31.61 1qhb h VAL 433 CO -0.40 0.49 0.09 0.25 0.02 0.00 0.00 177.57 178.02 1qhb h LEU 434 N 0.63 0.26 -0.57 2.57 5.85 -1.62 -1.19 115.31 121.25 1qhb h LEU 434 Ca 0.07 -0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 1qhb h LEU 434 Cb 0.87 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.80 1qhb h LEU 434 CO 0.08 0.32 0.29 0.58 -0.34 0.00 0.00 178.44 179.37 1qhb h VAL 435 N 0.19 1.20 -0.32 1.05 2.07 -0.84 -2.58 116.25 117.02 1qhb h VAL 435 Ca 0.07 -0.53 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 1qhb h VAL 435 Cb 0.13 0.51 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 1qhb h VAL 435 CO -0.01 0.22 0.08 -0.08 0.02 0.00 0.00 177.57 177.80 1qhb h GLU 436 N 0.76 0.51 0.00 1.57 4.81 -0.59 -2.92 114.58 118.73 1qhb h GLU 436 Ca 0.20 -0.12 -0.05 0.00 -0.13 0.00 0.00 59.36 59.26 1qhb h GLU 436 Cb 0.08 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1qhb h GLU 436 CO -0.03 0.58 -0.23 0.93 -0.73 0.00 0.00 179.01 179.53 1qhb h GLU 437 N 0.35 0.00 -0.44 1.92 4.39 -1.15 -2.72 114.58 116.94 1qhb h GLU 437 Ca 0.10 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.80 1qhb h GLU 437 Cb 0.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1qhb h GLU 437 CO 0.00 0.23 0.00 1.28 -1.16 0.00 0.00 179.01 179.36 1qhb n LEU 438 N -3.66 2.76 -0.37 1.33 4.77 -0.98 -4.75 117.00 116.09 1qhb n LEU 438 Ca -0.01 -1.30 -0.05 0.00 -0.03 0.00 0.00 56.01 54.62 1qhb n LEU 438 Cb 0.35 -0.29 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 1qhb n LEU 438 CO 0.33 0.65 0.51 -1.54 -1.33 0.00 0.00 177.39 176.02 1qhb n SER 439 N 1.01 -0.75 -0.30 -1.43 3.41 -1.03 -1.06 113.62 113.47 1qhb n SER 439 Ca 0.18 1.65 -0.05 0.00 -0.26 0.00 0.00 58.87 60.39 1qhb n SER 439 Cb 0.46 -0.31 0.07 0.00 -0.26 0.00 0.00 64.21 64.17 1qhb n SER 439 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1qhb h SER 440 N 0.00 1.06 -0.84 4.04 4.64 -1.88 -2.24 113.55 118.33 1qhb h SER 440 Ca 0.26 -0.12 0.03 0.00 -0.47 0.00 0.00 61.79 61.49 1qhb h SER 440 Cb 0.49 -0.27 -0.05 0.00 -0.31 0.00 0.00 62.40 62.26 1qhb h SER 440 CO -0.91 0.88 0.55 0.40 -0.87 0.00 0.00 176.83 176.87 1qhb h ILE 441 N 1.16 1.15 -0.14 0.95 2.04 -1.47 -2.22 117.51 118.98 1qhb h ILE 441 Ca 0.28 -0.37 -0.04 0.00 1.00 0.00 0.00 64.86 65.73 1qhb h ILE 441 Cb 0.08 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 36.14 1qhb h ILE 441 CO -0.04 0.20 -0.11 -0.07 0.00 0.00 0.00 178.15 178.13 1qhb h LEU 442 N 1.07 0.20 -0.28 1.44 3.38 -0.67 -1.68 115.31 118.78 1qhb h LEU 442 Ca 0.33 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.24 1qhb h LEU 442 Cb -0.02 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1qhb h LEU 442 CO -0.11 0.34 0.10 0.44 0.09 0.00 0.00 178.44 179.30 1qhb h ASP 443 N 0.21 0.40 -0.85 -0.43 3.32 -1.08 -0.23 116.42 117.76 1qhb h ASP 443 Ca 0.04 -0.19 -0.00 0.00 0.02 0.00 0.00 57.03 56.90 1qhb h ASP 443 Cb 0.33 -0.10 -0.04 0.00 0.22 0.00 0.00 39.33 39.73 1qhb h ASP 443 CO 0.02 0.48 0.52 0.44 -1.72 0.00 0.00 179.24 178.98 1qhb h ASP 444 N 0.30 1.02 -0.52 6.45 3.32 -1.20 -2.73 116.42 123.06 1qhb h ASP 444 Ca 0.09 -0.06 -0.12 0.00 0.02 0.00 0.00 57.03 56.96 1qhb h ASP 444 Cb 0.22 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 1qhb h ASP 444 CO -0.00 0.78 -0.14 -1.28 -1.72 0.00 0.00 179.24 176.87 1qhb h SER 445 N 1.17 1.03 -0.55 6.45 0.87 -1.20 0.08 113.55 121.40 1qhb h SER 445 Ca 0.31 -0.37 -0.02 0.00 -1.23 0.00 0.00 61.79 60.48 1qhb h SER 445 Cb -0.05 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.60 1qhb h SER 445 CO -0.06 1.16 0.29 0.00 -0.53 0.00 0.00 176.83 177.69 1qhb h ALA 446 N 0.90 1.44 0.09 6.23 0.00 -0.85 0.33 119.26 127.40 1qhb h ALA 446 Ca 0.13 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1qhb h ALA 446 Cb 0.72 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1qhb h ALA 446 CO 0.06 0.46 -0.04 1.03 0.00 0.00 0.00 179.25 180.75 1qhb h SER 447 N 0.80 -0.10 -0.40 0.00 0.87 -1.16 -1.04 113.55 112.52 1qhb h SER 447 Ca 0.20 -0.29 -0.05 0.00 -1.23 0.00 0.00 61.79 60.42 1qhb h SER 447 Cb 0.06 0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 62.02 1qhb h SER 447 CO -0.03 0.24 0.08 -1.28 -0.53 0.00 0.00 176.83 175.30 1qhb h SER 448 N -0.45 0.69 0.08 6.23 0.87 -0.64 -2.40 113.55 117.92 1qhb h SER 448 Ca -0.01 -0.13 -0.10 0.00 -1.23 0.00 0.00 61.79 60.32 1qhb h SER 448 Cb 0.38 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 1qhb h SER 448 CO 0.02 0.71 -0.34 0.78 -0.53 0.00 0.00 176.83 177.47 1qhb h ASN 449 N 0.70 0.38 -0.51 6.23 2.35 -0.29 -1.96 115.58 122.48 1qhb h ASN 449 Ca 0.15 -0.14 -0.09 0.00 -0.55 0.00 0.00 56.30 55.67 1qhb h ASN 449 Cb 0.32 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1qhb h ASN 449 CO 0.00 0.70 -0.00 -0.08 -1.65 0.00 0.00 177.43 176.40 1qhb h GLU 450 N 0.32 0.95 -0.35 0.81 4.81 -0.75 0.18 114.58 120.55 1qhb h GLU 450 Ca 0.04 -0.29 -0.04 0.00 -0.13 0.00 0.00 59.36 58.94 1qhb h GLU 450 Cb 0.75 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 1qhb h GLU 450 CO 0.06 0.94 0.06 0.87 -0.73 0.00 0.00 179.01 180.21 1qhb h LYS 451 N 0.88 0.58 -0.75 1.92 1.57 -1.08 0.15 116.57 119.83 1qhb h LYS 451 Ca 0.16 -0.16 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1qhb h LYS 451 Cb 0.52 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.73 1qhb h LYS 451 CO 0.03 0.65 0.42 0.37 -0.57 0.00 0.00 179.45 180.35 1qhb h GLN 452 N 0.42 1.05 -0.13 3.15 5.75 -1.04 0.19 115.11 124.50 1qhb h GLN 452 Ca 0.11 -0.12 -0.14 0.00 -0.15 0.00 0.00 58.65 58.35 1qhb h GLN 452 Cb 0.35 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 1qhb h GLN 452 CO 0.01 0.78 -0.52 -0.91 -2.65 0.00 0.00 178.83 175.53 1qhb h ASN 453 N 1.04 0.38 -0.17 -0.69 2.35 -0.39 -1.10 115.58 117.00 1qhb h ASN 453 Ca 0.27 -0.19 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 1qhb h ASN 453 Cb 0.03 -0.11 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 1qhb h ASN 453 CO -0.04 0.83 0.01 0.40 -1.65 0.00 0.00 177.43 176.98 1qhb h ILE 454 N 0.27 1.24 -0.81 2.81 2.04 -0.55 0.26 117.51 122.77 1qhb h ILE 454 Ca 0.01 -0.78 0.07 0.00 1.00 0.00 0.00 64.86 65.15 1qhb h ILE 454 Cb 1.00 1.42 -0.05 0.00 -0.74 0.00 0.00 36.82 38.46 1qhb h ILE 454 CO 0.09 0.24 0.53 0.00 0.00 0.00 0.00 178.15 179.00 1qhb h ALA 455 N 0.80 1.62 0.00 1.87 0.00 -0.66 -2.38 119.26 120.51 1qhb h ALA 455 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1qhb h ALA 455 Cb 0.34 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1qhb h ALA 455 CO 0.01 0.25 -0.54 -0.25 0.00 0.00 0.00 179.25 178.71 1qhb n ASP 456 N -4.49 0.57 -0.44 0.00 8.00 -0.44 -4.95 116.55 114.80 1qhb n ASP 456 Ca 0.12 0.00 -0.04 0.00 0.71 0.00 0.00 54.79 55.58 1qhb n ASP 456 Cb 0.22 0.16 -0.01 0.00 -0.02 0.00 0.00 41.12 41.47 1qhb n ASP 456 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qhb n GLY 457 N 1.41 0.35 3.68 0.44 0.00 0.03 -5.02 105.19 106.08 1qhb n GLY 457 Ca 0.04 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 1qhb n GLY 457 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qhb s ASP 458 N -2.85 6.38 -0.06 1.61 1.01 -0.89 -5.05 116.67 116.82 1qhb s ASP 458 Ca 0.00 0.44 0.05 0.00 0.71 0.00 0.00 52.55 53.75 1qhb s ASP 458 Cb 0.00 -2.20 -0.00 0.00 1.01 0.00 0.00 42.92 41.73 1qhb s ASP 458 CO 0.00 -0.01 -0.20 -0.69 0.21 0.00 0.00 175.17 174.48 1qhb s VAL 459 N 1.08 1.69 -0.02 -1.27 1.01 -1.26 -4.68 120.40 116.95 1qhb s VAL 459 Ca 0.16 -0.85 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 1qhb s VAL 459 Cb -0.14 -1.46 0.01 0.00 0.00 0.00 0.00 36.38 34.80 1qhb s VAL 459 CO 0.06 0.48 0.23 -0.44 0.00 0.00 0.00 175.10 175.44 1qhb s SER 460 N 0.10 -0.12 0.46 3.32 0.01 -1.26 -4.89 113.70 111.32 1qhb s SER 460 Ca -0.08 0.04 -0.25 0.00 1.31 0.00 0.00 55.95 56.98 1qhb s SER 460 Cb -0.14 0.31 -0.08 0.00 0.21 0.00 0.00 66.02 66.32 1qhb s SER 460 CO 0.04 -0.36 1.36 -2.84 0.41 0.00 0.00 173.24 171.85 1qhb s PRO 461 N -1.11 3.67 0.00 12.44 0.02 -1.26 -4.85 135.00 143.91 1qhb s PRO 461 Ca -0.12 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.16 1qhb s PRO 461 Cb -0.06 -2.59 0.00 0.00 0.02 0.00 0.00 34.50 31.87 1qhb s PRO 461 CO 0.03 -0.78 0.00 0.41 -0.33 0.00 0.00 177.00 176.33 1qhb n GLY 462 N 0.62 -0.82 3.88 0.52 0.00 -1.26 -4.93 105.19 103.21 1qhb n GLY 462 Ca 0.06 -1.69 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 1qhb n GLY 462 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qhb s LYS 463 N -1.37 3.16 -0.17 1.61 1.02 -1.26 -5.07 119.74 117.65 1qhb s LYS 463 Ca 0.00 0.51 -0.01 0.00 0.02 0.00 0.00 55.97 56.50 1qhb s LYS 463 Cb 0.00 -2.08 -0.00 0.00 -0.52 0.00 0.00 37.83 35.23 1qhb s LYS 463 CO 0.00 -0.80 -0.13 0.45 -0.92 0.00 0.00 175.35 173.95 1qhb s SER 464 N -4.28 3.80 -0.15 2.83 0.15 -1.26 -4.93 113.70 109.86 1qhb s SER 464 Ca 0.56 -0.45 0.16 0.00 0.70 0.00 0.00 55.95 56.92 1qhb s SER 464 Cb -0.11 -1.60 0.46 0.00 -1.71 0.00 0.00 66.02 63.06 1qhb s SER 464 CO 0.52 0.06 1.35 0.49 1.20 0.00 0.00 173.24 176.86 1qhb n PHE 465 N 4.25 0.72 -1.66 3.44 3.72 -1.26 -3.95 117.46 122.71 1qhb n PHE 465 Ca -0.19 -0.87 -0.36 0.00 -0.05 0.00 0.00 57.45 55.99 1qhb n PHE 465 Cb 0.51 -0.26 0.07 0.00 -0.94 0.00 0.00 39.48 38.87 1qhb n PHE 465 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 1qhb s LEU 466 N -2.67 3.48 -0.17 4.37 1.43 -1.26 -4.56 118.68 119.30 1qhb s LEU 466 Ca 0.38 2.47 -0.29 0.00 -1.03 0.00 0.00 54.13 55.66 1qhb s LEU 466 Cb 0.31 -4.60 -0.00 0.00 0.03 0.00 0.00 46.19 41.92 1qhb s LEU 466 CO 0.08 -2.04 1.06 -0.22 0.23 0.00 0.00 176.35 175.47 1qhb s LEU 467 N -4.64 4.17 0.15 1.79 2.96 -1.26 -4.96 118.68 116.90 1qhb s LEU 467 Ca 0.78 1.50 -0.31 0.00 -0.22 0.00 0.00 54.13 55.88 1qhb s LEU 467 Cb -0.33 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.72 1qhb s LEU 467 CO 0.41 -0.59 1.49 -2.84 -1.32 0.00 0.00 176.35 173.49 1qhb s PRO 468 N 2.73 4.26 -0.06 0.98 0.02 -1.26 -4.83 135.00 136.84 1qhb s PRO 468 Ca 0.48 2.24 -0.05 0.00 0.02 0.00 0.00 61.00 63.69 1qhb s PRO 468 Cb -0.18 -3.19 -0.04 0.00 0.02 0.00 0.00 34.50 31.11 1qhb s PRO 468 CO 0.12 -0.53 0.16 -1.64 -0.33 0.00 0.00 177.00 174.79 1qhb s MET 469 N 1.04 3.43 0.42 5.54 -1.94 -0.57 -4.78 119.30 122.43 1qhb s MET 469 Ca 0.67 -0.24 0.22 0.00 -1.71 0.00 0.00 55.69 54.63 1qhb s MET 469 Cb -0.41 -3.13 0.30 0.00 2.01 0.00 0.00 34.83 33.60 1qhb s MET 469 CO 0.31 0.72 1.59 0.00 -0.01 0.00 0.00 175.02 177.63 1qhb h ALA 470 N 4.35 0.95 -3.48 3.03 0.00 -1.60 1.00 119.26 123.51 1qhb h ALA 470 Ca -0.52 -0.06 -0.68 0.00 0.00 0.00 0.00 54.91 53.65 1qhb h ALA 470 Cb 1.21 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.82 1qhb h ALA 470 CO 0.64 0.09 -0.66 -0.06 0.00 0.00 0.00 179.25 179.26 1qhb s PHE 471 N -3.17 3.04 0.31 0.00 0.08 -1.26 -4.81 117.98 112.16 1qhb s PHE 471 Ca 0.07 0.09 -0.00 0.00 0.12 0.00 0.00 56.93 57.20 1qhb s PHE 471 Cb 0.05 -1.72 0.51 0.00 -0.57 0.00 0.00 43.02 41.29 1qhb s PHE 471 CO 0.68 0.41 1.94 0.00 -0.10 0.00 0.00 175.22 178.15 1qhb h ALA 472 N 4.98 1.41 -0.04 5.36 0.00 -1.87 -1.92 119.26 127.18 1qhb h ALA 472 Ca -0.49 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1qhb h ALA 472 Cb 1.18 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1qhb h ALA 472 CO 0.54 0.49 0.00 -0.85 0.00 0.00 0.00 179.25 179.43 1qhb n GLU 473 N -4.38 1.49 0.00 0.00 0.00 -1.26 -4.73 120.64 111.76 1qhb n GLU 473 Ca 0.07 -0.72 0.00 0.00 0.00 0.00 0.00 57.16 56.51 1qhb n GLU 473 Cb 0.09 -1.45 0.00 0.00 0.00 0.00 0.00 31.44 30.08 1qhb n GLU 473 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1qhb n GLY 474 N 1.10 1.92 3.78 -1.84 0.00 -0.72 -4.81 105.19 104.62 1qhb n GLY 474 Ca 0.19 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.38 1qhb n GLY 474 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qhb s SER 475 N -4.00 4.42 1.11 1.61 1.04 -1.26 -4.84 113.70 111.78 1qhb s SER 475 Ca 0.00 1.44 -0.12 0.00 0.48 0.00 0.00 55.95 57.75 1qhb s SER 475 Cb 0.00 -2.19 0.26 0.00 0.10 0.00 0.00 66.02 64.19 1qhb s SER 475 CO 0.00 -2.04 1.06 -2.84 0.98 0.00 0.00 173.24 170.40 1qhb s PRO 476 N -5.07 -0.52 -0.97 4.02 0.02 -1.26 -4.86 135.00 126.36 1qhb s PRO 476 Ca 0.61 1.08 -0.07 0.00 0.02 0.00 0.00 61.00 62.64 1qhb s PRO 476 Cb -0.15 -1.58 -0.08 0.00 0.02 0.00 0.00 34.50 32.70 1qhb s PRO 476 CO 0.55 -3.53 3.02 1.19 -0.33 0.00 0.00 177.00 177.91 1qhb n PHE 477 N -4.81 1.67 -3.50 6.54 3.01 -1.26 -4.82 117.46 114.29 1qhb n PHE 477 Ca 0.05 -2.46 -0.16 0.00 1.01 0.00 0.00 57.45 55.90 1qhb n PHE 477 Cb 0.53 -1.99 -0.05 0.00 -0.01 0.00 0.00 39.48 37.97 1qhb n PHE 477 CO 0.00 0.00 0.00 -3.38 1.01 0.00 0.00 176.76 174.39 1qhb s HIS 478 N 0.75 -0.60 0.97 1.38 -3.43 -1.26 -2.51 115.29 110.60 1qhb s HIS 478 Ca 0.65 0.86 -0.13 0.00 -0.80 0.00 0.00 55.06 55.63 1qhb s HIS 478 Cb 0.25 0.46 0.05 0.00 -1.43 0.00 0.00 32.58 31.90 1qhb s HIS 478 CO -0.07 -0.65 0.41 -2.30 -2.00 0.00 0.00 174.74 170.13 1qhb n PRO 479 N 0.53 -0.47 0.15 -0.38 -0.02 -1.26 -4.94 135.00 128.60 1qhb n PRO 479 Ca -0.17 -0.10 0.03 0.00 -2.02 0.00 0.00 63.50 61.24 1qhb n PRO 479 Cb 0.59 -1.87 0.05 0.00 -0.02 0.00 0.00 33.50 32.25 1qhb n PRO 479 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1qhb h SER 480 N -1.65 0.00 -3.37 2.55 0.87 -1.51 -3.46 113.55 106.98 1qhb h SER 480 Ca -0.45 0.00 -0.59 0.00 -1.23 0.00 0.00 61.79 59.52 1qhb h SER 480 Cb 1.29 0.00 -0.37 0.00 -0.44 0.00 0.00 62.40 62.88 1qhb h SER 480 CO 0.35 0.46 -0.80 -0.47 -0.53 0.00 0.00 176.83 175.83 1qhb s TYR 481 N -3.00 2.14 0.00 2.24 5.04 -1.26 -4.22 117.35 118.29 1qhb s TYR 481 Ca 0.04 -1.38 0.00 0.00 -2.44 0.00 0.00 57.07 53.29 1qhb s TYR 481 Cb 0.07 -1.52 0.00 0.00 0.35 0.00 0.00 41.96 40.87 1qhb s TYR 481 CO 0.74 -0.69 0.00 0.41 -1.34 0.00 0.00 175.55 174.66 1qhb n GLY 482 N 4.76 1.52 3.48 8.97 0.00 -1.26 -2.89 105.19 119.77 1qhb n GLY 482 Ca -0.14 -1.86 -0.32 0.00 0.00 0.00 0.00 46.02 43.71 1qhb n GLY 482 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1qhb s SER 483 N -1.00 3.99 0.16 1.61 0.15 -1.25 -4.84 113.70 112.52 1qhb s SER 483 Ca 0.00 -0.26 -0.09 0.00 0.70 0.00 0.00 55.95 56.30 1qhb s SER 483 Cb 0.00 -0.79 0.00 0.00 -1.71 0.00 0.00 66.02 63.52 1qhb s SER 483 CO 0.00 0.31 1.47 1.23 1.20 0.00 0.00 173.24 177.45 1qhb h GLY 484 N 5.03 0.88 0.89 9.45 0.00 -1.95 0.61 103.07 117.99 1qhb h GLY 484 Ca -0.47 -0.96 -0.04 0.00 0.00 0.00 0.00 47.33 45.86 1qhb h GLY 484 CO 0.50 0.87 0.05 0.45 0.00 0.00 0.00 176.54 178.41 1qhb h HIS 485 N 0.64 0.54 -0.04 5.60 3.86 -1.95 -2.51 115.15 121.29 1qhb h HIS 485 Ca 0.03 -0.07 -0.19 0.00 -1.16 0.00 0.00 60.37 58.98 1qhb h HIS 485 Cb 1.06 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 29.38 1qhb h HIS 485 CO 0.06 0.59 -0.80 0.00 0.86 0.00 0.00 177.93 178.64 1qhb h ALA 486 N 0.88 0.55 -0.28 2.45 0.00 -1.86 -1.49 119.26 119.51 1qhb h ALA 486 Ca 0.09 -0.66 -0.10 0.00 0.00 0.00 0.00 54.91 54.25 1qhb h ALA 486 Cb 0.34 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1qhb h ALA 486 CO 0.01 0.81 -0.23 -0.24 0.00 0.00 0.00 179.25 179.60 1qhb h VAL 487 N 0.21 1.26 -0.32 0.00 3.04 -0.83 -0.53 116.25 119.07 1qhb h VAL 487 Ca -0.04 -1.26 -0.16 0.00 -1.01 0.00 0.00 66.70 64.24 1qhb h VAL 487 Cb 1.40 1.31 -0.00 0.00 -2.01 0.00 0.00 31.29 31.98 1qhb h VAL 487 CO 0.13 0.40 -0.41 0.58 -1.01 0.00 0.00 177.57 177.27 1qhb h VAL 488 N 0.47 1.28 -0.18 1.51 2.07 -1.35 -1.76 116.25 118.29 1qhb h VAL 488 Ca 0.07 -1.59 0.01 0.00 0.82 0.00 0.00 66.70 66.01 1qhb h VAL 488 Cb 0.66 1.54 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 1qhb h VAL 488 CO 0.05 0.52 0.09 0.00 0.02 0.00 0.00 177.57 178.25 1qhb h ALA 489 N 0.72 0.21 -0.51 1.67 0.00 -1.09 0.18 119.26 120.44 1qhb h ALA 489 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1qhb h ALA 489 Cb 1.00 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1qhb h ALA 489 CO 0.10 -0.33 0.33 0.78 0.00 0.00 0.00 179.25 180.12 1qhb h GLY 490 N 0.19 0.73 0.86 0.00 0.00 -0.89 -0.87 103.07 103.09 1qhb h GLY 490 Ca 0.07 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.10 1qhb h GLY 490 CO -0.04 0.28 0.05 0.00 0.00 0.00 0.00 176.54 176.83 1qhb h ALA 491 N 1.17 0.22 -0.20 3.60 0.00 -1.04 -2.82 119.26 120.19 1qhb h ALA 491 Ca 0.19 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1qhb h ALA 491 Cb -0.05 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1qhb h ALA 491 CO -0.04 -0.17 -0.03 0.00 0.00 0.00 0.00 179.25 179.02 1qhb h VAL 493 N 0.11 1.20 -0.63 0.00 -1.51 -1.25 -1.96 116.25 112.21 1qhb h VAL 493 Ca 0.05 -1.08 0.03 0.00 -1.23 0.00 0.00 66.70 64.47 1qhb h VAL 493 Cb 0.45 1.59 -0.04 0.00 -2.13 0.00 0.00 31.29 31.16 1qhb h VAL 493 CO 0.02 0.31 0.39 0.74 -1.23 0.00 0.00 177.57 177.79 1qhb h THR 494 N 0.00 1.07 -0.46 7.19 2.02 -1.38 0.18 112.91 121.52 1qhb h THR 494 Ca -0.00 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 66.90 1qhb h THR 494 Cb 0.56 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.20 1qhb h THR 494 CO 0.04 0.14 0.23 0.40 0.37 0.00 0.00 175.52 176.70 1qhb h ILE 495 N 0.76 1.18 -0.51 3.11 1.08 -1.12 -1.76 117.51 120.25 1qhb h ILE 495 Ca 0.26 -0.50 -0.12 0.00 -0.39 0.00 0.00 64.86 64.11 1qhb h ILE 495 Cb 0.03 0.65 -0.02 0.00 -3.07 0.00 0.00 36.82 34.42 1qhb h ILE 495 CO -0.11 0.20 -0.14 -0.07 -0.69 0.00 0.00 178.15 177.33 1qhb h LEU 496 N 0.61 1.02 -1.41 1.44 3.38 -0.85 -1.15 115.31 118.34 1qhb h LEU 496 Ca 0.16 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.72 1qhb h LEU 496 Cb 0.10 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1qhb h LEU 496 CO -0.02 1.15 -0.05 0.11 0.09 0.00 0.00 178.44 179.72 1qhb h LYS 497 N 0.87 0.32 -0.07 1.13 1.57 -0.51 -1.35 116.57 118.52 1qhb h LYS 497 Ca 0.13 -0.06 -0.19 0.00 -1.87 0.00 0.00 60.65 58.66 1qhb h LYS 497 Cb 0.72 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.97 1qhb h LYS 497 CO 0.05 0.39 -0.75 0.00 -0.57 0.00 0.00 179.45 178.58 1qhb h ALA 498 N 1.64 0.56 0.14 3.86 0.00 -1.05 -3.36 119.26 121.05 1qhb h ALA 498 Ca 0.07 -0.62 -0.29 0.00 0.00 0.00 0.00 54.91 54.07 1qhb h ALA 498 Cb 0.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1qhb h ALA 498 CO 0.01 0.76 -1.37 0.35 0.00 0.00 0.00 179.25 179.01 1qhb h PHE 499 N 0.29 0.53 -1.93 0.00 3.04 -0.85 -3.38 116.94 114.62 1qhb h PHE 499 Ca -0.04 -0.38 -0.44 0.00 3.98 0.00 0.00 57.97 61.09 1qhb h PHE 499 Cb 1.34 -0.02 0.01 0.00 2.56 0.00 0.00 35.95 39.83 1qhb h PHE 499 CO 0.05 1.34 -0.30 -0.06 -2.02 0.00 0.00 178.31 177.32 1qhb s PHE 500 N -2.64 3.12 -1.07 0.41 0.08 -0.54 -0.69 117.98 116.65 1qhb s PHE 500 Ca -0.06 -0.16 -0.23 0.00 0.12 0.00 0.00 56.93 56.60 1qhb s PHE 500 Cb 0.07 -2.05 -0.02 0.00 -0.57 0.00 0.00 43.02 40.44 1qhb s PHE 500 CO 0.88 -0.08 1.80 0.34 -0.10 0.00 0.00 175.22 178.06 1qhb s ASP 501 N -4.19 5.70 0.47 1.36 -1.08 -0.14 -3.83 116.67 114.96 1qhb s ASP 501 Ca 0.46 -1.41 0.17 0.00 -0.52 0.00 0.00 52.55 51.25 1qhb s ASP 501 Cb -0.10 -2.57 1.16 0.00 -1.46 0.00 0.00 42.92 39.95 1qhb s ASP 501 CO 0.32 -2.30 2.00 0.00 0.52 0.00 0.00 175.17 175.72 1qhb h ALA 502 N 9.91 2.15 -0.09 3.66 0.00 -1.89 -1.71 119.26 131.30 1qhb h ALA 502 Ca 0.21 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1qhb h ALA 502 Cb 0.97 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1qhb h ALA 502 CO 1.30 -0.28 0.00 0.09 0.00 0.00 0.00 179.25 180.37 1qhb n ASN 503 N -4.45 0.86 -4.77 0.00 3.02 -1.26 0.11 115.26 108.76 1qhb n ASN 503 Ca 0.08 -1.60 -0.41 0.00 -0.03 0.00 0.00 54.58 52.62 1qhb n ASN 503 Cb 0.41 -0.06 -0.01 0.00 -0.61 0.00 0.00 39.78 39.51 1qhb n ASN 503 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1qhb s PHE 504 N -1.88 2.63 0.07 3.10 5.36 -0.64 -4.76 117.98 121.84 1qhb s PHE 504 Ca 0.29 1.01 -0.12 0.00 -0.96 0.00 0.00 56.93 57.16 1qhb s PHE 504 Cb 0.15 -4.05 -0.06 0.00 -0.34 0.00 0.00 43.02 38.71 1qhb s PHE 504 CO 0.23 -3.26 0.42 -0.65 -1.46 0.00 0.00 175.22 170.50 1qhb s GLN 505 N -1.52 3.82 -0.29 10.12 -0.21 -1.26 -1.81 119.66 128.52 1qhb s GLN 505 Ca 0.57 0.27 -0.10 0.00 0.02 0.00 0.00 55.36 56.12 1qhb s GLN 505 Cb -0.47 -3.04 -0.03 0.00 1.00 0.00 0.00 33.01 30.47 1qhb s GLN 505 CO 0.58 0.58 0.15 0.42 -2.12 0.00 0.00 175.29 174.90 1qhb s ILE 506 N -1.33 4.79 -0.19 1.08 1.01 0.27 -4.94 121.20 121.90 1qhb s ILE 506 Ca 0.31 -0.17 0.22 0.00 0.00 0.00 0.00 60.65 61.02 1qhb s ILE 506 Cb -0.15 -3.35 -0.12 0.00 0.01 0.00 0.00 42.46 38.86 1qhb s ILE 506 CO 0.17 0.18 0.86 0.47 0.00 0.00 0.00 174.94 176.62 1qhb n ASP 507 N 5.00 0.56 -4.58 3.58 8.00 -1.26 -1.17 116.55 126.68 1qhb n ASP 507 Ca -0.14 0.19 -0.39 0.00 0.71 0.00 0.00 54.79 55.16 1qhb n ASP 507 Cb 0.51 0.97 -0.11 0.00 -0.02 0.00 0.00 41.12 42.47 1qhb n ASP 507 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1qhb s GLN 508 N -3.41 3.85 -0.21 -1.24 -0.21 -1.26 -4.85 119.66 112.33 1qhb s GLN 508 Ca -0.03 -0.39 -0.02 0.00 0.02 0.00 0.00 55.36 54.94 1qhb s GLN 508 Cb 0.11 -3.69 0.00 0.00 1.00 0.00 0.00 33.01 30.43 1qhb s GLN 508 CO 0.83 -0.24 -0.09 0.08 -2.12 0.00 0.00 175.29 173.74 1qhb s VAL 509 N 1.76 2.94 0.27 1.09 1.01 -1.26 -5.02 120.40 121.19 1qhb s VAL 509 Ca 0.07 -0.64 0.09 0.00 0.00 0.00 0.00 61.98 61.50 1qhb s VAL 509 Cb -0.16 -2.32 -0.04 0.00 0.00 0.00 0.00 36.38 33.86 1qhb s VAL 509 CO 0.11 0.46 0.02 -0.36 0.00 0.00 0.00 175.10 175.32 1qhb s PHE 510 N 1.42 2.72 0.22 5.22 0.08 -1.26 -0.75 117.98 125.63 1qhb s PHE 510 Ca 0.05 -0.23 -0.02 0.00 0.12 0.00 0.00 56.93 56.86 1qhb s PHE 510 Cb -0.14 -1.23 -0.03 0.00 -0.57 0.00 0.00 43.02 41.04 1qhb s PHE 510 CO -0.06 0.60 0.20 -1.21 -0.10 0.00 0.00 175.22 174.64 1qhb s GLU 511 N -3.70 1.32 -0.07 0.44 2.02 -0.66 -4.78 118.70 113.27 1qhb s GLU 511 Ca 0.32 -1.62 -0.19 0.00 0.02 0.00 0.00 54.97 53.49 1qhb s GLU 511 Cb -0.06 0.31 -0.05 0.00 0.10 0.00 0.00 34.13 34.43 1qhb s GLU 511 CO 0.20 -0.46 0.53 0.08 0.02 0.00 0.00 175.26 175.63 1qhb s VAL 512 N -4.04 5.08 0.60 2.63 1.01 -1.26 -0.91 120.40 123.50 1qhb s VAL 512 Ca 0.37 1.08 -0.19 0.00 0.00 0.00 0.00 61.98 63.24 1qhb s VAL 512 Cb 0.05 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.53 1qhb s VAL 512 CO 0.13 0.36 1.09 -0.67 0.00 0.00 0.00 175.10 176.02 1qhb n ASP 513 N 3.26 1.33 0.22 3.32 2.03 0.60 -4.78 116.55 122.53 1qhb n ASP 513 Ca -0.07 0.84 0.14 0.00 0.52 0.00 0.00 54.79 56.22 1qhb n ASP 513 Cb 0.51 -1.45 0.41 0.00 -0.72 0.00 0.00 41.12 39.87 1qhb n ASP 513 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1qhb h THR 514 N 0.66 0.00 0.00 5.18 1.35 -1.91 -3.37 112.91 114.82 1qhb h THR 514 Ca -0.49 -0.69 -0.17 0.00 -0.55 0.00 0.00 66.41 64.50 1qhb h THR 514 Cb 1.35 1.67 -0.03 0.00 -1.73 0.00 0.00 68.15 69.41 1qhb h THR 514 CO 0.52 0.00 -1.65 0.47 -0.25 0.00 0.00 175.52 174.62 1qhb n ASP 515 N -2.90 2.98 -4.56 5.36 8.00 -1.26 -5.06 116.55 119.10 1qhb n ASP 515 Ca 0.03 -0.04 -0.24 0.00 0.71 0.00 0.00 54.79 55.25 1qhb n ASP 515 Cb 0.41 0.14 -0.09 0.00 -0.02 0.00 0.00 41.12 41.57 1qhb n ASP 515 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1qhb s GLU 516 N -2.23 1.98 -1.08 -1.24 2.02 -1.26 -5.03 118.70 111.85 1qhb s GLU 516 Ca -0.12 -1.65 -0.16 0.00 0.02 0.00 0.00 54.97 53.07 1qhb s GLU 516 Cb 0.04 -1.93 -0.07 0.00 0.10 0.00 0.00 34.13 32.26 1qhb s GLU 516 CO 0.30 0.30 2.15 -3.47 0.02 0.00 0.00 175.26 174.56 1qhb n ASP 517 N -0.79 3.92 -3.92 -0.19 2.03 -1.26 -4.20 116.55 112.15 1qhb n ASP 517 Ca -0.05 -2.66 -0.09 0.00 0.52 0.00 0.00 54.79 52.51 1qhb n ASP 517 Cb 0.60 -1.31 -0.06 0.00 -0.72 0.00 0.00 41.12 39.63 1qhb n ASP 517 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 1qhb s LYS 518 N 3.93 1.30 0.01 -0.67 -2.85 -1.26 -4.86 119.74 115.33 1qhb s LYS 518 Ca 0.52 -1.12 -0.17 0.00 -1.00 0.00 0.00 55.97 54.20 1qhb s LYS 518 Cb 0.14 0.43 -0.06 0.00 -2.06 0.00 0.00 37.83 36.28 1qhb s LYS 518 CO 0.01 -0.51 0.48 -0.51 0.10 0.00 0.00 175.35 174.93 1qhb s LEU 519 N -2.96 4.46 0.15 2.77 1.43 -1.26 -0.29 118.68 122.98 1qhb s LEU 519 Ca 0.17 1.06 0.07 0.00 -1.03 0.00 0.00 54.13 54.39 1qhb s LEU 519 Cb 0.01 -2.73 -0.04 0.00 0.03 0.00 0.00 46.19 43.47 1qhb s LEU 519 CO 0.02 0.25 -0.14 0.68 0.23 0.00 0.00 176.35 177.38 1qhb s VAL 520 N -0.78 1.49 0.26 -1.59 -7.23 -0.09 -4.84 120.40 107.62 1qhb s VAL 520 Ca 0.26 -1.93 -0.30 0.00 -1.81 0.00 0.00 61.98 58.20 1qhb s VAL 520 Cb -0.17 -1.76 -0.11 0.00 0.56 0.00 0.00 36.38 34.89 1qhb s VAL 520 CO 0.15 -0.50 1.51 -0.75 -0.31 0.00 0.00 175.10 175.20 1qhb s LYS 521 N -3.12 4.20 0.77 4.82 2.20 -1.26 -1.66 119.74 125.70 1qhb s LYS 521 Ca 0.15 2.42 -0.12 0.00 -0.36 0.00 0.00 55.97 58.07 1qhb s LYS 521 Cb -0.03 -3.08 0.05 0.00 -1.51 0.00 0.00 37.83 33.27 1qhb s LYS 521 CO 0.04 -0.52 1.11 0.45 -0.36 0.00 0.00 175.35 176.07 1qhb s SER 522 N 0.47 4.80 0.26 1.43 0.15 0.07 -4.76 113.70 116.12 1qhb s SER 522 Ca 0.62 1.16 0.24 0.00 0.70 0.00 0.00 55.95 58.67 1qhb s SER 522 Cb -0.45 -1.89 0.48 0.00 -1.71 0.00 0.00 66.02 62.46 1qhb s SER 522 CO 0.44 -1.76 1.55 0.77 1.20 0.00 0.00 173.24 175.44 1qhb h SER 523 N -0.94 0.00 -3.09 5.45 4.64 -1.93 -3.43 113.55 114.24 1qhb h SER 523 Ca -0.46 -0.04 -0.54 0.00 -0.47 0.00 0.00 61.79 60.27 1qhb h SER 523 Cb 1.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 1qhb h SER 523 CO 0.62 0.02 0.67 0.12 -0.87 0.00 0.00 176.83 177.39 1qhb s PHE 524 N -3.18 3.23 0.12 4.77 5.36 -1.26 -4.93 117.98 122.08 1qhb s PHE 524 Ca 0.07 1.17 -0.17 0.00 -0.96 0.00 0.00 56.93 57.04 1qhb s PHE 524 Cb 0.10 -3.47 -0.03 0.00 -0.34 0.00 0.00 43.02 39.28 1qhb s PHE 524 CO 0.67 -1.54 1.64 -1.35 -1.46 0.00 0.00 175.22 173.18 1qhb h PRO 525 N 7.25 0.53 0.00 10.12 0.11 -1.98 -3.45 132.00 144.58 1qhb h PRO 525 Ca -0.38 -0.11 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1qhb h PRO 525 Cb 1.19 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1qhb h PRO 525 CO 0.86 0.56 0.00 0.41 -0.21 0.00 0.00 178.00 179.61 1qhb n GLY 526 N -0.65 -1.78 3.84 -0.55 0.00 -1.26 -4.76 105.19 100.03 1qhb n GLY 526 Ca -0.01 -1.90 -0.29 0.00 0.00 0.00 0.00 46.02 43.81 1qhb n GLY 526 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1qhb s PRO 527 N 0.00 0.74 0.26 1.61 0.04 -1.26 -5.12 135.00 131.26 1qhb s PRO 527 Ca 0.00 -0.08 0.12 0.00 0.04 0.00 0.00 61.00 61.08 1qhb s PRO 527 Cb 0.00 -1.83 -0.05 0.00 0.04 0.00 0.00 34.50 32.67 1qhb s PRO 527 CO 0.00 -2.40 -0.20 -0.51 0.04 0.00 0.00 177.00 173.93 1qhb s LEU 528 N -6.03 2.57 0.23 -3.56 1.43 -0.32 -4.91 118.68 108.08 1qhb s LEU 528 Ca 0.69 -1.01 0.06 0.00 -1.03 0.00 0.00 54.13 52.83 1qhb s LEU 528 Cb -0.09 -1.08 -0.03 0.00 0.03 0.00 0.00 46.19 45.02 1qhb s LEU 528 CO 0.53 0.04 0.27 0.42 0.23 0.00 0.00 176.35 177.83 1qhb s THR 529 N -2.42 4.89 0.20 5.49 -4.23 -1.26 0.96 115.64 119.26 1qhb s THR 529 Ca 0.28 -1.12 -0.11 0.00 -1.18 0.00 0.00 61.69 59.55 1qhb s THR 529 Cb -0.05 -3.62 0.12 0.00 1.34 0.00 0.00 72.50 70.29 1qhb s THR 529 CO 0.14 -0.29 1.84 0.58 -0.54 0.00 0.00 174.62 176.35 1qhb h VAL 530 N 1.42 1.10 -0.62 2.29 2.07 -1.05 -1.87 116.25 119.59 1qhb h VAL 530 Ca -0.50 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 1qhb h VAL 530 Cb 1.23 0.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.20 1qhb h VAL 530 CO 0.62 0.15 0.38 0.00 0.02 0.00 0.00 177.57 178.74 1qhb h ALA 531 N 1.27 0.79 -0.70 1.67 0.00 -0.62 0.54 119.26 122.20 1qhb h ALA 531 Ca 0.25 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.04 1qhb h ALA 531 Cb -0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 1qhb h ALA 531 CO -0.09 0.25 0.20 0.78 0.00 0.00 0.00 179.25 180.38 1qhb h GLY 532 N 0.84 1.18 2.00 0.00 0.00 -1.74 0.13 103.07 105.48 1qhb h GLY 532 Ca 0.22 -0.71 -0.11 0.00 0.00 0.00 0.00 47.33 46.74 1qhb h GLY 532 CO -0.04 0.66 -0.52 0.83 0.00 0.00 0.00 176.54 177.46 1qhb h GLU 533 N 1.05 0.00 -0.01 4.80 4.39 -1.10 -0.50 114.58 123.22 1qhb h GLU 533 Ca 0.22 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.67 1qhb h GLU 533 Cb 0.33 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 28.99 1qhb h GLU 533 CO -0.00 0.52 -1.02 -0.07 -1.16 0.00 0.00 179.01 177.28 1qhb h LEU 534 N 0.00 0.86 -0.56 1.33 3.38 -0.54 -2.08 115.31 117.70 1qhb h LEU 534 Ca -0.01 -0.68 -0.07 0.00 0.09 0.00 0.00 57.88 57.21 1qhb h LEU 534 Cb 1.18 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 1qhb h LEU 534 CO 0.07 1.48 0.06 0.78 0.09 0.00 0.00 178.44 180.92 1qhb h ASN 535 N 0.38 0.92 -1.01 -0.43 2.35 -0.54 -2.33 115.58 114.92 1qhb h ASN 535 Ca -0.12 -0.28 0.04 0.00 -0.55 0.00 0.00 56.30 55.39 1qhb h ASN 535 Cb 1.67 -0.24 -0.06 0.00 0.05 0.00 0.00 38.32 39.73 1qhb h ASN 535 CO 0.20 0.97 0.66 0.50 -1.65 0.00 0.00 177.43 178.10 1qhb h LYS 536 N 0.84 1.23 -0.37 0.81 3.64 -1.13 -1.18 116.57 120.40 1qhb h LYS 536 Ca 0.17 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 1qhb h LYS 536 Cb 0.46 -0.28 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1qhb h LYS 536 CO 0.02 0.81 0.16 1.25 -2.27 0.00 0.00 179.45 179.42 1qhb h LEU 537 N 1.26 0.50 -0.35 5.20 5.85 -1.11 0.49 115.31 127.15 1qhb h LEU 537 Ca 0.41 -0.15 0.04 0.00 0.84 0.00 0.00 57.88 59.01 1qhb h LEU 537 Cb 0.02 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.89 1qhb h LEU 537 CO -0.13 0.52 0.13 0.00 -0.34 0.00 0.00 178.44 178.62 1qhb h ALA 538 N 1.01 0.41 -0.33 1.25 0.00 -0.95 -1.39 119.26 119.25 1qhb h ALA 538 Ca 0.13 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1qhb h ALA 538 Cb 0.16 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1qhb h ALA 538 CO -0.01 -0.26 -0.06 -0.44 0.00 0.00 0.00 179.25 178.48 1qhb h ASP 539 N 0.28 0.52 -0.16 0.00 3.32 -0.77 -1.65 116.42 117.95 1qhb h ASP 539 Ca 0.16 -0.12 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1qhb h ASP 539 Cb 0.12 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.53 1qhb h ASP 539 CO -0.15 0.63 0.08 0.78 -1.72 0.00 0.00 179.24 178.85 1qhb h ASN 540 N 0.51 0.21 -0.22 6.45 -0.26 0.85 0.24 115.58 123.37 1qhb h ASN 540 Ca 0.10 -0.12 -0.05 0.00 -0.56 0.00 0.00 56.30 55.67 1qhb h ASN 540 Cb 0.42 -0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.62 1qhb h ASN 540 CO 0.02 0.28 -0.04 0.58 -1.06 0.00 0.00 177.43 177.21 1qhb h VAL 541 N 0.13 1.28 -0.06 2.81 2.07 -1.15 0.19 116.25 121.51 1qhb h VAL 541 Ca 0.06 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.57 1qhb h VAL 541 Cb 0.12 1.50 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1qhb h VAL 541 CO -0.01 0.31 0.01 0.00 0.02 0.00 0.00 177.57 177.90 1qhb h ALA 542 N 0.76 0.06 0.00 1.67 0.00 -1.27 -2.68 119.26 117.80 1qhb h ALA 542 Ca 0.06 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1qhb h ALA 542 Cb 0.48 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1qhb h ALA 542 CO 0.02 -0.46 -0.47 0.82 0.00 0.00 0.00 179.25 179.16 1qhb h ILE 543 N 0.04 1.22 -0.39 0.00 1.08 -0.49 -2.55 117.51 116.42 1qhb h ILE 543 Ca 0.03 -1.68 0.05 0.00 -0.39 0.00 0.00 64.86 62.87 1qhb h ILE 543 Cb 0.02 1.94 -0.02 0.00 -3.07 0.00 0.00 36.82 35.69 1qhb h ILE 543 CO -0.04 0.46 0.26 1.23 -0.69 0.00 0.00 178.15 179.38 1qhb h GLY 544 N 1.67 0.38 1.10 5.37 0.00 -0.27 0.77 103.07 112.08 1qhb h GLY 544 Ca -0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 1qhb h GLY 544 CO 0.06 0.10 0.33 3.21 0.00 0.00 0.00 176.54 180.24 1qhb h ARG 545 N 0.31 1.15 -0.37 4.80 2.47 -1.36 -2.05 114.38 119.34 1qhb h ARG 545 Ca 0.17 -0.20 -0.00 0.00 -1.26 0.00 0.00 59.98 58.69 1qhb h ARG 545 Cb 0.28 -0.19 -0.02 0.00 -1.65 0.00 0.00 29.97 28.38 1qhb h ARG 545 CO -0.04 0.92 0.22 -0.91 0.56 0.00 0.00 179.97 180.73 1qhb h ASN 546 N 1.13 0.44 -0.60 7.04 4.21 -1.11 -1.90 115.58 124.79 1qhb h ASN 546 Ca 0.26 -0.05 0.11 0.00 1.21 0.00 0.00 56.30 57.84 1qhb h ASN 546 Cb 0.19 -0.11 -0.04 0.00 -1.12 0.00 0.00 38.32 37.24 1qhb h ASN 546 CO -0.02 0.35 0.40 0.24 -1.29 0.00 0.00 177.43 177.11 1qhb h MET 547 N 0.48 0.33 0.00 0.81 2.86 -0.59 0.36 114.93 119.18 1qhb h MET 547 Ca 0.13 -0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 1qhb h MET 547 Cb -0.01 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.58 1qhb h MET 547 CO -0.03 0.22 0.00 0.00 1.06 0.00 0.00 176.91 178.16 1qhb h ALA 548 N 1.70 1.00 0.00 6.32 0.00 -1.01 -3.43 119.26 123.85 1qhb h ALA 548 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1qhb h ALA 548 Cb 0.64 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1qhb h ALA 548 CO -0.07 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.59 1qhb n GLY 549 N 0.91 0.86 0.60 0.00 0.00 0.13 -1.60 105.19 106.09 1qhb n GLY 549 Ca 0.04 -0.12 0.07 0.00 0.00 0.00 0.00 46.02 46.02 1qhb n GLY 549 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1qhb n VAL 550 N -2.25 0.01 -4.07 1.61 0.24 -0.75 -4.19 118.33 108.94 1qhb n VAL 550 Ca 0.00 -0.51 -0.11 0.00 -2.04 0.00 0.00 64.34 61.69 1qhb n VAL 550 Cb 0.00 1.30 -0.06 0.00 -1.47 0.00 0.00 33.84 33.61 1qhb n VAL 550 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1qhb s HIS 551 N -1.25 0.71 0.23 6.34 4.02 -1.24 -4.61 115.29 119.49 1qhb s HIS 551 Ca 0.18 -1.01 0.09 0.00 1.02 0.00 0.00 55.06 55.34 1qhb s HIS 551 Cb 0.13 -0.07 -0.04 0.00 -1.02 0.00 0.00 32.58 31.57 1qhb s HIS 551 CO 0.19 -0.92 -0.05 0.71 1.02 0.00 0.00 174.74 175.69 1qhb s TYR 552 N -3.89 2.66 0.18 1.40 1.51 -1.26 -4.43 117.35 113.52 1qhb s TYR 552 Ca 0.29 -0.22 -0.20 0.00 -1.01 0.00 0.00 57.07 55.92 1qhb s TYR 552 Cb 0.02 -1.23 0.12 0.00 -0.11 0.00 0.00 41.96 40.76 1qhb s TYR 552 CO 0.12 0.58 1.60 0.35 -1.11 0.00 0.00 175.55 177.09 1qhb h PHE 553 N 2.32 -0.76 -0.60 2.71 3.57 -1.99 -2.07 116.94 120.13 1qhb h PHE 553 Ca -0.45 0.06 0.09 0.00 3.53 0.00 0.00 57.97 61.20 1qhb h PHE 553 Cb 1.23 0.41 -0.04 0.00 2.79 0.00 0.00 35.95 40.34 1qhb h PHE 553 CO 0.68 -0.35 0.40 0.66 -2.23 0.00 0.00 178.31 177.46 1qhb h SER 554 N -0.16 0.39 -0.54 0.41 4.64 -1.97 -1.45 113.55 114.87 1qhb h SER 554 Ca 0.22 0.01 0.04 0.00 -0.47 0.00 0.00 61.79 61.59 1qhb h SER 554 Cb 0.52 -0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 62.49 1qhb h SER 554 CO -0.60 0.24 0.29 0.44 -0.87 0.00 0.00 176.83 176.33 1qhb h ASP 555 N 0.44 0.43 0.11 4.97 3.32 -1.70 -1.98 116.42 122.01 1qhb h ASP 555 Ca 0.27 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.34 1qhb h ASP 555 Cb 0.50 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1qhb h ASP 555 CO -0.08 0.29 -0.05 1.56 -1.72 0.00 0.00 179.24 179.25 1qhb h GLN 556 N 0.56 -0.14 -0.23 3.56 1.08 -1.21 -2.71 115.11 116.02 1qhb h GLN 556 Ca 0.24 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.44 1qhb h GLN 556 Cb 0.12 0.03 -0.01 0.00 -0.05 0.00 0.00 27.48 27.57 1qhb h GLN 556 CO -0.15 0.32 0.13 0.35 -0.95 0.00 0.00 178.83 178.53 1qhb h PHE 557 N -0.68 0.31 -0.45 2.96 3.57 -1.40 -0.68 116.94 120.58 1qhb h PHE 557 Ca -0.01 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.43 1qhb h PHE 557 Cb 0.53 -0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 1qhb h PHE 557 CO 0.09 0.27 0.08 0.93 -2.23 0.00 0.00 178.31 177.44 1qhb h GLU 558 N 0.27 0.68 -0.31 1.11 4.39 -1.49 -2.70 114.58 116.52 1qhb h GLU 558 Ca 0.08 -0.14 -0.11 0.00 0.34 0.00 0.00 59.36 59.54 1qhb h GLU 558 Cb 0.05 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 1qhb h GLU 558 CO -0.01 0.64 -0.26 0.77 -1.16 0.00 0.00 179.01 178.99 1qhb h SER 559 N 0.66 0.63 -0.81 1.42 0.02 -1.16 -1.95 113.55 112.36 1qhb h SER 559 Ca 0.15 -0.23 0.05 0.00 -0.84 0.00 0.00 61.79 60.92 1qhb h SER 559 Cb 0.29 -0.17 -0.05 0.00 0.14 0.00 0.00 62.40 62.60 1qhb h SER 559 CO 0.00 0.87 0.50 -0.07 -1.14 0.00 0.00 176.83 176.99 1qhb h LEU 560 N 0.54 0.81 -0.60 5.07 3.38 -0.82 -0.57 115.31 123.13 1qhb h LEU 560 Ca 0.07 0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.91 1qhb h LEU 560 Cb 0.73 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1qhb h LEU 560 CO 0.06 0.54 -0.43 -0.07 0.09 0.00 0.00 178.44 178.63 1qhb h LEU 561 N 0.95 0.67 -0.68 1.67 3.38 -1.20 -2.50 115.31 117.60 1qhb h LEU 561 Ca 0.34 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.92 1qhb h LEU 561 Cb 0.10 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1qhb h LEU 561 CO -0.15 1.01 0.06 0.25 0.09 0.00 0.00 178.44 179.70 1qhb h LEU 562 N 0.51 1.04 -0.69 1.67 5.85 -0.69 -2.90 115.31 120.10 1qhb h LEU 562 Ca 0.04 -0.27 -0.12 0.00 0.84 0.00 0.00 57.88 58.37 1qhb h LEU 562 Cb 0.95 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.69 1qhb h LEU 562 CO 0.09 1.06 -0.27 1.23 -0.34 0.00 0.00 178.44 180.20 1qhb h GLY 563 N 1.03 0.77 0.54 3.75 0.00 -0.92 -2.12 103.07 106.12 1qhb h GLY 563 Ca 0.19 -0.69 0.06 0.00 0.00 0.00 0.00 47.33 46.89 1qhb h GLY 563 CO 0.02 0.63 0.16 -2.09 0.00 0.00 0.00 176.54 175.26 1qhb h GLU 564 N 0.61 0.33 -0.53 4.80 4.81 -1.34 -1.47 114.58 121.80 1qhb h GLU 564 Ca 0.08 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.19 1qhb h GLU 564 Cb 0.78 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 1qhb h GLU 564 CO 0.06 0.22 -0.06 1.96 -0.73 0.00 0.00 179.01 180.46 1qhb h GLN 565 N 0.34 0.95 -0.61 1.92 4.20 -1.24 -0.59 115.11 120.07 1qhb h GLN 565 Ca 0.23 -0.31 -0.00 0.00 0.06 0.00 0.00 58.65 58.62 1qhb h GLN 565 Cb 0.24 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.91 1qhb h GLN 565 CO -0.24 0.97 0.38 0.82 -0.67 0.00 0.00 178.83 180.09 1qhb h ILE 566 N 0.86 1.18 -0.19 2.54 1.08 -1.14 -1.52 117.51 120.31 1qhb h ILE 566 Ca 0.15 -0.38 -0.06 0.00 -0.39 0.00 0.00 64.86 64.18 1qhb h ILE 566 Cb 0.59 0.32 -0.00 0.00 -3.07 0.00 0.00 36.82 34.66 1qhb h ILE 566 CO 0.04 0.18 -0.13 0.00 -0.69 0.00 0.00 178.15 177.54 1qhb h ALA 567 N 1.20 0.27 -0.83 1.87 0.00 -0.97 -1.53 119.26 119.26 1qhb h ALA 567 Ca 0.22 -0.31 0.10 0.00 0.00 0.00 0.00 54.91 54.92 1qhb h ALA 567 Cb -0.04 -0.06 -0.08 0.00 0.00 0.00 0.00 17.79 17.61 1qhb h ALA 567 CO -0.04 0.14 0.47 0.82 0.00 0.00 0.00 179.25 180.64 1qhb h ILE 568 N 0.10 0.89 -0.45 0.00 2.04 -1.02 -1.83 117.51 117.23 1qhb h ILE 568 Ca 0.04 -0.27 -0.12 0.00 1.00 0.00 0.00 64.86 65.51 1qhb h ILE 568 Cb 0.64 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1qhb h ILE 568 CO 0.04 0.14 -0.18 1.23 0.00 0.00 0.00 178.15 179.38 1qhb h GLY 569 N 0.78 0.96 0.96 5.37 0.00 -0.88 -1.17 103.07 109.07 1qhb h GLY 569 Ca 0.41 -0.80 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 1qhb h GLY 569 CO -0.26 0.73 0.19 -2.22 0.00 0.00 0.00 176.54 174.98 1qhb h ILE 570 N 0.77 1.19 -0.71 2.60 2.04 -0.96 -2.45 117.51 119.99 1qhb h ILE 570 Ca 0.11 -0.57 -0.07 0.00 1.00 0.00 0.00 64.86 65.33 1qhb h ILE 570 Cb 0.72 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.52 1qhb h ILE 570 CO 0.06 0.21 0.17 -0.07 0.00 0.00 0.00 178.15 178.52 1qhb h LEU 571 N 0.57 1.08 -0.41 1.44 3.38 -1.09 0.33 115.31 120.61 1qhb h LEU 571 Ca 0.15 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1qhb h LEU 571 Cb 0.16 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1qhb h LEU 571 CO -0.02 1.04 0.21 -0.33 0.09 0.00 0.00 178.44 179.44 1qhb h GLU 572 N 1.08 0.58 -0.64 1.13 5.08 -1.16 -2.04 114.58 118.61 1qhb h GLU 572 Ca 0.22 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.43 1qhb h GLU 572 Cb 0.38 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.50 1qhb h GLU 572 CO 0.00 0.49 0.12 0.93 -1.00 0.00 0.00 179.01 179.55 1qhb h GLU 573 N 0.53 1.05 0.00 2.33 5.08 -1.14 -2.85 114.58 119.57 1qhb h GLU 573 Ca 0.14 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1qhb h GLU 573 Cb 0.09 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1qhb h GLU 573 CO -0.02 0.96 0.00 1.04 -1.00 0.00 0.00 179.01 179.99 1qhb n GLN 574 N -4.27 0.15 0.16 2.33 6.02 0.08 -2.73 117.38 119.12 1qhb n GLN 574 Ca 0.04 0.35 0.13 0.00 -0.01 0.00 0.00 57.00 57.51 1qhb n GLN 574 Cb 0.27 -1.78 0.54 0.00 1.02 0.00 0.00 30.24 30.30 1qhb n GLN 574 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1qhb h SER 575 N 0.00 0.00 1.13 1.08 4.64 -1.12 -1.00 113.55 118.28 1qhb h SER 575 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1qhb h SER 575 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1qhb h SER 575 CO 0.00 0.00 -0.11 0.18 -0.87 0.00 0.00 176.83 176.03 1qhb n LEU 576 N -2.37 0.43 0.02 5.97 4.77 -1.11 -3.65 117.00 121.07 1qhb n LEU 576 Ca 0.01 0.46 0.12 0.00 -0.03 0.00 0.00 56.01 56.58 1qhb n LEU 576 Cb 0.22 -0.38 0.32 0.00 -2.33 0.00 0.00 43.42 41.25 1qhb n LEU 576 CO 0.20 -0.07 0.56 0.35 -1.33 0.00 0.00 177.39 177.10 1qhb n THR 577 N -1.86 0.12 -3.93 -5.08 -2.24 -0.38 -4.91 114.28 96.00 1qhb n THR 577 Ca 0.06 -0.08 -0.33 0.00 -2.27 0.00 0.00 64.05 61.43 1qhb n THR 577 Cb 0.38 -0.05 -0.05 0.00 -2.10 0.00 0.00 70.33 68.52 1qhb n THR 577 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1qhb s TYR 578 N -3.05 3.52 -0.12 4.78 2.02 -1.24 -5.00 117.35 118.26 1qhb s TYR 578 Ca 0.10 0.33 0.21 0.00 -0.37 0.00 0.00 57.07 57.35 1qhb s TYR 578 Cb 0.17 -1.81 -0.19 0.00 -0.40 0.00 0.00 41.96 39.72 1qhb s TYR 578 CO 0.66 0.63 0.69 0.41 -1.57 0.00 0.00 175.55 176.38 1qhb n GLY 579 N 0.90 -1.19 3.68 0.71 0.00 -1.26 -4.96 105.19 103.06 1qhb n GLY 579 Ca -0.10 -0.37 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 1qhb n GLY 579 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1qhb s GLU 580 N -3.35 1.07 -0.50 1.61 8.01 -1.26 -4.98 118.70 119.31 1qhb s GLU 580 Ca -0.05 1.28 -0.16 0.00 0.01 0.00 0.00 54.97 56.04 1qhb s GLU 580 Cb 0.11 -1.75 0.08 0.00 -4.31 0.00 0.00 34.13 28.26 1qhb s GLU 580 CO 0.85 -2.50 0.47 1.21 0.01 0.00 0.00 175.26 175.30 1qhb s ASN 581 N -2.91 6.17 0.20 -0.19 2.47 -1.26 -5.00 114.94 114.42 1qhb s ASN 581 Ca 0.65 -1.34 -0.21 0.00 0.42 0.00 0.00 52.86 52.38 1qhb s ASN 581 Cb -0.21 -2.21 0.07 0.00 -1.45 0.00 0.00 41.25 37.45 1qhb s ASN 581 CO 0.58 -0.75 1.01 0.72 -3.72 0.00 0.00 177.10 174.94 1qhb s PHE 582 N 1.86 0.07 0.13 0.43 -0.71 -1.26 -4.75 117.98 113.76 1qhb s PHE 582 Ca 0.06 -0.50 -0.24 0.00 -1.04 0.00 0.00 56.93 55.21 1qhb s PHE 582 Cb -0.24 0.71 0.08 0.00 -1.21 0.00 0.00 43.02 42.36 1qhb s PHE 582 CO 0.07 -0.99 0.65 -0.59 -1.34 0.00 0.00 175.22 173.02 1qhb s PHE 583 N -2.19 -0.50 -0.07 3.49 -0.12 -1.19 -5.01 117.98 112.38 1qhb s PHE 583 Ca 0.21 0.30 -0.14 0.00 -0.05 0.00 0.00 56.93 57.25 1qhb s PHE 583 Cb -0.03 0.56 -0.05 0.00 -0.63 0.00 0.00 43.02 42.87 1qhb s PHE 583 CO 0.06 -0.80 0.37 -0.06 -0.05 0.00 0.00 175.22 174.73 1qhb s PHE 584 N -3.64 3.61 -0.34 3.49 0.08 -1.26 -4.07 117.98 115.86 1qhb s PHE 584 Ca 0.02 0.84 -0.17 0.00 0.12 0.00 0.00 56.93 57.74 1qhb s PHE 584 Cb -0.01 -2.32 -0.01 0.00 -0.57 0.00 0.00 43.02 40.11 1qhb s PHE 584 CO -0.12 0.47 0.45 1.21 -0.10 0.00 0.00 175.22 177.13 1qhb s ASN 585 N -0.40 6.27 -0.24 1.36 2.47 -1.26 -1.34 114.94 121.80 1qhb s ASN 585 Ca 0.22 -0.04 0.02 0.00 0.42 0.00 0.00 52.86 53.47 1qhb s ASN 585 Cb -0.15 -2.24 0.05 0.00 -1.45 0.00 0.00 41.25 37.46 1qhb s ASN 585 CO 0.10 -0.40 -0.10 -0.22 -3.72 0.00 0.00 177.10 172.75 1qhb s LEU 586 N 2.24 2.94 -0.43 3.21 2.96 -0.25 -4.36 118.68 124.99 1qhb s LEU 586 Ca 0.16 -1.21 -0.29 0.00 -0.22 0.00 0.00 54.13 52.58 1qhb s LEU 586 Cb -0.16 -1.40 0.01 0.00 0.50 0.00 0.00 46.19 45.14 1qhb s LEU 586 CO 0.12 -0.18 1.46 -2.16 -1.32 0.00 0.00 176.35 174.27 1qhb s PRO 587 N 1.24 3.50 1.04 0.98 0.04 -1.26 -1.44 135.00 139.08 1qhb s PRO 587 Ca -0.06 0.92 -0.15 0.00 0.04 0.00 0.00 61.00 61.75 1qhb s PRO 587 Cb -0.19 -4.06 0.21 0.00 0.04 0.00 0.00 34.50 30.50 1qhb s PRO 587 CO -0.06 -1.67 1.15 0.15 0.04 0.00 0.00 177.00 176.61 1qhb s LYS 588 N 5.12 0.10 0.43 4.56 1.02 0.69 -4.96 119.74 126.71 1qhb s LYS 588 Ca 0.62 0.08 0.29 0.00 0.02 0.00 0.00 55.97 56.98 1qhb s LYS 588 Cb -0.14 -1.74 1.08 0.00 -0.52 0.00 0.00 37.83 36.51 1qhb s LYS 588 CO 0.32 -2.86 1.84 0.74 -0.92 0.00 0.00 175.35 174.47 1qhb h PHE 589 N -1.97 0.00 -0.26 3.18 0.04 -1.95 -2.59 116.94 113.39 1qhb h PHE 589 Ca -0.48 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.29 1qhb h PHE 589 Cb 1.30 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.45 1qhb h PHE 589 CO -0.80 0.00 0.00 -0.40 -0.60 0.00 0.00 178.31 176.51 1qhb n ASP 590 N -2.80 1.78 0.00 2.17 5.68 -1.26 -4.60 116.55 117.52 1qhb n ASP 590 Ca 0.02 -1.84 0.00 0.00 -0.50 0.00 0.00 54.79 52.47 1qhb n ASP 590 Cb 0.33 -0.17 0.00 0.00 -1.14 0.00 0.00 41.12 40.14 1qhb n ASP 590 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qhb n GLY 591 N 1.10 1.02 3.85 6.12 0.00 -0.98 -5.04 105.19 111.26 1qhb n GLY 591 Ca 0.14 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.95 1qhb n GLY 591 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qhb s THR 592 N -2.65 3.43 -0.00 2.61 -4.23 -1.26 -4.87 115.64 108.67 1qhb s THR 592 Ca 0.00 -1.38 0.05 0.00 -1.18 0.00 0.00 61.69 59.17 1qhb s THR 592 Cb 0.00 -3.16 -0.03 0.00 1.34 0.00 0.00 72.50 70.65 1qhb s THR 592 CO 0.00 -0.16 -0.13 -0.89 -0.54 0.00 0.00 174.62 172.90 1qhb s THR 593 N -2.33 3.14 0.04 3.99 2.01 -1.26 -0.22 115.64 121.01 1qhb s THR 593 Ca 0.41 -0.89 0.08 0.00 0.31 0.00 0.00 61.69 61.60 1qhb s THR 593 Cb -0.05 -2.30 -0.02 0.00 0.01 0.00 0.00 72.50 70.13 1qhb s THR 593 CO 0.26 0.45 -0.23 -0.51 -0.69 0.00 0.00 174.62 173.91 1qhb s ILE 594 N -0.87 1.82 -0.20 1.82 2.07 -0.52 -4.95 121.20 120.36 1qhb s ILE 594 Ca 0.14 -1.22 -0.02 0.00 -1.41 0.00 0.00 60.65 58.14 1qhb s ILE 594 Cb -0.11 -1.56 -0.00 0.00 0.13 0.00 0.00 42.46 40.92 1qhb s ILE 594 CO 0.04 0.29 -0.09 -1.10 -1.91 0.00 0.00 174.94 172.18 1qhb s GLN 595 N -1.10 3.29 0.00 3.50 -0.21 -1.26 -1.09 119.66 122.79 1qhb s GLN 595 Ca 0.09 -0.68 0.05 0.00 0.02 0.00 0.00 55.36 54.84 1qhb s GLN 595 Cb -0.09 -2.87 0.04 0.00 1.00 0.00 0.00 33.01 31.10 1qhb s GLN 595 CO 0.01 -0.16 0.67 -0.89 -2.12 0.00 0.00 175.29 172.81