#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qhx s PRO 7 N 0.00 3.06 -0.05 5.55 0.04 -1.26 -4.82 135.00 137.52 2qhx s PRO 7 Ca 0.00 1.13 0.06 0.00 0.04 0.00 0.00 61.00 62.23 2qhx s PRO 7 Cb 0.00 -2.00 -0.01 0.00 0.04 0.00 0.00 34.50 32.53 2qhx s PRO 7 CO 0.00 -1.02 -0.23 0.08 0.04 0.00 0.00 177.00 175.88 2qhx s VAL 8 N -2.68 1.86 -0.07 -0.36 1.01 -1.26 -0.96 120.40 117.93 2qhx s VAL 8 Ca 0.62 -0.96 0.05 0.00 0.00 0.00 0.00 61.98 61.69 2qhx s VAL 8 Cb -0.16 -1.58 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 2qhx s VAL 8 CO 0.45 0.52 -0.24 0.00 0.00 0.00 0.00 175.10 175.84 2qhx s ALA 9 N -0.11 2.22 -0.26 5.51 0.00 -0.08 -0.36 121.76 128.67 2qhx s ALA 9 Ca -0.03 -1.02 -0.09 0.00 0.00 0.00 0.00 51.96 50.82 2qhx s ALA 9 Cb -0.13 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 2qhx s ALA 9 CO 0.03 0.38 0.13 -1.17 0.00 0.00 0.00 175.76 175.14 2qhx s LEU 10 N -0.04 3.76 -0.22 0.00 2.96 0.67 -0.45 118.68 125.36 2qhx s LEU 10 Ca -0.07 -0.09 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 2qhx s LEU 10 Cb -0.15 -2.03 0.04 0.00 0.50 0.00 0.00 46.19 44.55 2qhx s LEU 10 CO 0.05 -0.03 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.21 2qhx s VAL 11 N 1.62 2.18 0.31 1.68 1.01 -0.83 -0.31 120.40 126.06 2qhx s VAL 11 Ca 0.07 -1.28 -0.23 0.00 0.00 0.00 0.00 61.98 60.53 2qhx s VAL 11 Cb -0.15 -2.11 -0.10 0.00 0.00 0.00 0.00 36.38 34.02 2qhx s VAL 11 CO 0.07 0.24 0.88 0.42 0.00 0.00 0.00 175.10 176.71 2qhx s THR 12 N 1.20 4.35 -1.24 3.92 -4.23 -0.89 -1.40 115.64 117.36 2qhx s THR 12 Ca -0.02 1.60 -0.01 0.00 -1.18 0.00 0.00 61.69 62.07 2qhx s THR 12 Cb -0.17 -3.89 -0.01 0.00 1.34 0.00 0.00 72.50 69.77 2qhx s THR 12 CO -0.08 0.08 0.84 0.61 -0.54 0.00 0.00 174.62 175.53 2qhx n GLY 13 N 0.39 -0.40 0.29 3.99 0.00 -1.11 -2.26 105.19 106.08 2qhx n GLY 13 Ca 0.02 0.16 0.13 0.00 0.00 0.00 0.00 46.02 46.32 2qhx n GLY 13 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qhx n ALA 14 N -4.13 3.10 -0.21 4.61 0.00 0.28 -4.15 120.51 120.00 2qhx n ALA 14 Ca -0.27 -0.43 -0.07 0.00 0.00 0.00 0.00 53.44 52.66 2qhx n ALA 14 Cb 0.67 -1.10 0.03 0.00 0.00 0.00 0.00 19.45 19.05 2qhx n ALA 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qhx h ALA 15 N 3.75 0.78 -2.94 0.00 0.00 -1.88 -2.54 119.26 116.42 2qhx h ALA 15 Ca 0.00 -0.15 -0.39 0.00 0.00 0.00 0.00 54.91 54.37 2qhx h ALA 15 Cb 0.54 -0.24 -0.10 0.00 0.00 0.00 0.00 17.79 17.99 2qhx h ALA 15 CO 0.00 0.36 -0.32 -1.59 0.00 0.00 0.00 179.25 177.70 2qhx s LYS 16 N -5.64 1.90 4.37 0.00 -2.85 -1.26 -4.48 119.74 111.78 2qhx s LYS 16 Ca -0.13 -1.93 0.00 0.00 -1.00 0.00 0.00 55.97 52.91 2qhx s LYS 16 Cb 0.13 0.39 0.00 0.00 -2.06 0.00 0.00 37.83 36.29 2qhx s LYS 16 CO 0.79 -0.75 0.00 0.54 0.10 0.00 0.00 175.35 176.03 2qhx n ARG 17 N -0.63 0.00 -0.17 1.78 1.74 -1.26 -2.27 116.66 115.86 2qhx n ARG 17 Ca 0.04 0.00 -0.11 0.00 -0.77 0.00 0.00 57.85 57.02 2qhx n ARG 17 Cb 0.62 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 32.06 2qhx n ARG 17 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2qhx h LEU 18 N 0.00 0.93 -0.69 0.55 3.38 -1.92 -2.38 115.31 115.17 2qhx h LEU 18 Ca 0.00 -0.35 0.04 0.00 0.09 0.00 0.00 57.88 57.65 2qhx h LEU 18 Cb 0.00 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 40.45 2qhx h LEU 18 CO 0.00 1.06 0.42 1.23 0.09 0.00 0.00 178.44 181.25 2qhx h GLY 19 N 0.78 1.00 0.96 0.83 0.00 -1.67 0.12 103.07 105.09 2qhx h GLY 19 Ca 0.13 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.13 2qhx h GLY 19 CO 0.04 0.25 0.20 -0.09 0.00 0.00 0.00 176.54 176.94 2qhx h ARG 20 N 0.82 0.53 -0.73 4.80 2.43 -1.00 0.31 114.38 121.54 2qhx h ARG 20 Ca 0.29 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.36 2qhx h ARG 20 Cb 0.06 -0.10 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 2qhx h ARG 20 CO -0.13 0.45 0.36 1.03 -1.51 0.00 0.00 179.97 180.17 2qhx h SER 21 N 0.48 0.93 -0.21 -3.80 0.87 -0.89 0.26 113.55 111.19 2qhx h SER 21 Ca 0.13 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.57 2qhx h SER 21 Cb 0.08 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.79 2qhx h SER 21 CO -0.02 0.78 0.02 0.40 -0.53 0.00 0.00 176.83 177.48 2qhx h ILE 22 N 1.03 1.24 -0.58 2.23 2.04 -0.54 0.67 117.51 123.61 2qhx h ILE 22 Ca 0.25 -0.81 0.02 0.00 1.00 0.00 0.00 64.86 65.32 2qhx h ILE 22 Cb 0.09 1.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 2qhx h ILE 22 CO -0.03 0.25 0.36 0.00 0.00 0.00 0.00 178.15 178.73 2qhx h ALA 23 N 0.81 0.74 -0.40 1.87 0.00 -0.44 -0.64 119.26 121.21 2qhx h ALA 23 Ca 0.06 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 2qhx h ALA 23 Cb 0.36 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2qhx h ALA 23 CO 0.01 0.11 0.07 0.93 0.00 0.00 0.00 179.25 180.38 2qhx h GLU 24 N 0.73 0.65 -0.54 0.00 5.08 -0.42 -0.86 114.58 119.21 2qhx h GLU 24 Ca 0.22 -0.17 -0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2qhx h GLU 24 Cb -0.02 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.12 2qhx h GLU 24 CO -0.08 0.69 0.33 0.78 -1.00 0.00 0.00 179.01 179.74 2qhx h GLY 25 N 0.50 0.78 1.04 -3.84 0.00 -0.59 -0.17 103.07 100.79 2qhx h GLY 25 Ca 0.12 -0.32 -0.10 0.00 0.00 0.00 0.00 47.33 47.04 2qhx h GLY 25 CO 0.01 0.31 -0.06 1.41 0.00 0.00 0.00 176.54 178.21 2qhx h LEU 26 N 0.73 0.92 -1.23 3.11 3.38 -1.07 -2.94 115.31 118.21 2qhx h LEU 26 Ca 0.20 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2qhx h LEU 26 Cb -0.03 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.44 2qhx h LEU 26 CO -0.04 1.04 0.23 -0.74 0.09 0.00 0.00 178.44 179.02 2qhx h HIS 27 N 0.79 0.76 0.00 1.13 2.76 -0.89 -1.70 115.15 117.99 2qhx h HIS 27 Ca 0.13 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.27 2qhx h HIS 27 Cb 0.60 -0.24 0.00 0.00 1.55 0.00 0.00 27.41 29.32 2qhx h HIS 27 CO 0.04 0.58 0.00 0.00 -1.30 0.00 0.00 177.93 177.25 2qhx h ALA 28 N 1.50 1.00 -0.02 5.26 0.00 -0.86 -1.25 119.26 124.88 2qhx h ALA 28 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.10 2qhx h ALA 28 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2qhx h ALA 28 CO -0.02 0.00 -0.09 0.39 0.00 0.00 0.00 179.25 179.53 2qhx n GLU 29 N -2.80 1.76 0.00 0.00 -0.58 -0.68 -4.94 120.64 113.40 2qhx n GLU 29 Ca 0.00 -1.27 0.00 0.00 -0.42 0.00 0.00 57.16 55.47 2qhx n GLU 29 Cb 0.24 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 2qhx n GLU 29 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2qhx n GLY 30 N 1.29 0.67 3.76 0.62 0.00 -0.47 -5.09 105.19 105.97 2qhx n GLY 30 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.77 2qhx n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qhx s TYR 31 N -2.00 3.19 0.30 1.61 1.51 -0.95 -4.57 117.35 116.44 2qhx s TYR 31 Ca 0.00 1.45 -0.28 0.00 -1.01 0.00 0.00 57.07 57.24 2qhx s TYR 31 Cb 0.00 -3.59 -0.09 0.00 -0.11 0.00 0.00 41.96 38.17 2qhx s TYR 31 CO 0.00 -1.58 0.98 0.00 -1.11 0.00 0.00 175.55 173.84 2qhx s ALA 32 N -1.00 3.27 -0.08 3.71 0.00 -0.13 -4.24 121.76 123.28 2qhx s ALA 32 Ca 0.49 0.64 0.02 0.00 0.00 0.00 0.00 51.96 53.11 2qhx s ALA 32 Cb -0.38 -3.23 0.01 0.00 0.00 0.00 0.00 23.12 19.53 2qhx s ALA 32 CO 0.49 0.08 -0.13 0.08 0.00 0.00 0.00 175.76 176.28 2qhx s VAL 33 N -1.41 1.22 -0.37 0.00 1.01 0.21 -0.90 120.40 120.16 2qhx s VAL 33 Ca 0.47 -0.50 -0.18 0.00 0.00 0.00 0.00 61.98 61.77 2qhx s VAL 33 Cb -0.24 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.02 2qhx s VAL 33 CO 0.30 0.38 0.50 0.00 0.00 0.00 0.00 175.10 176.28 2qhx s LEU 35 N 2.37 5.28 0.33 0.00 1.43 0.13 -1.97 118.68 126.25 2qhx s LEU 35 Ca 0.17 -1.26 -0.26 0.00 -1.03 0.00 0.00 54.13 51.75 2qhx s LEU 35 Cb -0.16 -2.34 -0.09 0.00 0.03 0.00 0.00 46.19 43.63 2qhx s LEU 35 CO 0.14 -1.01 1.01 -2.28 0.23 0.00 0.00 176.35 174.43 2qhx s HIS 36 N 2.59 3.57 0.07 0.29 5.65 -0.49 -1.87 115.29 125.10 2qhx s HIS 36 Ca 0.12 1.74 -0.06 0.00 0.25 0.00 0.00 55.06 57.11 2qhx s HIS 36 Cb -0.23 -3.06 -0.01 0.00 -1.18 0.00 0.00 32.58 28.10 2qhx s HIS 36 CO 0.08 -0.17 0.12 1.52 -0.65 0.00 0.00 174.74 175.65 2qhx s TYR 37 N -1.50 0.25 -0.00 3.88 -0.85 -0.42 -0.56 117.35 118.15 2qhx s TYR 37 Ca 0.50 -0.69 -0.00 0.00 -0.52 0.00 0.00 57.07 56.36 2qhx s TYR 37 Cb -0.23 -0.15 -0.00 0.00 0.38 0.00 0.00 41.96 41.96 2qhx s TYR 37 CO 0.29 -0.48 -0.01 1.58 -1.52 0.00 0.00 175.55 175.41 2qhx n HIS 38 N 0.09 0.00 0.27 -3.49 -0.00 -1.26 -1.55 115.22 109.29 2qhx n HIS 38 Ca -0.15 0.00 0.07 0.00 -0.00 0.00 0.00 57.72 57.64 2qhx n HIS 38 Cb 0.62 -0.01 -0.10 0.00 -0.00 0.00 0.00 29.99 30.49 2qhx n HIS 38 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2qhx n ARG 39 N -2.56 1.15 -2.39 1.57 1.74 -1.26 -4.74 116.66 110.17 2qhx n ARG 39 Ca -0.00 -0.08 -0.41 0.00 -0.77 0.00 0.00 57.85 56.58 2qhx n ARG 39 Cb 0.01 -1.29 0.01 0.00 -1.02 0.00 0.00 32.46 30.17 2qhx n ARG 39 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2qhx n SER 40 N -1.75 7.02 -0.01 0.55 7.64 -1.26 -4.75 113.62 121.06 2qhx n SER 40 Ca -0.01 -3.32 -0.12 0.00 1.01 0.00 0.00 58.87 56.44 2qhx n SER 40 Cb 0.33 -1.32 -0.07 0.00 -1.01 0.00 0.00 64.21 62.14 2qhx n SER 40 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qhx h ALA 41 N 4.86 0.09 -0.03 -0.43 0.00 -1.96 -1.98 119.26 119.80 2qhx h ALA 41 Ca 0.52 -0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.36 2qhx h ALA 41 Cb 0.42 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.13 2qhx h ALA 41 CO 1.41 -0.31 -0.33 0.00 0.00 0.00 0.00 179.25 180.02 2qhx h ALA 42 N 0.84 -0.46 -0.58 0.00 0.00 -1.99 0.29 119.26 117.36 2qhx h ALA 42 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2qhx h ALA 42 Cb 0.19 0.59 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 2qhx h ALA 42 CO -0.00 -0.84 0.33 0.93 0.00 0.00 0.00 179.25 179.67 2qhx h GLU 43 N -0.46 0.79 0.15 0.00 3.07 -1.90 0.11 114.58 116.34 2qhx h GLU 43 Ca 0.07 -0.08 -0.01 0.00 -0.50 0.00 0.00 59.36 58.84 2qhx h GLU 43 Cb 0.57 -0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 2qhx h GLU 43 CO -0.29 0.59 -0.07 0.00 -1.40 0.00 0.00 179.01 177.84 2qhx h ALA 44 N 1.15 -0.21 -0.59 3.43 0.00 -1.13 -1.14 119.26 120.78 2qhx h ALA 44 Ca 0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2qhx h ALA 44 Cb 0.02 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.86 2qhx h ALA 44 CO -0.03 -0.58 0.36 -0.91 0.00 0.00 0.00 179.25 178.09 2qhx h ASN 45 N -0.28 0.69 -0.54 0.00 2.35 -0.75 0.18 115.58 117.23 2qhx h ASN 45 Ca -0.02 -0.03 -0.06 0.00 -0.55 0.00 0.00 56.30 55.64 2qhx h ASN 45 Cb 0.22 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 2qhx h ASN 45 CO 0.03 0.53 0.11 0.00 -1.65 0.00 0.00 177.43 176.46 2qhx h ALA 46 N 1.59 0.71 -0.62 -0.83 0.00 -0.81 -1.06 119.26 118.25 2qhx h ALA 46 Ca 0.21 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2qhx h ALA 46 Cb -0.04 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 2qhx h ALA 46 CO -0.04 0.43 0.12 1.25 0.00 0.00 0.00 179.25 181.01 2qhx h LEU 47 N 0.77 0.97 -0.83 0.00 5.85 -0.69 -2.30 115.31 119.07 2qhx h LEU 47 Ca 0.17 -0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2qhx h LEU 47 Cb 0.37 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 2qhx h LEU 47 CO 0.01 0.97 0.50 -1.28 -0.34 0.00 0.00 178.44 178.29 2qhx h SER 48 N 0.93 1.01 -0.18 1.25 0.87 -0.77 -2.10 113.55 114.57 2qhx h SER 48 Ca 0.19 -0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.68 2qhx h SER 48 Cb 0.40 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.10 2qhx h SER 48 CO 0.01 0.78 0.10 0.00 -0.53 0.00 0.00 176.83 177.20 2qhx h ALA 49 N 1.27 0.22 -0.38 6.23 0.00 -0.95 0.48 119.26 126.12 2qhx h ALA 49 Ca 0.30 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.23 2qhx h ALA 49 Cb -0.03 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2qhx h ALA 49 CO -0.05 -0.31 0.20 1.15 0.00 0.00 0.00 179.25 180.23 2qhx h THR 50 N 0.22 0.99 -0.34 0.00 2.02 -1.19 -0.72 112.91 113.89 2qhx h THR 50 Ca 0.07 -0.14 -0.16 0.00 0.77 0.00 0.00 66.41 66.94 2qhx h THR 50 Cb -0.01 0.55 -0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2qhx h THR 50 CO -0.03 0.07 -0.43 -0.07 0.37 0.00 0.00 175.52 175.43 2qhx h LEU 51 N 0.40 0.97 -1.30 2.58 3.38 -1.15 -2.27 115.31 117.92 2qhx h LEU 51 Ca 0.16 -0.49 -0.07 0.00 0.09 0.00 0.00 57.88 57.57 2qhx h LEU 51 Cb 0.06 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2qhx h LEU 51 CO -0.10 1.27 -0.25 0.78 0.09 0.00 0.00 178.44 180.22 2qhx h ASN 52 N 0.69 0.15 -0.53 -0.43 2.35 -0.76 -1.69 115.58 115.35 2qhx h ASN 52 Ca 0.04 -0.04 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 2qhx h ASN 52 Cb 1.03 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 39.34 2qhx h ASN 52 CO 0.10 0.41 0.07 0.00 -1.65 0.00 0.00 177.43 176.36 2qhx h ALA 53 N 1.61 0.71 -0.47 -0.83 0.00 -0.92 -2.45 119.26 116.91 2qhx h ALA 53 Ca 0.02 -0.25 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 2qhx h ALA 53 Cb 0.53 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2qhx h ALA 53 CO 0.04 0.47 -0.09 0.00 0.00 0.00 0.00 179.25 179.67 2qhx h ARG 54 N 0.78 0.85 -1.78 0.00 3.08 -1.12 -3.42 114.38 112.76 2qhx h ARG 54 Ca 0.16 -0.28 -0.15 0.00 0.07 0.00 0.00 59.98 59.78 2qhx h ARG 54 Cb 0.43 -0.07 -0.29 0.00 0.08 0.00 0.00 29.97 30.12 2qhx h ARG 54 CO 0.01 0.91 -0.49 0.50 -1.07 0.00 0.00 179.97 179.83 2qhx s ARG 55 N -4.84 0.38 0.34 0.04 3.52 -0.66 -5.12 118.95 112.61 2qhx s ARG 55 Ca -0.10 0.43 -0.28 0.00 -0.13 0.00 0.00 55.73 55.65 2qhx s ARG 55 Cb 0.14 -0.37 -0.12 0.00 -1.56 0.00 0.00 34.95 33.04 2qhx s ARG 55 CO 0.83 -0.77 1.27 -2.30 -0.81 0.00 0.00 175.30 173.53 2qhx n PRO 56 N 5.36 2.08 -3.66 5.12 -0.02 -0.93 -2.93 135.00 140.01 2qhx n PRO 56 Ca -0.02 0.73 -0.24 0.00 -2.02 0.00 0.00 63.50 61.95 2qhx n PRO 56 Cb 0.50 -2.30 0.06 0.00 -0.02 0.00 0.00 33.50 31.74 2qhx n PRO 56 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2qhx n ASN 57 N 0.76 -4.66 -0.17 2.55 5.15 -1.26 -4.92 115.26 112.71 2qhx n ASN 57 Ca 0.05 -0.65 0.02 0.00 -0.60 0.00 0.00 54.58 53.40 2qhx n ASN 57 Cb 0.36 -4.64 0.03 0.00 -0.53 0.00 0.00 39.78 35.00 2qhx n ASN 57 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2qhx n SER 58 N -2.99 1.88 -3.70 1.20 3.41 -1.15 -4.96 113.62 107.30 2qhx n SER 58 Ca -0.07 -1.65 -0.13 0.00 -0.26 0.00 0.00 58.87 56.76 2qhx n SER 58 Cb 0.58 -0.04 -0.09 0.00 -0.26 0.00 0.00 64.21 64.40 2qhx n SER 58 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2qhx s ALA 59 N -0.71 -1.23 0.16 7.33 0.00 -1.26 -0.62 121.76 125.42 2qhx s ALA 59 Ca 0.06 1.44 0.01 0.00 0.00 0.00 0.00 51.96 53.47 2qhx s ALA 59 Cb 0.03 -0.84 -0.04 0.00 0.00 0.00 0.00 23.12 22.27 2qhx s ALA 59 CO 0.05 -0.24 0.02 0.96 0.00 0.00 0.00 175.76 176.55 2qhx s ILE 60 N 0.40 0.45 0.01 0.00 -4.36 -0.79 -4.89 121.20 112.00 2qhx s ILE 60 Ca -0.01 -1.95 0.07 0.00 -0.26 0.00 0.00 60.65 58.50 2qhx s ILE 60 Cb -0.04 -2.09 -0.02 0.00 1.25 0.00 0.00 42.46 41.56 2qhx s ILE 60 CO -0.01 -0.47 -0.21 0.42 0.24 0.00 0.00 174.94 174.91 2qhx s THR 61 N -3.81 1.67 -0.01 8.37 -4.23 -1.26 0.17 115.64 116.54 2qhx s THR 61 Ca 0.24 -1.00 0.02 0.00 -1.18 0.00 0.00 61.69 59.76 2qhx s THR 61 Cb 0.07 -1.41 -0.00 0.00 1.34 0.00 0.00 72.50 72.50 2qhx s THR 61 CO 0.03 0.38 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.74 2qhx s VAL 62 N -0.60 0.48 -0.16 2.29 1.01 -0.78 -4.92 120.40 117.72 2qhx s VAL 62 Ca 0.08 -0.23 -0.08 0.00 0.00 0.00 0.00 61.98 61.75 2qhx s VAL 62 Cb -0.08 -0.42 -0.04 0.00 0.00 0.00 0.00 36.38 35.83 2qhx s VAL 62 CO 0.00 0.15 0.12 -1.58 0.00 0.00 0.00 175.10 173.79 2qhx s GLN 63 N 0.02 3.77 -0.28 2.72 -0.44 -1.26 -1.29 119.66 122.90 2qhx s GLN 63 Ca 0.00 -0.20 -0.21 0.00 -2.50 0.00 0.00 55.36 52.45 2qhx s GLN 63 Cb -0.04 -3.26 0.09 0.00 -1.64 0.00 0.00 33.01 28.16 2qhx s GLN 63 CO -0.00 0.53 0.80 0.00 0.50 0.00 0.00 175.29 177.12 2qhx s ALA 64 N -0.33 -1.91 -0.25 1.58 0.00 -0.59 -4.96 121.76 115.29 2qhx s ALA 64 Ca 0.11 2.17 -0.26 0.00 0.00 0.00 0.00 51.96 53.98 2qhx s ALA 64 Cb -0.12 -1.38 0.00 0.00 0.00 0.00 0.00 23.12 21.62 2qhx s ALA 64 CO 0.01 -0.34 0.88 0.34 0.00 0.00 0.00 175.76 176.66 2qhx s ASP 65 N 0.92 6.87 0.00 0.00 2.15 -1.26 -4.27 116.67 121.08 2qhx s ASP 65 Ca -0.04 1.06 0.21 0.00 0.43 0.00 0.00 52.55 54.21 2qhx s ASP 65 Cb -0.05 -2.46 0.57 0.00 -0.30 0.00 0.00 42.92 40.68 2qhx s ASP 65 CO -0.10 -0.59 1.48 0.18 -0.17 0.00 0.00 175.17 175.98 2qhx n LEU 66 N 6.16 3.51 -4.77 -1.34 4.77 -1.26 -4.93 117.00 119.14 2qhx n LEU 66 Ca 0.07 -1.71 -0.36 0.00 -0.03 0.00 0.00 56.01 53.98 2qhx n LEU 66 Cb 0.47 -0.40 0.00 0.00 -2.33 0.00 0.00 43.42 41.16 2qhx n LEU 66 CO 0.49 0.85 0.82 -0.55 -1.33 0.00 0.00 177.39 177.68 2qhx s SER 67 N -1.11 5.78 -1.16 -1.43 0.15 -1.26 -2.58 113.70 112.08 2qhx s SER 67 Ca 0.43 2.28 -0.08 0.00 0.70 0.00 0.00 55.95 59.29 2qhx s SER 67 Cb 0.23 -2.59 -0.09 0.00 -1.71 0.00 0.00 66.02 61.86 2qhx s SER 67 CO 0.31 -1.19 2.60 -3.20 1.20 0.00 0.00 173.24 172.96 2qhx n ASN 68 N -1.04 6.68 -4.19 5.45 5.15 0.03 -4.78 115.26 122.55 2qhx n ASN 68 Ca 0.10 -2.43 -0.15 0.00 -0.60 0.00 0.00 54.58 51.50 2qhx n ASN 68 Cb 0.49 -1.32 -0.11 0.00 -0.53 0.00 0.00 39.78 38.32 2qhx n ASN 68 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2qhx s VAL 69 N 2.63 1.04 0.30 3.44 -7.23 -1.26 -4.89 120.40 114.43 2qhx s VAL 69 Ca 0.55 -1.67 -0.28 0.00 -1.81 0.00 0.00 61.98 58.77 2qhx s VAL 69 Cb 0.15 -1.42 -0.09 0.00 0.56 0.00 0.00 36.38 35.58 2qhx s VAL 69 CO -0.04 -0.53 1.03 0.00 -0.31 0.00 0.00 175.10 175.24 2qhx s ALA 70 N -2.40 3.30 0.38 1.32 0.00 -1.26 -3.69 121.76 119.41 2qhx s ALA 70 Ca 0.07 0.73 0.08 0.00 0.00 0.00 0.00 51.96 52.84 2qhx s ALA 70 Cb -0.03 -3.27 -0.06 0.00 0.00 0.00 0.00 23.12 19.77 2qhx s ALA 70 CO 0.01 -0.03 0.10 0.95 0.00 0.00 0.00 175.76 176.79 2qhx s THR 71 N -1.33 2.45 0.30 0.00 -4.23 0.17 -4.88 115.64 108.11 2qhx s THR 71 Ca 0.47 -1.83 -0.29 0.00 -1.18 0.00 0.00 61.69 58.87 2qhx s THR 71 Cb -0.27 -2.93 -0.09 0.00 1.34 0.00 0.00 72.50 70.55 2qhx s THR 71 CO 0.34 -0.09 1.11 0.00 -0.54 0.00 0.00 174.62 175.44 2qhx s ALA 72 N -2.57 3.37 0.00 3.99 0.00 -1.26 0.14 121.76 125.43 2qhx s ALA 72 Ca 0.38 0.91 0.00 0.00 0.00 0.00 0.00 51.96 53.25 2qhx s ALA 72 Cb 0.03 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.81 2qhx s ALA 72 CO 0.21 -0.22 0.00 -0.35 0.00 0.00 0.00 175.76 175.40 2qhx n PRO 73 N 0.97 0.00 0.00 0.00 -0.04 -1.26 -4.71 135.00 129.97 2qhx n PRO 73 Ca -0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2qhx n PRO 73 Cb 0.45 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.91 2qhx n PRO 73 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2qhx n ALA 81 N -3.00 -0.14 -1.66 0.55 0.00 -1.26 -5.08 120.51 109.93 2qhx n ALA 81 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.10 2qhx n ALA 81 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 2qhx n ALA 81 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2qhx s PRO 82 N 0.00 3.18 -0.23 0.00 0.02 -1.26 -5.01 135.00 131.69 2qhx s PRO 82 Ca 0.00 1.45 -0.14 0.00 0.02 0.00 0.00 61.00 62.32 2qhx s PRO 82 Cb 0.00 -2.00 -0.04 0.00 0.02 0.00 0.00 34.50 32.48 2qhx s PRO 82 CO 0.00 -0.96 0.34 0.08 -0.33 0.00 0.00 177.00 176.13 2qhx s VAL 83 N -2.10 5.23 0.66 3.83 1.01 0.12 -4.86 120.40 124.28 2qhx s VAL 83 Ca 0.69 0.55 -0.11 0.00 0.00 0.00 0.00 61.98 63.11 2qhx s VAL 83 Cb -0.21 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 2qhx s VAL 83 CO 0.33 0.24 1.05 0.42 0.00 0.00 0.00 175.10 177.15 2qhx s THR 84 N 1.49 4.01 0.21 3.92 -4.23 -1.26 0.43 115.64 120.21 2qhx s THR 84 Ca 0.15 0.61 -0.09 0.00 -1.18 0.00 0.00 61.69 61.18 2qhx s THR 84 Cb -0.15 -3.64 0.15 0.00 1.34 0.00 0.00 72.50 70.20 2qhx s THR 84 CO 0.08 -0.83 1.84 0.25 -0.54 0.00 0.00 174.62 175.41 2qhx h LEU 85 N -0.48 0.70 -0.16 4.79 5.85 -1.86 -2.13 115.31 122.02 2qhx h LEU 85 Ca -0.45 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.33 2qhx h LEU 85 Cb 1.23 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.07 2qhx h LEU 85 CO 0.63 0.47 -0.14 0.15 -0.34 0.00 0.00 178.44 179.21 2qhx h PHE 86 N 0.83 -0.36 -0.55 1.25 3.57 -1.93 0.49 116.94 120.23 2qhx h PHE 86 Ca 0.29 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.89 2qhx h PHE 86 Cb 0.07 0.18 -0.06 0.00 2.79 0.00 0.00 35.95 38.93 2qhx h PHE 86 CO -0.05 -0.21 0.21 1.15 -2.23 0.00 0.00 178.31 177.19 2qhx h THR 87 N -0.16 0.82 -0.76 4.41 2.02 -1.88 0.10 112.91 117.46 2qhx h THR 87 Ca 0.10 -0.14 -0.02 0.00 0.77 0.00 0.00 66.41 67.13 2qhx h THR 87 Cb 0.31 0.38 -0.04 0.00 -1.74 0.00 0.00 68.15 67.07 2qhx h THR 87 CO -0.25 0.07 0.40 0.03 0.37 0.00 0.00 175.52 176.15 2qhx h ARG 88 N 0.40 1.06 -0.37 6.66 3.08 -0.73 -1.48 114.38 123.01 2qhx h ARG 88 Ca 0.27 -0.12 -0.07 0.00 0.07 0.00 0.00 59.98 60.12 2qhx h ARG 88 Cb 0.30 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2qhx h ARG 88 CO -0.26 0.79 -0.06 0.00 -1.07 0.00 0.00 179.97 179.37 2qhx h ALA 90 N 0.84 1.46 -0.12 0.00 0.00 -0.52 -2.37 119.26 118.54 2qhx h ALA 90 Ca 0.10 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 2qhx h ALA 90 Cb 0.56 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2qhx h ALA 90 CO 0.03 0.50 -0.36 0.93 0.00 0.00 0.00 179.25 180.35 2qhx h GLU 91 N 1.01 0.25 -0.18 0.00 5.08 -1.16 0.44 114.58 120.02 2qhx h GLU 91 Ca 0.27 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2qhx h GLU 91 Cb -0.11 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2qhx h GLU 91 CO -0.06 0.58 0.11 -0.07 -1.00 0.00 0.00 179.01 178.58 2qhx h LEU 92 N 0.22 0.22 -0.17 1.33 3.38 -1.11 0.43 115.31 119.61 2qhx h LEU 92 Ca 0.02 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2qhx h LEU 92 Cb 0.74 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 2qhx h LEU 92 CO 0.06 0.20 0.01 0.58 0.09 0.00 0.00 178.44 179.37 2qhx h VAL 93 N 0.22 1.25 -0.98 1.22 2.07 -1.34 -3.03 116.25 115.66 2qhx h VAL 93 Ca 0.07 -0.82 0.18 0.00 0.82 0.00 0.00 66.70 66.95 2qhx h VAL 93 Cb 0.02 1.46 -0.09 0.00 -1.52 0.00 0.00 31.29 31.15 2qhx h VAL 93 CO -0.01 0.24 0.61 0.00 0.02 0.00 0.00 177.57 178.44 2qhx h ALA 94 N 0.78 1.75 -0.53 1.67 0.00 -0.79 -1.47 119.26 120.68 2qhx h ALA 94 Ca 0.05 0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.05 2qhx h ALA 94 Cb 0.36 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2qhx h ALA 94 CO 0.01 -0.09 0.35 0.00 0.00 0.00 0.00 179.25 179.52 2qhx h ALA 95 N 1.62 1.77 -0.32 0.00 0.00 -0.78 0.22 119.26 121.78 2qhx h ALA 95 Ca 0.54 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.33 2qhx h ALA 95 Cb 0.88 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 2qhx h ALA 95 CO -0.32 0.16 -0.18 0.00 0.00 0.00 0.00 179.25 178.91 2qhx h TYR 97 N 0.45 0.69 -0.64 0.00 -1.99 -1.12 -0.30 116.97 114.06 2qhx h TYR 97 Ca 0.07 -0.19 0.04 0.00 2.00 0.00 0.00 58.73 60.65 2qhx h TYR 97 Cb 0.72 -0.15 -0.05 0.00 2.00 0.00 0.00 36.73 39.26 2qhx h TYR 97 CO 0.06 0.88 0.37 1.15 -0.00 0.00 0.00 178.16 180.62 2qhx h THR 98 N 0.30 1.01 0.21 -2.88 2.02 -0.68 0.27 112.91 113.16 2qhx h THR 98 Ca 0.05 -0.24 -0.34 0.00 0.77 0.00 0.00 66.41 66.65 2qhx h THR 98 Cb 0.74 0.25 0.02 0.00 -1.74 0.00 0.00 68.15 67.42 2qhx h THR 98 CO 0.05 0.13 -1.58 -0.74 0.37 0.00 0.00 175.52 173.75 2qhx h HIS 99 N 0.70 0.79 0.00 3.16 -0.00 -1.36 -3.41 115.15 115.04 2qhx h HIS 99 Ca 0.27 -0.58 0.00 0.00 -0.00 0.00 0.00 60.37 60.07 2qhx h HIS 99 Cb 0.11 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 27.49 2qhx h HIS 99 CO -0.07 1.57 0.00 0.91 -0.00 0.00 0.00 177.93 180.34 2qhx n TRP 100 N -3.62 0.00 -0.98 5.26 8.01 -0.14 -5.03 117.44 120.95 2qhx n TRP 100 Ca -0.19 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.00 2qhx n TRP 100 Cb 1.08 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 30.38 2qhx n TRP 100 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2qhx n GLY 101 N 0.26 0.57 3.58 6.99 0.00 0.96 -4.97 105.19 112.59 2qhx n GLY 101 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2qhx n GLY 101 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qhx s ARG 102 N -0.24 1.45 -0.23 1.61 1.70 -1.25 -4.89 118.95 117.11 2qhx s ARG 102 Ca 0.00 -0.65 -0.03 0.00 -0.47 0.00 0.00 55.73 54.57 2qhx s ARG 102 Cb 0.00 0.59 0.12 0.00 -0.57 0.00 0.00 34.95 35.09 2qhx s ARG 102 CO 0.00 -0.65 0.33 0.00 -1.08 0.00 0.00 175.30 173.90 2qhx n ASP 104 N 5.35 0.64 -4.06 0.00 8.00 0.51 -4.95 116.55 122.05 2qhx n ASP 104 Ca -0.04 -0.04 -0.22 0.00 0.71 0.00 0.00 54.79 55.20 2qhx n ASP 104 Cb 0.50 0.54 -0.15 0.00 -0.02 0.00 0.00 41.12 41.98 2qhx n ASP 104 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2qhx s VAL 105 N -2.50 1.00 -0.12 2.53 1.01 -0.63 -1.65 120.40 120.04 2qhx s VAL 105 Ca -0.18 -0.50 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2qhx s VAL 105 Cb 0.07 -0.87 0.01 0.00 0.00 0.00 0.00 36.38 35.59 2qhx s VAL 105 CO 0.76 0.30 -0.18 -0.22 0.00 0.00 0.00 175.10 175.76 2qhx s LEU 106 N 0.03 1.85 -0.32 3.92 2.96 -0.61 -0.24 118.68 126.27 2qhx s LEU 106 Ca -0.01 -0.48 -0.02 0.00 -0.22 0.00 0.00 54.13 53.40 2qhx s LEU 106 Cb -0.08 -1.21 0.07 0.00 0.50 0.00 0.00 46.19 45.47 2qhx s LEU 106 CO 0.01 0.04 0.04 -0.69 -1.32 0.00 0.00 176.35 174.43 2qhx s VAL 107 N 0.89 2.99 -0.96 1.68 1.01 0.58 -0.47 120.40 126.13 2qhx s VAL 107 Ca -0.08 -1.59 -0.24 0.00 0.00 0.00 0.00 61.98 60.08 2qhx s VAL 107 Cb -0.15 -2.82 0.04 0.00 0.00 0.00 0.00 36.38 33.44 2qhx s VAL 107 CO -0.01 -0.26 1.46 0.20 0.00 0.00 0.00 175.10 176.49 2qhx s ASN 108 N 1.35 6.33 -0.10 3.32 0.01 0.57 -2.09 114.94 124.33 2qhx s ASN 108 Ca -0.01 -1.20 0.03 0.00 -0.71 0.00 0.00 52.86 50.96 2qhx s ASN 108 Cb -0.20 -2.57 -0.08 0.00 0.41 0.00 0.00 41.25 38.81 2qhx s ASN 108 CO -0.02 -1.66 -0.06 -3.20 -1.51 0.00 0.00 177.10 170.65 2qhx n ASN 109 N 9.37 3.14 -4.63 -1.22 5.15 -1.25 -0.86 115.26 124.96 2qhx n ASN 109 Ca 0.28 -0.04 -0.46 0.00 -0.60 0.00 0.00 54.58 53.76 2qhx n ASN 109 Cb 0.50 0.10 -0.03 0.00 -0.53 0.00 0.00 39.78 39.82 2qhx n ASN 109 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2qhx n ALA 110 N -2.65 0.36 -3.54 5.20 0.00 -0.96 -4.88 120.51 114.04 2qhx n ALA 110 Ca -0.17 0.42 -0.01 0.00 0.00 0.00 0.00 53.44 53.69 2qhx n ALA 110 Cb 0.71 -2.16 -0.05 0.00 0.00 0.00 0.00 19.45 17.95 2qhx n ALA 110 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2qhx s SER 111 N 0.07 -0.70 0.38 0.00 0.15 -1.26 -4.40 113.70 107.95 2qhx s SER 111 Ca 0.68 1.01 -0.08 0.00 0.70 0.00 0.00 55.95 58.26 2qhx s SER 111 Cb -0.72 1.63 -0.06 0.00 -1.71 0.00 0.00 66.02 65.16 2qhx s SER 111 CO 0.52 -0.15 0.71 -0.94 1.20 0.00 0.00 173.24 174.59 2qhx s SER 112 N 2.15 6.47 -0.29 5.45 1.04 -1.26 -5.04 113.70 122.21 2qhx s SER 112 Ca -0.06 0.99 0.03 0.00 0.48 0.00 0.00 55.95 57.40 2qhx s SER 112 Cb -0.06 -2.26 0.20 0.00 0.10 0.00 0.00 66.02 63.99 2qhx s SER 112 CO -0.17 -0.37 0.60 0.12 0.98 0.00 0.00 173.24 174.40 2qhx s PHE 113 N -2.35 -1.75 0.11 5.02 5.36 -1.26 -4.88 117.98 118.23 2qhx s PHE 113 Ca 0.49 1.31 -0.25 0.00 -0.96 0.00 0.00 56.93 57.51 2qhx s PHE 113 Cb -0.10 0.41 0.08 0.00 -0.34 0.00 0.00 43.02 43.06 2qhx s PHE 113 CO 0.33 -1.00 0.74 1.52 -1.46 0.00 0.00 175.22 175.35 2qhx s TYR 114 N 2.84 -0.41 0.34 10.12 -0.85 -1.26 -5.15 117.35 122.98 2qhx s TYR 114 Ca 0.14 0.20 -0.29 0.00 -0.52 0.00 0.00 57.07 56.61 2qhx s TYR 114 Cb -0.12 0.57 -0.11 0.00 0.38 0.00 0.00 41.96 42.68 2qhx s TYR 114 CO -0.24 -0.77 1.51 -2.14 -1.52 0.00 0.00 175.55 172.39 2qhx s PRO 115 N -3.50 4.13 -0.56 -3.49 0.02 -1.26 -4.77 135.00 125.57 2qhx s PRO 115 Ca 0.04 2.54 0.04 0.00 0.02 0.00 0.00 61.00 63.65 2qhx s PRO 115 Cb -0.01 -3.00 0.17 0.00 0.02 0.00 0.00 34.50 31.68 2qhx s PRO 115 CO -0.09 -0.54 0.41 0.95 -0.33 0.00 0.00 177.00 177.41 2qhx s THR 116 N -0.74 1.64 0.44 0.99 -4.23 0.79 -4.98 115.64 109.54 2qhx s THR 116 Ca 0.56 -3.46 -0.24 0.00 -1.18 0.00 0.00 61.69 57.37 2qhx s THR 116 Cb -0.46 -2.09 -0.08 0.00 1.34 0.00 0.00 72.50 71.21 2qhx s THR 116 CO 0.57 -1.11 1.22 -2.84 -0.54 0.00 0.00 174.62 171.92 2qhx s PRO 117 N -0.69 3.80 0.23 3.99 0.02 -1.19 -4.09 135.00 137.08 2qhx s PRO 117 Ca 0.29 1.94 0.13 0.00 0.02 0.00 0.00 61.00 63.37 2qhx s PRO 117 Cb -0.01 -2.54 -0.01 0.00 0.02 0.00 0.00 34.50 31.96 2qhx s PRO 117 CO -0.18 -0.56 1.38 -0.07 -0.33 0.00 0.00 177.00 177.24 2qhx h LEU 118 N 2.27 0.00 -8.59 -5.54 3.38 -2.01 -3.45 115.31 101.36 2qhx h LEU 118 Ca -0.49 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 56.78 2qhx h LEU 118 Cb 1.25 0.00 -0.30 0.00 0.09 0.00 0.00 40.66 41.70 2qhx h LEU 118 CO 0.61 0.63 -0.87 -0.76 0.09 0.00 0.00 178.44 178.13 2qhx s LEU 119 N -6.49 2.14 0.32 1.67 1.43 -1.26 -5.24 118.68 111.24 2qhx s LEU 119 Ca 0.03 -0.45 -0.29 0.00 -1.03 0.00 0.00 54.13 52.38 2qhx s LEU 119 Cb 0.08 -1.38 -0.11 0.00 0.03 0.00 0.00 46.19 44.82 2qhx s LEU 119 CO 0.77 0.29 1.42 0.00 0.23 0.00 0.00 176.35 179.06 2qhx s ARG 120 N -0.43 4.24 0.00 1.70 1.70 -1.26 -5.16 118.95 119.73 2qhx s ARG 120 Ca 0.05 2.38 0.00 0.00 -0.47 0.00 0.00 55.73 57.68 2qhx s ARG 120 Cb -0.12 -3.05 0.00 0.00 -0.57 0.00 0.00 34.95 31.22 2qhx s ARG 120 CO 0.01 -0.39 0.00 0.00 -1.08 0.00 0.00 175.30 173.84 2qhx n ALA 135 N 1.29 0.00 1.61 7.88 0.00 -1.26 -5.22 120.51 124.81 2qhx n ALA 135 Ca 0.03 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.62 2qhx n ALA 135 Cb 0.40 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.53 2qhx n ALA 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2qhx n MET 136 N 0.00 1.11 -0.02 0.00 3.85 -1.26 -2.28 117.12 118.52 2qhx n MET 136 Ca 0.00 -0.41 -0.03 0.00 -1.00 0.00 0.00 57.70 56.26 2qhx n MET 136 Cb 0.00 -1.49 -0.02 0.00 -1.05 0.00 0.00 33.22 30.66 2qhx n MET 136 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 2qhx n GLU 137 N -0.59 0.09 -0.10 3.17 4.07 -1.26 -2.63 120.64 123.39 2qhx n GLU 137 Ca 0.19 0.03 0.04 0.00 -0.06 0.00 0.00 57.16 57.35 2qhx n GLU 137 Cb 0.25 -0.86 0.36 0.00 -0.06 0.00 0.00 31.44 31.13 2qhx n GLU 137 CO 0.00 0.00 0.00 1.79 -0.06 0.00 0.00 177.13 178.86 2qhx h THR 138 N -0.07 1.11 -0.28 6.31 1.35 -2.00 -2.56 112.91 116.77 2qhx h THR 138 Ca -0.09 -0.25 -0.02 0.00 -0.55 0.00 0.00 66.41 65.51 2qhx h THR 138 Cb 1.11 0.32 -0.01 0.00 -1.73 0.00 0.00 68.15 67.83 2qhx h THR 138 CO -0.04 0.13 0.11 0.00 -0.25 0.00 0.00 175.52 175.48 2qhx h ALA 139 N 1.65 0.37 -0.09 6.62 0.00 -1.57 0.53 119.26 126.78 2qhx h ALA 139 Ca 0.22 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.02 2qhx h ALA 139 Cb 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2qhx h ALA 139 CO -0.05 -0.03 -0.02 1.15 0.00 0.00 0.00 179.25 180.30 2qhx h THR 140 N 0.31 0.92 -0.28 0.00 2.02 -1.46 -0.21 112.91 114.21 2qhx h THR 140 Ca 0.09 -0.00 -0.12 0.00 0.77 0.00 0.00 66.41 67.15 2qhx h THR 140 Cb 0.19 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.50 2qhx h THR 140 CO -0.01 0.00 -0.31 0.00 0.37 0.00 0.00 175.52 175.57 2qhx h ALA 141 N 1.08 0.94 0.17 6.16 0.00 -1.38 -0.99 119.26 125.24 2qhx h ALA 141 Ca 0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.55 2qhx h ALA 141 Cb 0.06 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.73 2qhx h ALA 141 CO -0.08 0.61 -0.08 0.22 0.00 0.00 0.00 179.25 179.92 2qhx h ASP 142 N 0.50 -0.19 -0.24 0.00 3.58 -0.75 0.56 116.42 119.88 2qhx h ASP 142 Ca 0.06 -0.31 -0.07 0.00 0.42 0.00 0.00 57.03 57.14 2qhx h ASP 142 Cb 0.79 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.88 2qhx h ASP 142 CO 0.06 0.24 -0.10 -0.07 -2.88 0.00 0.00 179.24 176.49 2qhx h LEU 143 N -0.68 0.52 -0.34 2.28 3.38 -1.07 -2.25 115.31 117.14 2qhx h LEU 143 Ca -0.02 -0.40 -0.19 0.00 0.09 0.00 0.00 57.88 57.36 2qhx h LEU 143 Cb 0.49 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2qhx h LEU 143 CO 0.04 0.80 -0.68 -0.26 0.09 0.00 0.00 178.44 178.43 2qhx h PHE 144 N 0.23 0.81 0.77 1.13 0.04 -1.30 -2.79 116.94 115.83 2qhx h PHE 144 Ca 0.06 -0.33 -0.04 0.00 2.80 0.00 0.00 57.97 60.46 2qhx h PHE 144 Cb 0.60 -0.13 0.01 0.00 2.20 0.00 0.00 35.95 38.62 2qhx h PHE 144 CO 0.06 1.11 -0.37 0.78 -0.60 0.00 0.00 178.31 179.30 2qhx h GLY 145 N 0.94 -1.08 0.98 -1.45 0.00 -1.12 -0.04 103.07 101.31 2qhx h GLY 145 Ca -0.02 0.40 -0.04 0.00 0.00 0.00 0.00 47.33 47.66 2qhx h GLY 145 CO 0.13 -0.39 0.16 1.48 0.00 0.00 0.00 176.54 177.92 2qhx h SER 146 N -1.08 0.78 1.60 0.19 4.64 -1.13 0.38 113.55 118.91 2qhx h SER 146 Ca -0.11 -0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2qhx h SER 146 Cb 0.80 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 2qhx h SER 146 CO 0.17 0.78 -0.40 0.78 -0.87 0.00 0.00 176.83 177.30 2qhx h ASN 147 N 0.74 0.00 0.00 4.97 2.35 -1.57 -3.41 115.58 118.66 2qhx h ASN 147 Ca 0.17 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.92 2qhx h ASN 147 Cb 0.29 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.66 2qhx h ASN 147 CO -0.00 0.00 0.00 0.00 -1.65 0.00 0.00 177.43 175.78 2qhx n ALA 148 N -2.13 2.62 -0.08 -0.83 0.00 -0.65 -4.49 120.51 114.96 2qhx n ALA 148 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.35 2qhx n ALA 148 Cb 0.54 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.94 2qhx n ALA 148 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2qhx h ILE 149 N 0.00 1.29 -0.26 0.00 1.08 -0.84 -2.23 117.51 116.54 2qhx h ILE 149 Ca 0.00 -1.08 -0.02 0.00 -0.39 0.00 0.00 64.86 63.37 2qhx h ILE 149 Cb 0.00 1.50 -0.01 0.00 -3.07 0.00 0.00 36.82 35.24 2qhx h ILE 149 CO 0.00 0.34 0.10 0.00 -0.69 0.00 0.00 178.15 177.89 2qhx h ALA 150 N 0.75 0.34 -0.79 1.87 0.00 -0.48 -2.02 119.26 118.94 2qhx h ALA 150 Ca 0.06 -0.12 0.17 0.00 0.00 0.00 0.00 54.91 55.01 2qhx h ALA 150 Cb 0.54 -0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.12 2qhx h ALA 150 CO 0.03 -0.06 0.29 -1.35 0.00 0.00 0.00 179.25 178.15 2qhx h PRO 151 N 0.27 0.37 0.25 0.00 0.11 -1.74 0.28 132.00 131.53 2qhx h PRO 151 Ca 0.09 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.18 2qhx h PRO 151 Cb 0.19 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.20 2qhx h PRO 151 CO -0.01 0.25 -0.26 -0.92 -0.21 0.00 0.00 178.00 176.85 2qhx h TYR 152 N 0.38 -0.69 -0.91 0.65 3.20 -1.05 0.20 116.97 118.75 2qhx h TYR 152 Ca 0.45 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.32 2qhx h TYR 152 Cb 0.75 0.27 -0.04 0.00 1.54 0.00 0.00 36.73 39.25 2qhx h TYR 152 CO -0.19 -0.38 0.57 0.74 -1.64 0.00 0.00 178.16 177.26 2qhx h PHE 153 N -0.55 1.19 -0.46 -3.82 0.04 -0.88 -0.10 116.94 112.36 2qhx h PHE 153 Ca -0.00 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.76 2qhx h PHE 153 Cb 0.51 -0.39 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 2qhx h PHE 153 CO -0.17 0.78 0.26 -0.07 -0.60 0.00 0.00 178.31 178.51 2qhx h LEU 154 N 1.25 0.56 -0.21 1.54 3.38 -0.25 0.43 115.31 122.02 2qhx h LEU 154 Ca 0.33 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 2qhx h LEU 154 Cb -0.08 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2qhx h LEU 154 CO -0.06 0.47 0.10 0.40 0.09 0.00 0.00 178.44 179.44 2qhx h ILE 155 N 0.60 1.14 -0.08 1.22 2.04 -0.19 0.30 117.51 122.54 2qhx h ILE 155 Ca 0.16 -0.41 0.04 0.00 1.00 0.00 0.00 64.86 65.65 2qhx h ILE 155 Cb 0.03 1.03 -0.06 0.00 -0.74 0.00 0.00 36.82 37.07 2qhx h ILE 155 CO -0.03 0.14 -0.31 0.50 0.00 0.00 0.00 178.15 178.45 2qhx h LYS 156 N 0.21 -0.39 -0.32 2.37 3.64 -0.78 0.20 116.57 121.50 2qhx h LYS 156 Ca 0.07 0.03 0.04 0.00 -1.27 0.00 0.00 60.65 59.52 2qhx h LYS 156 Cb 0.13 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.00 2qhx h LYS 156 CO -0.01 -0.26 0.09 0.00 -2.27 0.00 0.00 179.45 177.00 2qhx h ALA 157 N 0.40 0.35 -0.29 5.00 0.00 -0.80 0.27 119.26 124.19 2qhx h ALA 157 Ca 0.08 0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.10 2qhx h ALA 157 Cb 0.54 0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.30 2qhx h ALA 157 CO -0.31 -0.31 -0.13 0.35 0.00 0.00 0.00 179.25 178.85 2qhx h PHE 158 N 0.22 -0.30 -0.55 0.00 3.04 -0.39 -1.72 116.94 117.25 2qhx h PHE 158 Ca 0.14 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.09 2qhx h PHE 158 Cb 0.13 0.18 -0.02 0.00 2.56 0.00 0.00 35.95 38.79 2qhx h PHE 158 CO -0.15 -0.19 0.20 0.00 -2.02 0.00 0.00 178.31 176.15 2qhx h ALA 159 N 1.17 0.71 -0.72 2.41 0.00 -0.29 -2.59 119.26 119.95 2qhx h ALA 159 Ca 0.15 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2qhx h ALA 159 Cb 0.30 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.83 2qhx h ALA 159 CO -0.34 0.34 0.42 0.45 0.00 0.00 0.00 179.25 180.12 2qhx h HIS 160 N 0.75 0.77 -0.48 0.00 3.86 -0.60 -0.01 115.15 119.45 2qhx h HIS 160 Ca 0.18 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.34 2qhx h HIS 160 Cb 0.23 -0.24 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 2qhx h HIS 160 CO 0.01 0.39 -0.03 0.00 0.86 0.00 0.00 177.93 179.16 2qhx h ARG 161 N 0.78 0.81 -0.23 2.45 2.47 -1.14 0.08 114.38 119.59 2qhx h ARG 161 Ca 0.31 -0.23 -0.06 0.00 -1.26 0.00 0.00 59.98 58.74 2qhx h ARG 161 Cb 0.15 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.38 2qhx h ARG 161 CO -0.17 0.83 -0.11 0.28 0.56 0.00 0.00 179.97 181.37 2qhx h VAL 162 N 0.75 1.30 -0.94 2.04 2.07 -1.06 -2.46 116.25 117.95 2qhx h VAL 162 Ca 0.14 -1.17 -0.00 0.00 0.82 0.00 0.00 66.70 66.49 2qhx h VAL 162 Cb 0.49 1.57 -0.05 0.00 -1.52 0.00 0.00 31.29 31.79 2qhx h VAL 162 CO 0.02 0.36 0.57 0.00 0.02 0.00 0.00 177.57 178.55 2qhx h ALA 163 N 0.72 1.20 0.00 1.67 0.00 -0.85 -2.20 119.26 119.80 2qhx h ALA 163 Ca 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2qhx h ALA 163 Cb 0.60 -0.38 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2qhx h ALA 163 CO 0.03 0.65 0.00 0.78 0.00 0.00 0.00 179.25 180.72 2qhx h GLY 164 N 1.30 0.00 -4.63 0.00 0.00 -0.91 -3.43 103.07 95.40 2qhx h GLY 164 Ca 0.34 0.00 -0.55 0.00 0.00 0.00 0.00 47.33 47.12 2qhx h GLY 164 CO -0.06 0.00 0.23 -1.59 0.00 0.00 0.00 176.54 175.11 2qhx s THR 165 N -3.47 4.88 0.30 4.70 2.01 -0.83 -5.02 115.64 118.22 2qhx s THR 165 Ca 0.03 1.76 -0.30 0.00 0.31 0.00 0.00 61.69 63.49 2qhx s THR 165 Cb 0.09 -4.18 -0.12 0.00 0.01 0.00 0.00 72.50 68.30 2qhx s THR 165 CO 0.48 0.24 1.55 -2.65 -0.69 0.00 0.00 174.62 173.55 2qhx n PRO 166 N 3.57 2.61 -0.32 4.92 -0.02 -1.26 -4.82 135.00 139.68 2qhx n PRO 166 Ca 0.02 0.93 0.15 0.00 -2.02 0.00 0.00 63.50 62.57 2qhx n PRO 166 Cb 0.51 -2.68 0.30 0.00 -0.02 0.00 0.00 33.50 31.61 2qhx n PRO 166 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2qhx h ALA 167 N 4.35 1.24 0.00 3.55 0.00 -1.92 0.16 119.26 126.63 2qhx h ALA 167 Ca -0.47 0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.74 2qhx h ALA 167 Cb 1.23 0.49 0.00 0.00 0.00 0.00 0.00 17.79 19.52 2qhx h ALA 167 CO 0.76 -0.57 0.00 1.57 0.00 0.00 0.00 179.25 181.01 2qhx h LYS 168 N 0.06 0.00 -0.02 0.00 -0.00 -2.02 -2.66 116.57 111.93 2qhx h LYS 168 Ca 0.59 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 61.24 2qhx h LYS 168 Cb 1.24 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.47 2qhx h LYS 168 CO -0.82 0.00 -0.13 0.72 -0.00 0.00 0.00 179.45 179.22 2qhx n HIS 169 N -2.70 0.00 -1.85 0.07 8.25 0.54 -5.01 115.22 114.52 2qhx n HIS 169 Ca -0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.13 2qhx n HIS 169 Cb 0.18 0.00 0.03 0.00 1.12 0.00 0.00 29.99 31.33 2qhx n HIS 169 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2qhx s ARG 170 N -1.64 2.99 0.93 -0.41 0.52 -1.00 -4.96 118.95 115.38 2qhx s ARG 170 Ca 0.18 1.30 -0.12 0.00 -0.52 0.00 0.00 55.73 56.56 2qhx s ARG 170 Cb 0.14 -1.98 0.15 0.00 0.52 0.00 0.00 34.95 33.78 2qhx s ARG 170 CO 0.29 -1.09 1.11 0.20 0.02 0.00 0.00 175.30 175.84 2qhx s GLY 171 N -2.73 1.58 0.00 -3.53 0.00 -1.26 -5.01 107.32 96.37 2qhx s GLY 171 Ca 0.65 -0.38 0.12 0.00 0.00 0.00 0.00 44.72 45.11 2qhx s GLY 171 CO 0.41 0.17 0.96 -1.30 0.00 0.00 0.00 173.10 173.34 2qhx n THR 172 N -3.89 0.17 -3.02 0.90 -2.24 -1.26 -4.73 114.28 100.20 2qhx n THR 172 Ca 0.06 -0.58 -0.16 0.00 -2.27 0.00 0.00 64.05 61.09 2qhx n THR 172 Cb 0.58 1.13 -0.00 0.00 -2.10 0.00 0.00 70.33 69.93 2qhx n THR 172 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2qhx n ASN 173 N 0.68 -0.63 -4.70 3.42 5.15 -1.26 -5.09 115.26 112.83 2qhx n ASN 173 Ca 0.08 -3.11 -0.42 0.00 -0.60 0.00 0.00 54.58 50.53 2qhx n ASN 173 Cb 0.33 0.30 -0.03 0.00 -0.53 0.00 0.00 39.78 39.86 2qhx n ASN 173 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 2qhx s TYR 174 N -1.00 3.52 -0.09 1.20 2.02 -1.26 -4.77 117.35 116.96 2qhx s TYR 174 Ca 0.34 1.52 -0.04 0.00 -0.37 0.00 0.00 57.07 58.52 2qhx s TYR 174 Cb 0.27 -3.24 0.05 0.00 -0.40 0.00 0.00 41.96 38.63 2qhx s TYR 174 CO -0.11 -0.51 0.19 0.45 -1.57 0.00 0.00 175.55 174.00 2qhx s SER 175 N 1.10 0.05 -0.17 2.29 0.15 -0.66 -2.13 113.70 114.34 2qhx s SER 175 Ca 0.53 0.41 -0.01 0.00 0.70 0.00 0.00 55.95 57.58 2qhx s SER 175 Cb -0.23 0.33 -0.00 0.00 -1.71 0.00 0.00 66.02 64.41 2qhx s SER 175 CO 0.25 -0.18 -0.13 -0.63 1.20 0.00 0.00 173.24 173.76 2qhx s ILE 176 N 1.55 2.85 -0.17 6.45 1.01 0.93 -1.58 121.20 132.24 2qhx s ILE 176 Ca -0.06 -0.70 -0.01 0.00 0.00 0.00 0.00 60.65 59.88 2qhx s ILE 176 Cb -0.11 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.12 2qhx s ILE 176 CO -0.07 0.50 -0.11 -0.63 0.00 0.00 0.00 174.94 174.63 2qhx s ILE 177 N 0.94 3.03 -0.24 2.92 -1.09 0.38 -1.35 121.20 125.80 2qhx s ILE 177 Ca -0.02 -0.64 -0.11 0.00 -2.23 0.00 0.00 60.65 57.65 2qhx s ILE 177 Cb -0.15 -2.31 -0.05 0.00 -1.58 0.00 0.00 42.46 38.37 2qhx s ILE 177 CO -0.01 0.49 0.17 0.20 -1.23 0.00 0.00 174.94 174.56 2qhx s ASN 178 N 0.86 6.14 -0.57 3.58 0.01 0.24 -0.32 114.94 124.88 2qhx s ASN 178 Ca -0.03 0.14 -0.27 0.00 -0.71 0.00 0.00 52.86 51.99 2qhx s ASN 178 Cb -0.15 -2.11 0.03 0.00 0.41 0.00 0.00 41.25 39.43 2qhx s ASN 178 CO 0.00 0.06 1.11 -0.04 -1.51 0.00 0.00 177.10 176.72 2qhx s MET 179 N 1.04 3.46 0.00 -0.60 -1.94 -0.04 -1.39 119.30 119.83 2qhx s MET 179 Ca 0.08 0.09 0.00 0.00 -1.71 0.00 0.00 55.69 54.16 2qhx s MET 179 Cb -0.13 -4.02 0.00 0.00 2.01 0.00 0.00 34.83 32.68 2qhx s MET 179 CO 0.04 -1.61 0.00 1.33 -0.01 0.00 0.00 175.02 174.78 2qhx n VAL 180 N 6.52 0.00 -3.70 -6.03 0.24 0.46 -4.91 118.33 110.92 2qhx n VAL 180 Ca 0.06 0.00 -0.17 0.00 -2.04 0.00 0.00 64.34 62.20 2qhx n VAL 180 Cb 0.49 -0.28 -0.16 0.00 -1.47 0.00 0.00 33.84 32.41 2qhx n VAL 180 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2qhx s ASP 181 N -0.64 0.57 0.58 -1.34 -1.08 -1.26 -4.07 116.67 109.43 2qhx s ASP 181 Ca 0.00 0.24 0.36 0.00 -0.52 0.00 0.00 52.55 52.63 2qhx s ASP 181 Cb 0.00 0.13 1.66 0.00 -1.46 0.00 0.00 42.92 43.25 2qhx s ASP 181 CO 0.00 -0.21 2.10 0.00 0.52 0.00 0.00 175.17 177.58 2qhx h ALA 182 N 8.02 1.03 -0.01 3.66 0.00 -1.11 -3.27 119.26 127.59 2qhx h ALA 182 Ca -0.23 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2qhx h ALA 182 Cb 1.12 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.91 2qhx h ALA 182 CO 0.24 0.03 -0.47 -1.33 0.00 0.00 0.00 179.25 177.72 2qhx n MET 183 N -3.17 1.30 0.25 0.00 2.81 -1.26 -4.57 117.12 112.49 2qhx n MET 183 Ca -0.01 -0.87 0.17 0.00 -1.81 0.00 0.00 57.70 55.18 2qhx n MET 183 Cb 0.24 -1.42 0.70 0.00 -0.71 0.00 0.00 33.22 32.03 2qhx n MET 183 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 2qhx h THR 184 N 2.08 0.00 0.00 2.03 1.35 -1.95 0.23 112.91 116.65 2qhx h THR 184 Ca 0.00 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 2qhx h THR 184 Cb 0.68 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 2qhx h THR 184 CO 0.00 0.00 0.00 0.59 -0.25 0.00 0.00 175.52 175.86 2qhx n ASN 185 N -2.90 0.46 -3.53 5.36 4.13 -1.26 -3.33 115.26 114.20 2qhx n ASN 185 Ca 0.00 0.60 -0.28 0.00 1.68 0.00 0.00 54.58 56.58 2qhx n ASN 185 Cb 0.26 -0.70 -0.08 0.00 -1.54 0.00 0.00 39.78 37.72 2qhx n ASN 185 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2qhx n GLN 186 N -1.99 2.59 -1.66 3.52 6.02 0.81 -5.09 117.38 121.58 2qhx n GLN 186 Ca 0.03 -4.65 -0.42 0.00 -0.01 0.00 0.00 57.00 51.96 2qhx n GLN 186 Cb 0.25 -2.28 0.01 0.00 1.02 0.00 0.00 30.24 29.24 2qhx n GLN 186 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2qhx n PRO 187 N 1.03 1.69 -2.43 -1.09 -0.02 -1.21 -4.91 135.00 128.07 2qhx n PRO 187 Ca 0.28 0.60 -0.42 0.00 -2.02 0.00 0.00 63.50 61.94 2qhx n PRO 187 Cb 0.40 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.65 2qhx n PRO 187 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2qhx s LEU 188 N -0.97 4.27 0.07 2.45 2.96 -1.26 -4.95 118.68 121.24 2qhx s LEU 188 Ca 0.61 1.83 -0.33 0.00 -0.22 0.00 0.00 54.13 56.01 2qhx s LEU 188 Cb -0.55 -3.55 -0.12 0.00 0.50 0.00 0.00 46.19 42.46 2qhx s LEU 188 CO 0.58 -0.63 1.76 -0.11 -1.32 0.00 0.00 176.35 176.64 2qhx n LEU 189 N 5.46 3.53 0.00 -0.68 7.94 -1.26 -2.14 117.00 129.84 2qhx n LEU 189 Ca 0.12 1.02 0.00 0.00 -1.11 0.00 0.00 56.01 56.03 2qhx n LEU 189 Cb 0.46 -1.45 0.00 0.00 0.53 0.00 0.00 43.42 42.96 2qhx n LEU 189 CO 0.56 -0.06 0.00 0.61 -1.11 0.00 0.00 177.39 177.39 2qhx n GLY 190 N 4.00 0.75 1.43 -3.96 0.00 -1.26 -4.96 105.19 101.18 2qhx n GLY 190 Ca 0.19 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 2qhx n GLY 190 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2qhx n TYR 191 N -2.26 1.56 -0.05 1.61 4.02 -0.91 -0.15 117.16 120.97 2qhx n TYR 191 Ca 0.00 -1.81 -0.11 0.00 -0.01 0.00 0.00 57.90 55.97 2qhx n TYR 191 Cb 0.00 -0.58 -0.05 0.00 -0.02 0.00 0.00 39.34 38.69 2qhx n TYR 191 CO 0.00 0.00 0.00 1.15 -1.01 0.00 0.00 176.86 177.00 2qhx h THR 192 N 1.13 0.15 -0.43 -0.72 2.02 -1.81 -0.31 112.91 112.93 2qhx h THR 192 Ca 0.30 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.53 2qhx h THR 192 Cb 1.67 0.15 -0.05 0.00 -1.74 0.00 0.00 68.15 68.19 2qhx h THR 192 CO 0.57 0.00 0.17 0.40 0.37 0.00 0.00 175.52 177.03 2qhx h ILE 193 N -0.41 0.89 -0.22 3.11 1.08 -1.90 0.23 117.51 120.29 2qhx h ILE 193 Ca 0.11 -0.12 0.05 0.00 -0.39 0.00 0.00 64.86 64.51 2qhx h ILE 193 Cb 0.60 0.51 -0.05 0.00 -3.07 0.00 0.00 36.82 34.80 2qhx h ILE 193 CO -0.47 0.06 -0.12 0.22 -0.69 0.00 0.00 178.15 177.15 2qhx h TYR 194 N 0.35 -0.30 -0.59 1.37 3.20 -1.69 -0.40 116.97 118.91 2qhx h TYR 194 Ca 0.20 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 2qhx h TYR 194 Cb 0.17 0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.58 2qhx h TYR 194 CO -0.14 -0.19 0.36 1.15 -1.64 0.00 0.00 178.16 177.71 2qhx h THR 195 N -0.10 1.17 -0.65 1.81 2.02 -0.22 -1.43 112.91 115.51 2qhx h THR 195 Ca 0.12 -0.38 0.05 0.00 0.77 0.00 0.00 66.41 66.98 2qhx h THR 195 Cb 0.29 0.35 -0.05 0.00 -1.74 0.00 0.00 68.15 67.00 2qhx h THR 195 CO -0.29 0.18 0.37 0.24 0.37 0.00 0.00 175.52 176.39 2qhx h MET 196 N 0.80 0.68 -0.62 6.66 2.86 -0.28 -1.63 114.93 123.40 2qhx h MET 196 Ca 0.21 -0.04 -0.09 0.00 -2.06 0.00 0.00 59.70 57.72 2qhx h MET 196 Cb -0.03 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.45 2qhx h MET 196 CO -0.04 0.45 0.03 0.00 1.06 0.00 0.00 176.91 178.41 2qhx h ALA 197 N 1.32 0.88 -0.50 6.32 0.00 -0.29 -0.52 119.26 126.48 2qhx h ALA 197 Ca 0.28 -0.30 -0.08 0.00 0.00 0.00 0.00 54.91 54.82 2qhx h ALA 197 Cb 0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2qhx h ALA 197 CO -0.16 0.67 0.00 0.87 0.00 0.00 0.00 179.25 180.63 2qhx h LYS 198 N 0.98 0.83 -0.79 0.00 1.79 -1.05 0.37 116.57 118.70 2qhx h LYS 198 Ca 0.18 -0.23 0.04 0.00 -2.18 0.00 0.00 60.65 58.47 2qhx h LYS 198 Cb 0.52 -0.09 -0.05 0.00 -1.58 0.00 0.00 32.23 31.02 2qhx h LYS 198 CO 0.03 0.83 0.49 0.78 -1.08 0.00 0.00 179.45 180.50 2qhx h GLY 199 N 0.98 1.16 1.07 3.86 0.00 -0.71 0.64 103.07 110.06 2qhx h GLY 199 Ca 0.15 -0.36 -0.08 0.00 0.00 0.00 0.00 47.33 47.04 2qhx h GLY 199 CO 0.02 0.28 0.11 0.00 0.00 0.00 0.00 176.54 176.95 2qhx h ALA 200 N 1.35 0.89 -0.58 3.60 0.00 -0.51 -2.25 119.26 121.77 2qhx h ALA 200 Ca 0.33 -0.27 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 2qhx h ALA 200 Cb 0.08 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2qhx h ALA 200 CO -0.14 0.66 0.11 1.25 0.00 0.00 0.00 179.25 181.13 2qhx h LEU 201 N 1.04 0.86 -0.55 0.00 5.85 -0.33 0.12 115.31 122.30 2qhx h LEU 201 Ca 0.20 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2qhx h LEU 201 Cb 0.44 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 2qhx h LEU 201 CO 0.01 0.86 0.36 -0.33 -0.34 0.00 0.00 178.44 179.01 2qhx h GLU 202 N 0.87 0.73 -0.89 1.25 5.08 -0.74 -0.79 114.58 120.10 2qhx h GLU 202 Ca 0.18 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2qhx h GLU 202 Cb 0.36 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.40 2qhx h GLU 202 CO 0.00 0.49 0.57 0.78 -1.00 0.00 0.00 179.01 179.85 2qhx h GLY 203 N 0.75 1.26 1.01 -3.84 0.00 -0.79 -2.38 103.07 99.08 2qhx h GLY 203 Ca 0.20 -0.49 -0.00 0.00 0.00 0.00 0.00 47.33 47.04 2qhx h GLY 203 CO -0.04 0.48 0.47 -2.00 0.00 0.00 0.00 176.54 175.44 2qhx h LEU 204 N 1.21 0.94 -0.10 3.11 5.85 -0.36 -0.36 115.31 125.59 2qhx h LEU 204 Ca 0.32 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 59.00 2qhx h LEU 204 Cb -0.11 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 40.66 2qhx h LEU 204 CO -0.07 0.73 -0.04 0.74 -0.34 0.00 0.00 178.44 179.47 2qhx h THR 205 N 1.07 0.87 -0.06 1.05 2.02 -0.70 0.90 112.91 118.06 2qhx h THR 205 Ca 0.28 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.44 2qhx h THR 205 Cb -0.04 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2qhx h THR 205 CO -0.05 0.00 -0.03 0.03 0.37 0.00 0.00 175.52 175.84 2qhx h ARG 206 N -0.02 0.14 -0.34 6.66 3.08 -1.21 -1.65 114.38 121.04 2qhx h ARG 206 Ca 0.05 -0.06 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 2qhx h ARG 206 Cb 0.10 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 2qhx h ARG 206 CO -0.12 0.52 0.20 1.03 -1.07 0.00 0.00 179.97 180.53 2qhx h SER 207 N -0.25 0.41 -0.67 7.04 0.87 -1.02 -2.62 113.55 117.32 2qhx h SER 207 Ca 0.01 -0.06 -0.07 0.00 -1.23 0.00 0.00 61.79 60.44 2qhx h SER 207 Cb 0.48 -0.10 -0.03 0.00 -0.44 0.00 0.00 62.40 62.30 2qhx h SER 207 CO 0.01 0.36 0.13 0.00 -0.53 0.00 0.00 176.83 176.80 2qhx h ALA 208 N 1.07 0.96 -0.57 6.23 0.00 -0.86 -2.02 119.26 124.06 2qhx h ALA 208 Ca 0.12 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.80 2qhx h ALA 208 Cb 0.02 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.52 2qhx h ALA 208 CO -0.02 0.66 0.35 0.00 0.00 0.00 0.00 179.25 180.23 2qhx h ALA 209 N 1.10 0.74 -0.18 0.00 0.00 -1.11 0.50 119.26 120.31 2qhx h ALA 209 Ca 0.21 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.08 2qhx h ALA 209 Cb 0.41 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2qhx h ALA 209 CO 0.01 0.07 0.01 1.25 0.00 0.00 0.00 179.25 180.59 2qhx h LEU 210 N 0.68 0.29 -0.56 0.00 5.85 -1.31 -2.52 115.31 117.75 2qhx h LEU 210 Ca 0.23 -0.29 -0.15 0.00 0.84 0.00 0.00 57.88 58.52 2qhx h LEU 210 Cb 0.03 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 2qhx h LEU 210 CO -0.10 0.50 -0.69 -0.08 -0.34 0.00 0.00 178.44 177.73 2qhx h GLU 211 N 0.07 0.00 -0.02 1.25 4.81 -1.05 -3.21 114.58 116.43 2qhx h GLU 211 Ca 0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.28 2qhx h GLU 211 Cb 0.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.73 2qhx h GLU 211 CO 0.01 0.69 -0.28 1.28 -0.73 0.00 0.00 179.01 179.98 2qhx n LEU 212 N -3.65 2.09 -0.24 1.64 4.77 0.14 -4.38 117.00 117.37 2qhx n LEU 212 Ca -0.01 -0.73 0.03 0.00 -0.03 0.00 0.00 56.01 55.28 2qhx n LEU 212 Cb 0.69 -0.02 0.16 0.00 -2.33 0.00 0.00 43.42 41.92 2qhx n LEU 212 CO 0.43 0.37 1.00 0.00 -1.33 0.00 0.00 177.39 177.86 2qhx h ALA 213 N 4.11 0.96 -0.25 -1.18 0.00 -1.45 -1.40 119.26 120.04 2qhx h ALA 213 Ca 0.00 0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.09 2qhx h ALA 213 Cb 0.76 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 2qhx h ALA 213 CO 0.00 -0.21 0.23 -1.35 0.00 0.00 0.00 179.25 177.92 2qhx h PRO 214 N 0.42 0.00 -0.50 0.00 0.11 -1.81 0.93 132.00 131.15 2qhx h PRO 214 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 2qhx h PRO 214 Cb 0.54 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.65 2qhx h PRO 214 CO -0.38 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 178.69 2qhx n LEU 215 N -4.02 2.70 -2.06 2.35 4.77 -0.56 -4.93 117.00 115.25 2qhx n LEU 215 Ca 0.03 -1.35 -0.19 0.00 -0.03 0.00 0.00 56.01 54.47 2qhx n LEU 215 Cb 0.38 -0.34 -0.04 0.00 -2.33 0.00 0.00 43.42 41.09 2qhx n LEU 215 CO 0.30 0.65 -0.21 0.00 -1.33 0.00 0.00 177.39 176.80 2qhx n GLN 216 N 0.91 -1.66 -3.11 3.23 6.02 0.32 -4.96 117.38 118.14 2qhx n GLN 216 Ca 0.16 0.99 -0.41 0.00 -0.01 0.00 0.00 57.00 57.73 2qhx n GLN 216 Cb 0.44 -5.51 -0.06 0.00 1.02 0.00 0.00 30.24 26.12 2qhx n GLN 216 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2qhx s ILE 217 N -2.79 4.93 0.01 5.09 1.01 -1.00 -4.22 121.20 124.22 2qhx s ILE 217 Ca 0.00 0.85 -0.20 0.00 0.00 0.00 0.00 60.65 61.30 2qhx s ILE 217 Cb 0.00 -4.01 -0.06 0.00 0.01 0.00 0.00 42.46 38.40 2qhx s ILE 217 CO 0.00 -0.16 0.58 -0.13 0.00 0.00 0.00 174.94 175.23 2qhx s ARG 218 N 2.63 4.28 -0.15 2.79 0.52 -0.91 -4.03 118.95 124.08 2qhx s ARG 218 Ca 0.25 0.72 -0.00 0.00 -0.52 0.00 0.00 55.73 56.18 2qhx s ARG 218 Cb -0.15 -3.31 0.03 0.00 0.52 0.00 0.00 34.95 32.04 2qhx s ARG 218 CO 0.12 0.44 -0.09 0.08 0.02 0.00 0.00 175.30 175.88 2qhx s VAL 219 N -0.44 1.29 0.19 3.52 1.01 -1.26 -0.05 120.40 124.66 2qhx s VAL 219 Ca 0.30 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.69 2qhx s VAL 219 Cb -0.18 -1.34 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 2qhx s VAL 219 CO 0.17 0.28 0.05 0.20 0.00 0.00 0.00 175.10 175.80 2qhx s ASN 220 N 1.58 0.94 0.06 3.32 0.01 -0.46 0.28 114.94 120.67 2qhx s ASN 220 Ca 0.03 -1.25 0.09 0.00 -0.71 0.00 0.00 52.86 51.02 2qhx s ASN 220 Cb -0.14 0.19 -0.03 0.00 0.41 0.00 0.00 41.25 41.67 2qhx s ASN 220 CO -0.09 -0.66 -0.25 -0.83 -1.51 0.00 0.00 177.10 173.76 2qhx s GLY 221 N -3.18 1.36 -0.13 0.66 0.00 0.48 -0.59 107.32 105.92 2qhx s GLY 221 Ca 0.29 -1.25 0.03 0.00 0.00 0.00 0.00 44.72 43.79 2qhx s GLY 221 CO 0.07 -1.16 -0.22 0.14 0.00 0.00 0.00 173.10 171.93 2qhx s VAL 222 N -0.84 2.05 -0.34 1.40 1.01 -0.49 -0.40 120.40 122.79 2qhx s VAL 222 Ca 0.11 -0.98 0.02 0.00 0.00 0.00 0.00 61.98 61.12 2qhx s VAL 222 Cb -0.10 -1.80 0.09 0.00 0.00 0.00 0.00 36.38 34.57 2qhx s VAL 222 CO 0.03 0.55 0.06 -0.83 0.00 0.00 0.00 175.10 174.90 2qhx s GLY 223 N 0.71 1.89 0.74 4.51 0.00 -0.00 -0.40 107.32 114.76 2qhx s GLY 223 Ca -0.10 -2.33 -0.13 0.00 0.00 0.00 0.00 44.72 42.16 2qhx s GLY 223 CO 0.01 0.88 1.13 -4.14 0.00 0.00 0.00 173.10 170.98 2qhx s PRO 224 N 1.03 2.25 0.00 2.90 0.02 -1.26 -0.44 135.00 139.50 2qhx s PRO 224 Ca 0.05 1.44 0.00 0.00 0.02 0.00 0.00 61.00 62.51 2qhx s PRO 224 Cb -0.20 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.44 2qhx s PRO 224 CO -0.06 -1.69 0.00 0.41 -0.33 0.00 0.00 177.00 175.34 2qhx n GLY 225 N -0.40 -0.38 3.01 0.52 0.00 -1.11 -0.87 105.19 105.97 2qhx n GLY 225 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.83 2qhx n GLY 225 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qhx s LEU 226 N -3.30 1.66 -0.00 0.99 1.43 -1.26 -4.88 118.68 113.31 2qhx s LEU 226 Ca 0.00 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 2qhx s LEU 226 Cb 0.00 -1.16 -0.00 0.00 0.03 0.00 0.00 46.19 45.06 2qhx s LEU 226 CO 0.00 -0.06 -0.05 -0.44 0.23 0.00 0.00 176.35 176.03 2qhx s SER 227 N 1.50 0.60 -1.30 2.29 0.01 -1.26 0.04 113.70 115.57 2qhx s SER 227 Ca 0.05 -0.10 -0.19 0.00 1.31 0.00 0.00 55.95 57.02 2qhx s SER 227 Cb -0.13 -0.06 0.03 0.00 0.21 0.00 0.00 66.02 66.06 2qhx s SER 227 CO -0.11 0.06 0.36 1.33 0.41 0.00 0.00 173.24 175.29 2qhx n VAL 228 N 2.92 -1.79 -1.90 3.43 0.24 -0.15 -4.83 118.33 116.25 2qhx n VAL 228 Ca -0.13 -0.52 -0.42 0.00 -2.04 0.00 0.00 64.34 61.23 2qhx n VAL 228 Cb 0.58 -1.59 -0.03 0.00 -1.47 0.00 0.00 33.84 31.34 2qhx n VAL 228 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 2qhx s LEU 229 N -7.30 4.37 -0.15 1.34 2.96 -1.26 -5.11 118.68 113.52 2qhx s LEU 229 Ca 0.26 2.71 0.01 0.00 -0.22 0.00 0.00 54.13 56.90 2qhx s LEU 229 Cb -0.15 -3.61 0.23 0.00 0.50 0.00 0.00 46.19 43.17 2qhx s LEU 229 CO 0.94 -0.83 1.31 0.52 -1.32 0.00 0.00 176.35 176.97 2qhx n VAL 230 N 3.37 1.75 -0.03 1.68 0.31 -1.26 -5.13 118.33 119.02 2qhx n VAL 230 Ca 0.12 -0.66 -0.04 0.00 -0.01 0.00 0.00 64.34 63.75 2qhx n VAL 230 Cb 0.38 -0.81 -0.04 0.00 -0.91 0.00 0.00 33.84 32.47 2qhx n VAL 230 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2qhx n GLU 239 N -0.07 1.40 -0.11 5.55 -0.58 -1.26 -5.23 120.64 120.34 2qhx n GLU 239 Ca 0.21 0.02 -0.09 0.00 -0.42 0.00 0.00 57.16 56.88 2qhx n GLU 239 Cb 0.90 -1.14 -0.01 0.00 -0.57 0.00 0.00 31.44 30.63 2qhx n GLU 239 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2qhx h GLY 240 N 0.74 0.51 0.72 0.62 0.00 -2.00 -1.87 103.07 101.79 2qhx h GLY 240 Ca -0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 46.96 2qhx h GLY 240 CO -0.01 0.20 -0.06 0.45 0.00 0.00 0.00 176.54 177.12 2qhx h HIS 241 N 0.46 -0.17 0.00 5.60 3.86 -2.02 -3.22 115.15 119.65 2qhx h HIS 241 Ca 0.13 -0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.28 2qhx h HIS 241 Cb 0.00 0.06 -0.01 0.00 1.06 0.00 0.00 27.41 28.52 2qhx h HIS 241 CO -0.04 0.13 -0.23 0.07 0.86 0.00 0.00 177.93 178.72 2qhx h ARG 242 N -0.47 0.00 0.00 2.45 0.11 -1.88 -2.52 114.38 112.07 2qhx h ARG 242 Ca -0.02 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.06 2qhx h ARG 242 Cb 0.37 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.45 2qhx h ARG 242 CO 0.03 0.23 0.00 -1.13 0.10 0.00 0.00 179.97 179.20 2qhx n SER 243 N -4.12 0.23 0.09 0.08 3.41 -0.71 -2.20 113.62 110.40 2qhx n SER 243 Ca -0.02 0.56 0.13 0.00 -0.26 0.00 0.00 58.87 59.28 2qhx n SER 243 Cb 0.29 -0.61 0.39 0.00 -0.26 0.00 0.00 64.21 64.03 2qhx n SER 243 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2qhx n LYS 244 N -1.75 0.24 -2.22 4.33 4.76 -0.95 -4.75 118.16 117.82 2qhx n LYS 244 Ca 0.03 0.18 -0.43 0.00 -2.87 0.00 0.00 58.31 55.22 2qhx n LYS 244 Cb 0.18 -1.77 -0.02 0.00 -1.84 0.00 0.00 35.03 31.58 2qhx n LYS 244 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2qhx s VAL 245 N -3.10 3.85 0.19 -0.18 1.01 -1.02 -4.89 120.40 116.27 2qhx s VAL 245 Ca 0.10 0.96 -0.12 0.00 0.00 0.00 0.00 61.98 62.92 2qhx s VAL 245 Cb 0.13 -3.87 0.11 0.00 0.00 0.00 0.00 36.38 32.75 2qhx s VAL 245 CO 0.61 -0.36 1.72 -0.65 0.00 0.00 0.00 175.10 176.42 2qhx h PRO 246 N 10.22 0.27 -6.18 2.72 0.11 -1.82 -2.41 132.00 134.91 2qhx h PRO 246 Ca -0.31 -0.02 -0.59 0.00 0.11 0.00 0.00 66.00 65.20 2qhx h PRO 246 Cb 1.13 -0.06 -0.08 0.00 0.11 0.00 0.00 31.00 32.10 2qhx h PRO 246 CO 1.01 0.18 0.67 -1.17 -0.21 0.00 0.00 178.00 178.49 2qhx s LEU 247 N -10.44 3.95 0.00 2.35 2.96 -0.35 -4.12 118.68 113.02 2qhx s LEU 247 Ca -0.13 0.64 0.00 0.00 -0.22 0.00 0.00 54.13 54.42 2qhx s LEU 247 Cb 0.16 -3.33 0.00 0.00 0.50 0.00 0.00 46.19 43.51 2qhx s LEU 247 CO 0.73 -0.90 0.00 -1.22 -1.32 0.00 0.00 176.35 173.64 2qhx n TYR 248 N 6.90 0.00 -3.79 5.38 4.01 -1.26 -4.17 117.16 124.23 2qhx n TYR 248 Ca 0.08 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.57 2qhx n TYR 248 Cb 0.48 -0.07 0.03 0.00 -0.31 0.00 0.00 39.34 39.47 2qhx n TYR 248 CO 0.00 0.00 0.00 1.04 -0.46 0.00 0.00 176.86 177.44 2qhx n GLN 249 N -1.96 -5.40 -3.59 -0.72 3.00 -0.91 -4.98 117.38 102.82 2qhx n GLN 249 Ca 0.00 0.62 -0.12 0.00 -0.01 0.00 0.00 57.00 57.50 2qhx n GLN 249 Cb 0.00 -5.37 -0.05 0.00 0.00 0.00 0.00 30.24 24.82 2qhx n GLN 249 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 2qhx s ARG 250 N -6.30 1.07 0.87 -1.09 1.70 -0.94 -3.84 118.95 110.43 2qhx s ARG 250 Ca 0.35 -0.51 -0.11 0.00 -0.47 0.00 0.00 55.73 54.99 2qhx s ARG 250 Cb -0.17 0.48 0.11 0.00 -0.57 0.00 0.00 34.95 34.80 2qhx s ARG 250 CO 0.82 -0.41 1.10 0.16 -1.08 0.00 0.00 175.30 175.88 2qhx s ASP 251 N -2.48 3.61 0.66 -2.89 -4.77 -1.26 -4.84 116.67 104.70 2qhx s ASP 251 Ca -0.01 1.80 -0.11 0.00 -3.30 0.00 0.00 52.55 50.94 2qhx s ASP 251 Cb 0.00 -2.42 -0.01 0.00 -1.09 0.00 0.00 42.92 39.40 2qhx s ASP 251 CO -0.08 -2.60 1.05 -0.94 0.70 0.00 0.00 175.17 173.30 2qhx s SER 252 N -3.17 5.79 0.73 2.11 1.04 0.11 -4.82 113.70 115.48 2qhx s SER 252 Ca 0.64 1.22 -0.11 0.00 0.48 0.00 0.00 55.95 58.18 2qhx s SER 252 Cb -0.19 -2.14 0.04 0.00 0.10 0.00 0.00 66.02 63.83 2qhx s SER 252 CO 0.57 -1.12 1.10 -0.94 0.98 0.00 0.00 173.24 173.83 2qhx s SER 253 N -4.28 5.03 0.18 7.02 1.04 -1.26 -0.98 113.70 120.45 2qhx s SER 253 Ca 0.56 0.89 -0.11 0.00 0.48 0.00 0.00 55.95 57.77 2qhx s SER 253 Cb -0.11 -1.57 0.09 0.00 0.10 0.00 0.00 66.02 64.53 2qhx s SER 253 CO 0.52 -1.56 1.75 0.00 0.98 0.00 0.00 173.24 174.93 2qhx h ALA 254 N -0.76 0.81 -0.48 5.32 0.00 -1.96 -3.01 119.26 119.18 2qhx h ALA 254 Ca -0.45 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.26 2qhx h ALA 254 Cb 1.29 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.81 2qhx h ALA 254 CO 0.64 0.40 0.12 0.00 0.00 0.00 0.00 179.25 180.41 2qhx h ALA 255 N 1.11 1.30 -0.00 0.00 0.00 -1.94 0.53 119.26 120.26 2qhx h ALA 255 Ca 0.21 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2qhx h ALA 255 Cb 0.17 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 2qhx h ALA 255 CO -0.02 0.49 0.01 0.93 0.00 0.00 0.00 179.25 180.66 2qhx h GLU 256 N 0.71 0.00 0.00 0.00 5.08 -1.92 0.12 114.58 118.57 2qhx h GLU 256 Ca 0.16 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.24 2qhx h GLU 256 Cb 0.26 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.47 2qhx h GLU 256 CO -0.00 0.00 -1.53 0.28 -1.00 0.00 0.00 179.01 176.76 2qhx n VAL 257 N -3.85 1.54 -0.13 3.13 0.31 -0.72 -4.47 118.33 114.14 2qhx n VAL 257 Ca -0.03 -0.11 -0.01 0.00 -0.01 0.00 0.00 64.34 64.18 2qhx n VAL 257 Cb 0.09 -2.00 0.23 0.00 -0.91 0.00 0.00 33.84 31.24 2qhx n VAL 257 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2qhx h SER 258 N -0.98 0.75 -0.52 4.52 4.64 -0.66 -2.11 113.55 119.18 2qhx h SER 258 Ca -0.42 -0.10 0.10 0.00 -0.47 0.00 0.00 61.79 60.90 2qhx h SER 258 Cb 1.38 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 63.25 2qhx h SER 258 CO -0.25 0.69 0.36 0.44 -0.87 0.00 0.00 176.83 177.20 2qhx h ASP 259 N 0.81 0.23 -0.11 4.97 3.32 -1.00 -0.03 116.42 124.62 2qhx h ASP 259 Ca 0.19 0.01 -0.14 0.00 0.02 0.00 0.00 57.03 57.10 2qhx h ASP 259 Cb 0.18 -0.04 0.01 0.00 0.22 0.00 0.00 39.33 39.69 2qhx h ASP 259 CO -0.02 0.14 -0.49 0.58 -1.72 0.00 0.00 179.24 177.73 2qhx h VAL 260 N 0.26 1.36 -0.45 -1.35 2.07 -1.61 -1.48 116.25 115.06 2qhx h VAL 260 Ca 0.24 -1.81 0.07 0.00 0.82 0.00 0.00 66.70 66.03 2qhx h VAL 260 Cb 0.62 2.16 -0.06 0.00 -1.52 0.00 0.00 31.29 32.49 2qhx h VAL 260 CO -0.05 0.54 0.09 0.58 0.02 0.00 0.00 177.57 178.76 2qhx h VAL 261 N 0.13 0.76 -0.46 2.57 2.07 -1.21 -1.54 116.25 118.57 2qhx h VAL 261 Ca -0.03 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 2qhx h VAL 261 Cb 1.13 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2qhx h VAL 261 CO 0.10 0.04 0.28 0.40 0.02 0.00 0.00 177.57 178.41 2qhx h ILE 262 N 0.23 1.14 -0.32 4.57 5.03 -0.95 -2.05 117.51 125.16 2qhx h ILE 262 Ca 0.22 -0.32 0.02 0.00 -0.12 0.00 0.00 64.86 64.66 2qhx h ILE 262 Cb 0.28 0.53 -0.03 0.00 -3.03 0.00 0.00 36.82 34.57 2qhx h ILE 262 CO -0.29 0.15 0.17 0.15 -0.68 0.00 0.00 178.15 177.65 2qhx h PHE 263 N 0.61 0.31 0.00 1.37 3.57 -0.94 -2.09 116.94 119.78 2qhx h PHE 263 Ca 0.17 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 2qhx h PHE 263 Cb -0.01 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 38.64 2qhx h PHE 263 CO -0.03 0.17 -0.07 -0.07 -2.23 0.00 0.00 178.31 176.08 2qhx h LEU 264 N 0.35 0.00 0.00 0.59 3.38 -0.95 -0.56 115.31 118.12 2qhx h LEU 264 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2qhx h LEU 264 Cb 0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.79 2qhx h LEU 264 CO -0.09 0.07 -0.08 0.00 0.09 0.00 0.00 178.44 178.44 2qhx s SER 266 N -6.11 4.87 0.56 0.00 1.04 -0.22 -4.91 113.70 108.94 2qhx s SER 266 Ca 0.07 1.86 0.35 0.00 0.48 0.00 0.00 55.95 58.71 2qhx s SER 266 Cb 0.05 -2.53 1.49 0.00 0.10 0.00 0.00 66.02 65.14 2qhx s SER 266 CO 0.68 -1.79 2.03 0.77 0.98 0.00 0.00 173.24 175.91 2qhx h SER 267 N -0.60 0.00 0.37 7.02 4.64 -1.90 -2.31 113.55 120.77 2qhx h SER 267 Ca -0.45 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.85 2qhx h SER 267 Cb 1.23 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.32 2qhx h SER 267 CO 0.53 0.01 -0.09 0.11 -0.87 0.00 0.00 176.83 176.52 2qhx h LYS 268 N 0.00 0.00 -0.71 4.77 1.57 -1.92 -2.50 116.57 117.78 2qhx h LYS 268 Ca -0.00 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.68 2qhx h LYS 268 Cb 0.45 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.70 2qhx h LYS 268 CO 0.00 0.09 0.13 0.00 -0.57 0.00 0.00 179.45 179.09 2qhx n ALA 269 N -2.24 4.09 0.90 3.86 0.00 -0.87 -4.66 120.51 121.59 2qhx n ALA 269 Ca -0.02 -1.91 0.09 0.00 0.00 0.00 0.00 53.44 51.61 2qhx n ALA 269 Cb 0.22 -1.18 0.48 0.00 0.00 0.00 0.00 19.45 18.97 2qhx n ALA 269 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2qhx n LYS 270 N 0.23 0.27 0.00 0.00 2.85 -0.94 -1.78 118.16 118.79 2qhx n LYS 270 Ca 0.31 0.10 0.11 0.00 -1.05 0.00 0.00 58.31 57.78 2qhx n LYS 270 Cb 1.20 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 34.09 2qhx n LYS 270 CO 0.00 0.00 0.00 0.98 -0.05 0.00 0.00 177.40 178.33 2qhx n TYR 271 N -1.28 0.00 -3.04 5.58 9.36 -1.26 -4.88 117.16 121.63 2qhx n TYR 271 Ca 0.09 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.90 2qhx n TYR 271 Cb 0.15 0.00 -0.06 0.00 -0.63 0.00 0.00 39.34 38.80 2qhx n TYR 271 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 2qhx s ILE 272 N -2.37 4.90 0.00 2.97 1.01 -0.74 -5.04 121.20 121.93 2qhx s ILE 272 Ca 0.19 1.10 -0.12 0.00 0.00 0.00 0.00 60.65 61.81 2qhx s ILE 272 Cb 0.18 -4.04 0.02 0.00 0.01 0.00 0.00 42.46 38.62 2qhx s ILE 272 CO 0.53 -0.12 0.25 0.28 0.00 0.00 0.00 174.94 175.89 2qhx s THR 273 N 2.71 0.07 -0.36 2.92 -1.32 -1.26 -4.73 115.64 113.67 2qhx s THR 273 Ca 0.29 -0.61 0.00 0.00 -1.21 0.00 0.00 61.69 60.16 2qhx s THR 273 Cb -0.15 -0.65 0.00 0.00 -1.51 0.00 0.00 72.50 70.19 2qhx s THR 273 CO 0.11 -0.33 0.00 0.61 -2.21 0.00 0.00 174.62 172.79 2qhx n GLY 274 N 1.15 0.62 3.49 6.08 0.00 0.14 -4.96 105.19 111.71 2qhx n GLY 274 Ca -0.21 -0.35 -0.28 0.00 0.00 0.00 0.00 46.02 45.17 2qhx n GLY 274 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2qhx s THR 275 N -1.95 2.83 -0.18 2.61 -4.23 -1.26 -4.67 115.64 108.79 2qhx s THR 275 Ca 0.00 -1.62 -0.03 0.00 -1.18 0.00 0.00 61.69 58.87 2qhx s THR 275 Cb 0.00 -2.33 -0.01 0.00 1.34 0.00 0.00 72.50 71.50 2qhx s THR 275 CO 0.00 0.03 -0.07 0.00 -0.54 0.00 0.00 174.62 174.04 2qhx s VAL 277 N 0.87 5.08 0.08 0.00 1.01 0.47 -4.95 120.40 122.95 2qhx s VAL 277 Ca -0.02 -0.27 -0.31 0.00 0.00 0.00 0.00 61.98 61.39 2qhx s VAL 277 Cb -0.15 -3.60 -0.06 0.00 0.00 0.00 0.00 36.38 32.57 2qhx s VAL 277 CO 0.01 0.02 1.21 -0.54 0.00 0.00 0.00 175.10 175.79 2qhx s LYS 278 N 1.69 4.43 -0.66 2.72 1.02 -1.26 -0.82 119.74 126.86 2qhx s LYS 278 Ca 0.06 1.79 0.05 0.00 0.02 0.00 0.00 55.97 57.89 2qhx s LYS 278 Cb -0.17 -3.33 0.17 0.00 -0.52 0.00 0.00 37.83 33.97 2qhx s LYS 278 CO 0.09 -0.25 0.47 0.08 -0.92 0.00 0.00 175.35 174.82 2qhx s VAL 279 N 0.95 2.49 0.00 3.17 1.01 0.42 -4.91 120.40 123.52 2qhx s VAL 279 Ca 0.58 -4.01 0.00 0.00 0.00 0.00 0.00 61.98 58.55 2qhx s VAL 279 Cb -0.30 -2.64 0.00 0.00 0.00 0.00 0.00 36.38 33.44 2qhx s VAL 279 CO 0.30 -1.04 0.46 -0.90 0.00 0.00 0.00 175.10 173.92 2qhx n ASP 280 N 2.12 0.29 -2.26 3.32 5.75 -1.26 -2.75 116.55 121.75 2qhx n ASP 280 Ca 0.21 -1.12 -0.15 0.00 -0.01 0.00 0.00 54.79 53.72 2qhx n ASP 280 Cb 0.37 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.44 2qhx n ASP 280 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2qhx n GLY 281 N -0.06 -0.19 1.77 6.12 0.00 -1.26 -1.36 105.19 110.20 2qhx n GLY 281 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2qhx n GLY 281 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qhx n GLY 282 N -0.76 0.56 0.33 -0.02 0.00 -1.26 -1.22 105.19 102.82 2qhx n GLY 282 Ca -0.17 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.85 2qhx n GLY 282 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2qhx h TYR 283 N 0.00 0.85 0.00 1.61 3.20 -1.56 -1.68 116.97 119.39 2qhx h TYR 283 Ca 0.00 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.86 2qhx h TYR 283 Cb 0.00 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 38.00 2qhx h TYR 283 CO 0.00 0.60 0.00 -1.13 -1.64 0.00 0.00 178.16 175.99 2qhx n SER 284 N -4.38 0.00 -0.01 -2.11 3.41 -1.26 -1.83 113.62 107.44 2qhx n SER 284 Ca 0.06 0.37 0.13 0.00 -0.26 0.00 0.00 58.87 59.16 2qhx n SER 284 Cb 0.10 -0.43 0.41 0.00 -0.26 0.00 0.00 64.21 64.03 2qhx n SER 284 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2qhx n LEU 285 N -1.43 0.33 -4.89 1.04 4.77 -0.63 -4.93 117.00 111.26 2qhx n LEU 285 Ca 0.04 0.18 -0.29 0.00 -0.03 0.00 0.00 56.01 55.91 2qhx n LEU 285 Cb 0.15 -0.34 0.04 0.00 -2.33 0.00 0.00 43.42 40.94 2qhx n LEU 285 CO 0.12 0.08 0.69 0.42 -1.33 0.00 0.00 177.39 177.37 2qhx s THR 286 N -2.96 3.78 0.06 -5.08 -4.23 -0.76 -5.10 115.64 101.35 2qhx s THR 286 Ca 0.13 0.45 -0.00 0.00 -1.18 0.00 0.00 61.69 61.09 2qhx s THR 286 Cb 0.18 -3.55 -0.04 0.00 1.34 0.00 0.00 72.50 70.43 2qhx s THR 286 CO 0.62 -0.69 -0.04 0.00 -0.54 0.00 0.00 174.62 173.97 2qhx s ARG 287 N -5.24 0.68 0.00 3.99 1.70 -1.26 -5.11 118.95 113.71 2qhx s ARG 287 Ca 0.56 -1.26 0.13 0.00 -0.47 0.00 0.00 55.73 54.70 2qhx s ARG 287 Cb -0.11 0.09 0.78 0.00 -0.57 0.00 0.00 34.95 35.14 2qhx s ARG 287 CO 0.51 -0.09 1.20 0.00 -1.08 0.00 0.00 175.30 175.84