#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qhu s GLU 2 N 0.00 0.88 0.02 2.12 2.02 -1.26 -0.98 118.70 121.50 2qhu s GLU 2 Ca 0.00 -1.30 0.01 0.00 0.02 0.00 0.00 54.97 53.71 2qhu s GLU 2 Cb 0.00 -0.39 -0.01 0.00 0.10 0.00 0.00 34.13 33.82 2qhu s GLU 2 CO 0.00 0.03 -0.05 -0.59 0.02 0.00 0.00 175.26 174.67 2qhu s PHE 3 N -3.17 0.47 -0.08 1.61 -0.12 -0.80 -4.41 117.98 111.47 2qhu s PHE 3 Ca 0.11 -0.29 -0.18 0.00 -0.05 0.00 0.00 56.93 56.52 2qhu s PHE 3 Cb 0.02 -0.29 -0.05 0.00 -0.63 0.00 0.00 43.02 42.07 2qhu s PHE 3 CO -0.02 -0.06 0.48 -1.17 -0.05 0.00 0.00 175.22 174.41 2qhu s LEU 4 N -0.82 4.34 -0.19 -1.99 2.96 -0.11 -0.52 118.68 122.34 2qhu s LEU 4 Ca -0.05 0.90 -0.08 0.00 -0.22 0.00 0.00 54.13 54.68 2qhu s LEU 4 Cb -0.06 -2.71 -0.04 0.00 0.50 0.00 0.00 46.19 43.88 2qhu s LEU 4 CO -0.00 0.08 0.07 -0.69 -1.32 0.00 0.00 176.35 174.49 2qhu s VAL 5 N 0.18 4.86 -0.18 1.68 1.01 -0.82 -0.21 120.40 126.91 2qhu s VAL 5 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 61.98 62.23 2qhu s VAL 5 Cb -0.16 -3.20 0.01 0.00 0.00 0.00 0.00 36.38 33.03 2qhu s VAL 5 CO 0.12 0.45 -0.17 -1.61 0.00 0.00 0.00 175.10 173.89 2qhu s GLU 6 N 0.45 3.09 -0.53 2.72 2.02 -0.33 -4.97 118.70 121.16 2qhu s GLU 6 Ca 0.04 -0.78 -0.21 0.00 0.02 0.00 0.00 54.97 54.04 2qhu s GLU 6 Cb -0.12 -2.65 0.06 0.00 0.10 0.00 0.00 34.13 31.51 2qhu s GLU 6 CO 0.00 -0.17 0.72 0.34 0.02 0.00 0.00 175.26 176.17 2qhu s ASP 7 N 1.25 6.25 0.00 -0.19 2.15 -1.26 -0.79 116.67 124.08 2qhu s ASP 7 Ca 0.03 -0.79 0.27 0.00 0.43 0.00 0.00 52.55 52.50 2qhu s ASP 7 Cb -0.14 -2.33 0.89 0.00 -0.30 0.00 0.00 42.92 41.04 2qhu s ASP 7 CO -0.09 -1.00 1.66 0.18 -0.17 0.00 0.00 175.17 175.74 2qhu n LEU 8 N 6.56 0.66 0.00 -1.34 4.77 0.21 -4.98 117.00 122.87 2qhu n LEU 8 Ca -0.04 -0.06 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 2qhu n LEU 8 Cb 0.46 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 2qhu n LEU 8 CO 0.57 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.37 2qhu n GLY 9 N 1.37 1.64 3.65 -0.72 0.00 -1.25 -4.53 105.19 105.34 2qhu n GLY 9 Ca 0.11 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 2qhu n GLY 9 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2qhu s LEU 10 N 0.00 4.07 -0.01 0.99 2.96 -1.26 -1.24 118.68 124.19 2qhu s LEU 10 Ca 0.00 1.15 0.00 0.00 -0.22 0.00 0.00 54.13 55.07 2qhu s LEU 10 Cb 0.00 -3.37 0.01 0.00 0.50 0.00 0.00 46.19 43.33 2qhu s LEU 10 CO 0.00 -0.63 -0.00 -0.69 -1.32 0.00 0.00 176.35 173.71 2qhu s VAL 11 N 3.09 0.09 0.39 1.68 1.01 -0.26 -4.95 120.40 121.46 2qhu s VAL 11 Ca 0.40 0.02 -0.26 0.00 0.00 0.00 0.00 61.98 62.13 2qhu s VAL 11 Cb -0.15 -0.13 -0.11 0.00 0.00 0.00 0.00 36.38 36.00 2qhu s VAL 11 CO 0.08 0.06 1.29 -2.65 0.00 0.00 0.00 175.10 173.88 2qhu n PRO 12 N 3.45 2.03 -0.11 2.72 -0.02 -1.26 -4.29 135.00 137.52 2qhu n PRO 12 Ca -0.18 0.72 -0.05 0.00 -2.02 0.00 0.00 63.50 61.97 2qhu n PRO 12 Cb 0.56 -2.38 0.01 0.00 -0.02 0.00 0.00 33.50 31.67 2qhu n PRO 12 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2qhu h TYR 13 N 2.28 -0.29 -0.06 6.00 3.20 -1.93 -1.57 116.97 124.60 2qhu h TYR 13 Ca -0.47 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.46 2qhu h TYR 13 Cb 1.29 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 39.72 2qhu h TYR 13 CO 0.49 -0.20 -0.10 0.78 -1.64 0.00 0.00 178.16 177.48 2qhu h GLY 14 N -0.05 -0.07 1.19 1.82 0.00 -1.99 0.18 103.07 104.15 2qhu h GLY 14 Ca 0.18 0.13 -0.09 0.00 0.00 0.00 0.00 47.33 47.55 2qhu h GLY 14 CO -0.41 -0.11 -0.02 0.83 0.00 0.00 0.00 176.54 176.82 2qhu h GLU 15 N -0.15 0.97 -0.73 4.80 3.07 -1.93 -1.94 114.58 118.67 2qhu h GLU 15 Ca 0.06 -0.30 -0.02 0.00 -0.50 0.00 0.00 59.36 58.60 2qhu h GLU 15 Cb 0.23 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.02 2qhu h GLU 15 CO -0.15 0.97 0.37 0.00 -1.40 0.00 0.00 179.01 178.80 2qhu h ALA 16 N 1.08 1.29 -0.27 3.43 0.00 -0.99 -0.53 119.26 123.27 2qhu h ALA 16 Ca 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2qhu h ALA 16 Cb 0.55 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2qhu h ALA 16 CO 0.03 0.56 0.13 2.35 0.00 0.00 0.00 179.25 182.33 2qhu h TRP 17 N 1.02 0.38 -0.97 0.00 7.01 -0.37 0.31 115.95 123.34 2qhu h TRP 17 Ca 0.25 -0.02 0.01 0.00 2.11 0.00 0.00 58.89 61.25 2qhu h TRP 17 Cb 0.06 -0.12 -0.05 0.00 -2.10 0.00 0.00 29.16 26.96 2qhu h TRP 17 CO 0.01 0.35 0.64 0.00 -2.79 0.00 0.00 178.44 176.66 2qhu h ALA 18 N 0.99 1.31 -0.39 2.65 0.00 -0.97 -1.71 119.26 121.15 2qhu h ALA 18 Ca 0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 2qhu h ALA 18 Cb 0.11 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2qhu h ALA 18 CO -0.01 0.64 0.20 -0.92 0.00 0.00 0.00 179.25 179.16 2qhu h TYR 19 N 1.31 0.54 -0.58 0.00 3.20 -0.77 -2.03 116.97 118.65 2qhu h TYR 19 Ca 0.36 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.32 2qhu h TYR 19 Cb -0.15 -0.17 -0.10 0.00 1.54 0.00 0.00 36.73 37.85 2qhu h TYR 19 CO -0.00 0.44 -0.05 1.96 -1.64 0.00 0.00 178.16 178.86 2qhu h GLN 20 N 0.49 0.07 -0.69 1.82 4.20 -0.35 0.92 115.11 121.57 2qhu h GLN 20 Ca 0.13 -0.00 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 2qhu h GLN 20 Cb 0.08 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 2qhu h GLN 20 CO -0.02 0.04 0.16 0.87 -0.67 0.00 0.00 178.83 179.21 2qhu h LYS 21 N 0.07 1.11 -0.46 1.46 1.79 -1.05 0.15 116.57 119.64 2qhu h LYS 21 Ca 0.29 -0.27 -0.11 0.00 -2.18 0.00 0.00 60.65 58.38 2qhu h LYS 21 Cb 0.46 -0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 30.95 2qhu h LYS 21 CO -0.53 0.98 -0.16 0.00 -1.08 0.00 0.00 179.45 178.66 2qhu h ARG 22 N 1.05 0.92 -0.31 3.15 3.08 -0.75 -1.32 114.38 120.20 2qhu h ARG 22 Ca 0.22 -0.37 -0.01 0.00 0.07 0.00 0.00 59.98 59.88 2qhu h ARG 22 Cb 0.38 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 2qhu h ARG 22 CO 0.00 1.03 0.16 0.28 -1.07 0.00 0.00 179.97 180.37 2qhu h VAL 23 N 0.76 1.15 -0.48 2.04 2.07 -0.59 -2.67 116.25 118.53 2qhu h VAL 23 Ca 0.11 -0.41 0.06 0.00 0.82 0.00 0.00 66.70 67.28 2qhu h VAL 23 Cb 0.72 0.84 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 2qhu h VAL 23 CO 0.05 0.15 0.19 -0.74 0.02 0.00 0.00 177.57 177.24 2qhu h HIS 24 N 0.38 0.33 -0.55 1.57 -0.00 -0.59 -1.78 115.15 114.52 2qhu h HIS 24 Ca 0.11 0.02 0.08 0.00 -0.00 0.00 0.00 60.37 60.58 2qhu h HIS 24 Cb 0.10 -0.08 -0.06 0.00 -0.00 0.00 0.00 27.41 27.37 2qhu h HIS 24 CO -0.02 0.13 0.21 0.00 -0.00 0.00 0.00 177.93 178.25 2qhu h ARG 25 N 0.37 0.39 -0.50 5.26 3.08 -1.13 -0.79 114.38 121.07 2qhu h ARG 25 Ca 0.22 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 60.16 2qhu h ARG 25 Cb 0.21 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 2qhu h ARG 25 CO -0.21 0.26 -0.05 0.93 -1.07 0.00 0.00 179.97 179.83 2qhu h GLU 26 N 0.40 0.88 -0.33 0.04 5.08 -1.07 -1.40 114.58 118.18 2qhu h GLU 26 Ca 0.27 -0.28 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 2qhu h GLU 26 Cb 0.29 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2qhu h GLU 26 CO -0.26 0.91 -0.11 0.28 -1.00 0.00 0.00 179.01 178.84 2qhu h VAL 27 N 0.80 1.28 -0.97 3.13 2.07 -0.98 0.31 116.25 121.90 2qhu h VAL 27 Ca 0.14 -1.18 0.07 0.00 0.82 0.00 0.00 66.70 66.55 2qhu h VAL 27 Cb 0.55 1.36 -0.07 0.00 -1.52 0.00 0.00 31.29 31.62 2qhu h VAL 27 CO 0.03 0.38 0.63 0.58 0.02 0.00 0.00 177.57 179.21 2qhu h VAL 28 N 0.44 1.06 0.00 2.57 2.07 -0.96 -0.92 116.25 120.51 2qhu h VAL 28 Ca 0.08 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2qhu h VAL 28 Cb 0.62 -0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 2qhu h VAL 28 CO 0.04 0.20 0.00 0.00 0.02 0.00 0.00 177.57 177.83 2qhu n ALA 29 N -2.38 2.19 -1.73 1.67 0.00 -0.54 -4.89 120.51 114.83 2qhu n ALA 29 Ca 0.15 -0.10 -0.07 0.00 0.00 0.00 0.00 53.44 53.43 2qhu n ALA 29 Cb 0.21 -1.40 -0.01 0.00 0.00 0.00 0.00 19.45 18.24 2qhu n ALA 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2qhu n GLY 30 N 0.98 0.43 0.57 0.00 0.00 -0.35 -4.93 105.19 101.89 2qhu n GLY 30 Ca 0.08 -0.67 0.05 0.00 0.00 0.00 0.00 46.02 45.48 2qhu n GLY 30 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qhu n ASN 31 N 0.83 2.90 -3.68 1.61 3.02 0.06 -4.95 115.26 115.06 2qhu n ASN 31 Ca -0.07 -2.15 -0.14 0.00 -0.03 0.00 0.00 54.58 52.19 2qhu n ASN 31 Cb 0.41 -0.24 -0.09 0.00 -0.61 0.00 0.00 39.78 39.25 2qhu n ASN 31 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2qhu s ARG 32 N -1.27 0.66 0.91 3.52 3.52 -1.19 -4.92 118.95 120.18 2qhu s ARG 32 Ca 0.22 0.77 -0.12 0.00 -0.13 0.00 0.00 55.73 56.48 2qhu s ARG 32 Cb 0.13 0.32 0.14 0.00 -1.56 0.00 0.00 34.95 33.98 2qhu s ARG 32 CO 0.12 -0.08 1.09 -1.25 -0.81 0.00 0.00 175.30 174.38 2qhu s PRO 33 N 0.28 1.15 0.20 5.12 0.04 -1.26 -4.47 135.00 136.06 2qhu s PRO 33 Ca -0.00 0.80 -0.32 0.00 0.04 0.00 0.00 61.00 61.52 2qhu s PRO 33 Cb -0.04 -1.80 -0.15 0.00 0.04 0.00 0.00 34.50 32.55 2qhu s PRO 33 CO 0.01 -2.31 1.16 -2.30 0.04 0.00 0.00 177.00 173.60 2qhu n PRO 34 N -3.93 1.28 -4.73 0.56 -0.02 -1.26 -4.71 135.00 122.19 2qhu n PRO 34 Ca 0.07 0.45 -0.27 0.00 -2.02 0.00 0.00 63.50 61.73 2qhu n PRO 34 Cb 0.55 -1.94 -0.17 0.00 -0.02 0.00 0.00 33.50 31.92 2qhu n PRO 34 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2qhu s THR 35 N -0.32 1.40 -0.33 3.45 2.01 -0.55 -0.94 115.64 120.36 2qhu s THR 35 Ca 0.70 -0.63 -0.08 0.00 0.31 0.00 0.00 61.69 61.99 2qhu s THR 35 Cb -0.81 -1.25 0.02 0.00 0.01 0.00 0.00 72.50 70.47 2qhu s THR 35 CO 0.53 0.41 0.13 -0.22 -0.69 0.00 0.00 174.62 174.79 2qhu s LEU 36 N 0.62 4.26 -0.09 4.42 2.96 0.70 -0.11 118.68 131.44 2qhu s LEU 36 Ca -0.15 -0.87 -0.22 0.00 -0.22 0.00 0.00 54.13 52.67 2qhu s LEU 36 Cb -0.16 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.55 2qhu s LEU 36 CO 0.05 -0.28 0.63 -0.76 -1.32 0.00 0.00 176.35 174.67 2qhu s LEU 37 N 1.51 4.29 -0.06 -0.68 1.43 -0.39 -1.18 118.68 123.60 2qhu s LEU 37 Ca 0.02 1.06 0.06 0.00 -1.03 0.00 0.00 54.13 54.24 2qhu s LEU 37 Cb -0.18 -2.96 -0.01 0.00 0.03 0.00 0.00 46.19 43.06 2qhu s LEU 37 CO 0.04 -0.09 -0.25 -0.76 0.23 0.00 0.00 176.35 175.52 2qhu s LEU 38 N 0.82 2.07 0.16 1.79 1.43 0.03 -0.07 118.68 124.91 2qhu s LEU 38 Ca 0.34 -0.51 -0.24 0.00 -1.03 0.00 0.00 54.13 52.69 2qhu s LEU 38 Cb -0.17 -1.37 0.07 0.00 0.03 0.00 0.00 46.19 44.76 2qhu s LEU 38 CO 0.15 0.25 1.02 -1.48 0.23 0.00 0.00 176.35 176.52 2qhu s LEU 39 N -0.18 -0.07 0.17 1.79 2.34 -0.39 -0.62 118.68 121.73 2qhu s LEU 39 Ca -0.03 -0.55 0.08 0.00 0.06 0.00 0.00 54.13 53.69 2qhu s LEU 39 Cb -0.14 2.08 -0.04 0.00 -0.56 0.00 0.00 46.19 47.53 2qhu s LEU 39 CO 0.03 -0.93 -0.17 -1.61 -1.06 0.00 0.00 176.35 172.62 2qhu s GLU 40 N -2.60 1.27 0.08 1.48 2.02 -0.37 -0.71 118.70 119.86 2qhu s GLU 40 Ca 0.18 -1.44 0.09 0.00 0.02 0.00 0.00 54.97 53.82 2qhu s GLU 40 Cb -0.02 -1.24 -0.03 0.00 0.10 0.00 0.00 34.13 32.94 2qhu s GLU 40 CO 0.04 0.24 -0.24 -1.01 0.02 0.00 0.00 175.26 174.31 2qhu s HIS 41 N -2.28 2.39 0.70 1.61 3.76 -1.26 -1.10 115.29 119.11 2qhu s HIS 41 Ca 0.17 -0.35 -0.16 0.00 -0.15 0.00 0.00 55.06 54.56 2qhu s HIS 41 Cb -0.04 -1.35 0.02 0.00 1.11 0.00 0.00 32.58 32.31 2qhu s HIS 41 CO 0.06 0.25 1.25 -2.14 -0.85 0.00 0.00 174.74 173.32 2qhu s PRO 42 N -1.66 2.27 -0.42 8.40 0.02 -1.26 -2.60 135.00 139.75 2qhu s PRO 42 Ca 0.14 1.92 -0.45 0.00 0.02 0.00 0.00 61.00 62.62 2qhu s PRO 42 Cb -0.10 -1.83 -0.19 0.00 0.02 0.00 0.00 34.50 32.40 2qhu s PRO 42 CO 0.05 -1.77 1.59 0.54 -0.33 0.00 0.00 177.00 177.08 2qhu n ARG 43 N -2.39 0.23 -3.74 5.54 1.74 -1.25 -4.61 116.66 112.18 2qhu n ARG 43 Ca 0.15 0.09 -0.13 0.00 -0.77 0.00 0.00 57.85 57.18 2qhu n ARG 43 Cb 0.49 -1.62 -0.10 0.00 -1.02 0.00 0.00 32.46 30.21 2qhu n ARG 43 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2qhu s VAL 44 N 2.89 0.01 -0.11 1.55 0.11 0.18 -1.37 120.40 123.66 2qhu s VAL 44 Ca 1.03 -0.12 0.01 0.00 -2.93 0.00 0.00 61.98 59.97 2qhu s VAL 44 Cb -1.40 -0.56 -0.01 0.00 -1.53 0.00 0.00 36.38 32.88 2qhu s VAL 44 CO 0.77 -0.06 -0.16 -0.63 -3.33 0.00 0.00 175.10 171.68 2qhu s ILE 45 N -0.21 2.76 0.03 7.04 1.01 0.16 -0.93 121.20 131.06 2qhu s ILE 45 Ca -0.04 -0.77 0.07 0.00 0.00 0.00 0.00 60.65 59.91 2qhu s ILE 45 Cb -0.03 -2.13 -0.03 0.00 0.01 0.00 0.00 42.46 40.28 2qhu s ILE 45 CO 0.02 0.54 -0.18 0.42 0.00 0.00 0.00 174.94 175.74 2qhu s THR 46 N 0.26 2.78 -0.25 2.92 -4.23 -0.40 -1.39 115.64 115.34 2qhu s THR 46 Ca -0.11 -1.15 0.03 0.00 -1.18 0.00 0.00 61.69 59.27 2qhu s THR 46 Cb -0.16 -2.16 0.05 0.00 1.34 0.00 0.00 72.50 71.58 2qhu s THR 46 CO 0.06 0.36 -0.12 -0.76 -0.54 0.00 0.00 174.62 173.63 2qhu s LEU 47 N -1.36 3.21 0.00 4.79 1.43 0.36 -1.46 118.68 125.65 2qhu s LEU 47 Ca 0.14 -1.28 0.00 0.00 -1.03 0.00 0.00 54.13 51.96 2qhu s LEU 47 Cb -0.10 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.61 2qhu s LEU 47 CO 0.05 -0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.07 2qhu n GLY 48 N 4.48 -0.06 0.26 -3.19 0.00 0.74 -1.22 105.19 106.21 2qhu n GLY 48 Ca -0.15 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.12 2qhu n GLY 48 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qhu h ARG 49 N 0.00 0.61 -0.01 1.61 3.08 -1.34 -2.55 114.38 115.79 2qhu h ARG 49 Ca 0.00 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.01 2qhu h ARG 49 Cb 0.00 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 29.91 2qhu h ARG 49 CO 0.00 0.40 -0.04 1.63 -1.07 0.00 0.00 179.97 180.89 2qhu n LYS 50 N -4.84 1.06 -2.80 0.04 4.76 -0.85 -4.95 118.16 110.58 2qhu n LYS 50 Ca 0.10 -0.35 -0.36 0.00 -2.87 0.00 0.00 58.31 54.83 2qhu n LYS 50 Cb 0.23 -1.49 -0.07 0.00 -1.84 0.00 0.00 35.03 31.87 2qhu n LYS 50 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2qhu s ALA 51 N -2.18 3.16 0.38 7.82 0.00 -0.96 -4.79 121.76 125.18 2qhu s ALA 51 Ca 0.38 0.48 0.06 0.00 0.00 0.00 0.00 51.96 52.87 2qhu s ALA 51 Cb 0.21 -3.17 -0.02 0.00 0.00 0.00 0.00 23.12 20.14 2qhu s ALA 51 CO 0.40 0.16 0.21 0.95 0.00 0.00 0.00 175.76 177.48 2qhu s THR 52 N -1.80 0.27 0.27 0.00 -4.23 -1.26 -4.91 115.64 103.97 2qhu s THR 52 Ca 0.54 -2.00 0.33 0.00 -1.18 0.00 0.00 61.69 59.38 2qhu s THR 52 Cb -0.15 -2.39 0.36 0.00 1.34 0.00 0.00 72.50 71.66 2qhu s THR 52 CO 0.20 0.00 2.05 1.23 -0.54 0.00 0.00 174.62 177.56 2qhu h GLY 53 N 1.92 0.00 1.56 3.99 0.00 -1.98 -2.47 103.07 106.09 2qhu h GLY 53 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.03 2qhu h GLY 53 CO 0.45 0.00 0.00 -1.84 0.00 0.00 0.00 176.54 175.15 2qhu n GLU 54 N -3.23 0.44 0.00 4.80 0.28 -1.26 -2.33 120.64 119.35 2qhu n GLU 54 Ca -0.01 0.00 0.12 0.00 -0.16 0.00 0.00 57.16 57.11 2qhu n GLU 54 Cb 0.27 -1.50 0.53 0.00 1.43 0.00 0.00 31.44 32.17 2qhu n GLU 54 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2qhu n ASN 55 N -1.28 0.00 -4.47 -1.84 3.02 -0.93 -4.63 115.26 105.13 2qhu n ASN 55 Ca 0.14 0.48 -0.36 0.00 -0.03 0.00 0.00 54.58 54.82 2qhu n ASN 55 Cb 0.24 -0.49 -0.12 0.00 -0.61 0.00 0.00 39.78 38.79 2qhu n ASN 55 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2qhu s LEU 56 N -2.99 3.41 0.12 3.41 1.43 -0.98 -0.72 118.68 122.36 2qhu s LEU 56 Ca 0.12 -0.17 -0.14 0.00 -1.03 0.00 0.00 54.13 52.91 2qhu s LEU 56 Cb 0.16 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.46 2qhu s LEU 56 CO 0.45 0.03 1.53 0.25 0.23 0.00 0.00 176.35 178.84 2qhu h LEU 57 N 7.73 0.74-10.41 1.79 6.46 -1.73 -3.45 115.31 116.44 2qhu h LEU 57 Ca -0.37 -0.36 -0.42 0.00 -0.12 0.00 0.00 57.88 56.61 2qhu h LEU 57 Cb 1.18 -0.20 0.02 0.00 -0.73 0.00 0.00 40.66 40.92 2qhu h LEU 57 CO 0.61 0.93 -0.28 -0.36 -0.62 0.00 0.00 178.44 178.72 2qhu s PHE 58 N -4.80 2.86 0.67 1.25 0.40 -1.26 -5.09 117.98 112.01 2qhu s PHE 58 Ca -0.13 -0.37 -0.17 0.00 -0.60 0.00 0.00 56.93 55.67 2qhu s PHE 58 Cb 0.10 -2.31 0.01 0.00 0.51 0.00 0.00 43.02 41.32 2qhu s PHE 58 CO 0.81 -0.34 1.22 -2.14 0.70 0.00 0.00 175.22 175.46 2qhu s PRO 59 N -4.32 2.48 0.54 0.24 0.02 -1.26 -4.90 135.00 127.80 2qhu s PRO 59 Ca 0.53 1.82 0.30 0.00 0.02 0.00 0.00 61.00 63.67 2qhu s PRO 59 Cb -0.10 -1.87 1.51 0.00 0.02 0.00 0.00 34.50 34.06 2qhu s PRO 59 CO 0.33 -1.58 2.07 1.05 -0.33 0.00 0.00 177.00 178.53 2qhu h GLU 60 N 0.21 0.00 -0.36 5.54 4.11 -1.95 -0.96 114.58 121.17 2qhu h GLU 60 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 2qhu h GLU 60 Cb 1.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.53 2qhu h GLU 60 CO 0.52 0.10 0.23 0.66 0.07 0.00 0.00 179.01 180.59 2qhu h SER 61 N 0.00 0.42 -0.83 3.06 4.64 -2.02 -2.35 113.55 116.47 2qhu h SER 61 Ca -0.00 -0.01 0.01 0.00 -0.47 0.00 0.00 61.79 61.32 2qhu h SER 61 Cb 0.36 -0.11 -0.04 0.00 -0.31 0.00 0.00 62.40 62.30 2qhu h SER 61 CO 0.01 0.32 0.55 -0.25 -0.87 0.00 0.00 176.83 176.59 2qhu h TRP 62 N 0.50 1.05 -0.23 4.77 7.01 -1.52 -2.51 115.95 125.01 2qhu h TRP 62 Ca 0.13 0.02 -0.00 0.00 2.11 0.00 0.00 58.89 61.15 2qhu h TRP 62 Cb -0.04 -0.35 -0.01 0.00 -2.10 0.00 0.00 29.16 26.66 2qhu h TRP 62 CO 0.00 0.65 0.13 1.88 -2.79 0.00 0.00 178.44 178.31 2qhu h TYR 63 N 1.12 0.31 -0.02 2.65 -1.99 -1.50 -1.54 116.97 116.01 2qhu h TYR 63 Ca 0.31 -0.01 -0.10 0.00 2.00 0.00 0.00 58.73 60.93 2qhu h TYR 63 Cb -0.12 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 38.50 2qhu h TYR 63 CO -0.01 0.26 -0.45 0.00 -0.00 0.00 0.00 178.16 177.96 2qhu h ARG 64 N 0.26 0.04 0.00 4.88 3.08 -1.56 -1.26 114.38 119.83 2qhu h ARG 64 Ca 0.08 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 2qhu h ARG 64 Cb 0.05 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 2qhu h ARG 64 CO -0.01 0.49 -0.25 1.49 -1.07 0.00 0.00 179.97 180.62 2qhu h GLU 65 N 0.03 0.00 -0.30 0.04 4.57 -1.10 -3.25 114.58 114.58 2qhu h GLU 65 Ca -0.00 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.04 2qhu h GLU 65 Cb 0.82 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 29.32 2qhu h GLU 65 CO 0.06 0.25 -0.11 0.09 -1.18 0.00 0.00 179.01 178.12 2qhu n ASN 66 N -3.45 2.55 0.00 1.04 4.13 -0.61 -4.97 115.26 113.96 2qhu n ASN 66 Ca -0.00 -3.68 0.00 0.00 1.68 0.00 0.00 54.58 52.58 2qhu n ASN 66 Cb 0.43 -0.61 0.00 0.00 -1.54 0.00 0.00 39.78 38.06 2qhu n ASN 66 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qhu n GLY 67 N -1.07 0.74 3.86 7.41 0.00 -1.07 -5.00 105.19 110.06 2qhu n GLY 67 Ca 0.30 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.96 2qhu n GLY 67 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2qhu s PHE 68 N -2.47 3.62 0.37 1.61 0.40 -0.55 -4.59 117.98 116.37 2qhu s PHE 68 Ca 0.00 0.77 -0.02 0.00 -0.60 0.00 0.00 56.93 57.08 2qhu s PHE 68 Cb 0.00 -2.13 -0.04 0.00 0.51 0.00 0.00 43.02 41.36 2qhu s PHE 68 CO 0.00 0.60 0.61 -1.21 0.70 0.00 0.00 175.22 175.92 2qhu s GLU 69 N -1.55 3.53 -0.04 0.44 2.02 -0.47 -3.71 118.70 118.93 2qhu s GLU 69 Ca 0.27 -0.13 -0.01 0.00 0.02 0.00 0.00 54.97 55.12 2qhu s GLU 69 Cb -0.14 -2.58 0.03 0.00 0.10 0.00 0.00 34.13 31.53 2qhu s GLU 69 CO 0.15 0.07 0.08 -1.17 0.02 0.00 0.00 175.26 174.41 2qhu s LEU 70 N -4.27 1.02 0.02 1.80 0.20 -1.26 -0.67 118.68 115.52 2qhu s LEU 70 Ca 0.43 0.16 -0.00 0.00 0.69 0.00 0.00 54.13 55.40 2qhu s LEU 70 Cb -0.10 0.15 -0.02 0.00 -0.43 0.00 0.00 46.19 45.79 2qhu s LEU 70 CO 0.37 -0.12 -0.02 -0.31 -0.29 0.00 0.00 176.35 175.98 2qhu s TYR 71 N 0.98 0.21 -0.23 5.38 1.51 -0.48 -4.98 117.35 119.74 2qhu s TYR 71 Ca -0.08 -0.43 -0.11 0.00 -1.01 0.00 0.00 57.07 55.45 2qhu s TYR 71 Cb -0.11 -0.15 -0.05 0.00 -0.11 0.00 0.00 41.96 41.54 2qhu s TYR 71 CO -0.04 -0.16 0.17 -1.58 -1.11 0.00 0.00 175.55 172.83 2qhu s TRP 72 N -1.22 3.34 0.25 2.71 0.52 -1.26 -0.48 118.94 122.80 2qhu s TRP 72 Ca -0.13 0.27 0.03 0.00 0.02 0.00 0.00 56.10 56.29 2qhu s TRP 72 Cb -0.08 -2.26 -0.05 0.00 -1.15 0.00 0.00 33.47 29.92 2qhu s TRP 72 CO -0.01 0.11 0.03 0.14 0.02 0.00 0.00 176.95 177.24 2qhu s VAL 73 N 0.93 0.97 -0.26 4.03 -7.23 -0.36 -4.92 120.40 113.56 2qhu s VAL 73 Ca 0.08 -2.02 0.13 0.00 -1.81 0.00 0.00 61.98 58.36 2qhu s VAL 73 Cb -0.13 -2.48 0.75 0.00 0.56 0.00 0.00 36.38 35.08 2qhu s VAL 73 CO 0.03 -0.21 1.72 -0.62 -0.31 0.00 0.00 175.10 175.71 2qhu n GLU 74 N -0.47 4.13 -2.07 4.82 1.02 -1.26 -3.68 120.64 123.13 2qhu n GLU 74 Ca -0.04 -3.10 -0.30 0.00 -0.02 0.00 0.00 57.16 53.70 2qhu n GLU 74 Cb 0.65 -2.18 0.01 0.00 -0.02 0.00 0.00 31.44 29.89 2qhu n GLU 74 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 2qhu s ARG 75 N -2.88 3.60 0.72 3.49 1.70 -1.26 -4.73 118.95 119.59 2qhu s ARG 75 Ca 0.53 0.63 -0.16 0.00 -0.47 0.00 0.00 55.73 56.26 2qhu s ARG 75 Cb 0.42 -2.15 0.03 0.00 -0.57 0.00 0.00 34.95 32.68 2qhu s ARG 75 CO 0.14 -0.47 1.23 0.20 -1.08 0.00 0.00 175.30 175.31 2qhu s GLY 76 N -4.12 2.46 0.00 3.88 0.00 -0.50 -1.98 107.32 107.05 2qhu s GLY 76 Ca 0.53 0.97 0.00 0.00 0.00 0.00 0.00 44.72 46.22 2qhu s GLY 76 CO 0.51 1.38 0.00 0.61 0.00 0.00 0.00 173.10 175.60 2qhu n GLY 77 N 0.56 0.28 0.00 0.20 0.00 -1.26 -4.48 105.19 100.49 2qhu n GLY 77 Ca 0.14 -2.03 0.00 0.00 0.00 0.00 0.00 46.02 44.14 2qhu n GLY 77 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2qhu n ASP 78 N -0.17 0.00 -4.87 1.61 3.85 -1.26 -2.02 116.55 113.70 2qhu n ASP 78 Ca 0.00 0.00 -0.36 0.00 -0.71 0.00 0.00 54.79 53.72 2qhu n ASP 78 Cb 0.00 0.00 -0.06 0.00 -1.35 0.00 0.00 41.12 39.71 2qhu n ASP 78 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 2qhu s VAL 79 N 1.35 5.22 0.18 2.12 0.11 -1.26 -0.18 120.40 127.93 2qhu s VAL 79 Ca 0.00 0.39 -0.06 0.00 -2.93 0.00 0.00 61.98 59.38 2qhu s VAL 79 Cb 0.00 -3.59 -0.02 0.00 -1.53 0.00 0.00 36.38 31.24 2qhu s VAL 79 CO 0.00 0.43 0.23 0.28 -3.33 0.00 0.00 175.10 172.71 2qhu s THR 80 N -1.24 0.05 -0.06 5.04 -1.32 -0.54 -4.85 115.64 112.73 2qhu s THR 80 Ca 0.26 -1.65 0.05 0.00 -1.21 0.00 0.00 61.69 59.14 2qhu s THR 80 Cb -0.14 -2.11 -0.02 0.00 -1.51 0.00 0.00 72.50 68.73 2qhu s THR 80 CO 0.14 -0.21 -0.20 -0.47 -2.21 0.00 0.00 174.62 171.67 2qhu s TYR 81 N -4.04 2.56 0.03 9.09 5.04 -1.26 -1.27 117.35 127.49 2qhu s TYR 81 Ca 0.25 -0.50 0.07 0.00 -2.44 0.00 0.00 57.07 54.45 2qhu s TYR 81 Cb 0.04 -1.63 -0.02 0.00 0.35 0.00 0.00 41.96 40.70 2qhu s TYR 81 CO 0.05 -0.07 -0.21 -1.01 -1.34 0.00 0.00 175.55 172.97 2qhu s HIS 82 N -0.32 1.83 0.25 4.97 3.76 -0.11 -5.01 115.29 120.66 2qhu s HIS 82 Ca 0.02 -0.37 -0.21 0.00 -0.15 0.00 0.00 55.06 54.35 2qhu s HIS 82 Cb -0.13 -1.11 0.05 0.00 1.11 0.00 0.00 32.58 32.51 2qhu s HIS 82 CO 0.02 0.06 0.88 0.20 -0.85 0.00 0.00 174.74 175.05 2qhu s GLY 83 N -1.02 0.03 0.30 -2.22 0.00 -1.24 -0.65 107.32 102.51 2qhu s GLY 83 Ca 0.08 -0.30 -0.29 0.00 0.00 0.00 0.00 44.72 44.20 2qhu s GLY 83 CO 0.01 0.40 1.25 -1.05 0.00 0.00 0.00 173.10 173.71 2qhu n PRO 84 N -0.53 1.88 -0.03 2.90 -0.02 -1.07 -1.90 135.00 136.23 2qhu n PRO 84 Ca -0.05 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 2qhu n PRO 84 Cb 0.60 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 2qhu n PRO 84 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2qhu n GLY 85 N 1.26 0.93 3.63 -1.23 0.00 -1.26 -4.08 105.19 104.44 2qhu n GLY 85 Ca 0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 2qhu n GLY 85 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2qhu s GLN 86 N -0.68 4.04 -0.47 1.61 0.74 -0.80 -0.40 119.66 123.71 2qhu s GLN 86 Ca 0.00 -0.16 -0.28 0.00 0.05 0.00 0.00 55.36 54.96 2qhu s GLN 86 Cb 0.00 -3.59 0.03 0.00 1.10 0.00 0.00 33.01 30.54 2qhu s GLN 86 CO 0.00 -0.08 1.08 -1.17 -0.55 0.00 0.00 175.29 174.57 2qhu s LEU 87 N 1.47 3.74 -0.18 3.68 2.96 0.47 -4.51 118.68 126.32 2qhu s LEU 87 Ca 0.10 0.41 -0.13 0.00 -0.22 0.00 0.00 54.13 54.29 2qhu s LEU 87 Cb -0.15 -3.46 -0.05 0.00 0.50 0.00 0.00 46.19 43.03 2qhu s LEU 87 CO 0.08 -1.19 0.28 -0.69 -1.32 0.00 0.00 176.35 173.51 2qhu s VAL 88 N 4.25 5.31 -0.11 1.68 1.01 0.11 -0.81 120.40 131.83 2qhu s VAL 88 Ca 0.45 0.50 0.03 0.00 0.00 0.00 0.00 61.98 62.97 2qhu s VAL 88 Cb -0.08 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.69 2qhu s VAL 88 CO 0.30 0.37 -0.21 -0.83 0.00 0.00 0.00 175.10 174.72 2qhu s GLY 89 N 0.60 1.27 -0.51 4.51 0.00 -0.51 -1.26 107.32 111.41 2qhu s GLY 89 Ca 0.15 -0.95 -0.00 0.00 0.00 0.00 0.00 44.72 43.92 2qhu s GLY 89 CO 0.04 -0.12 0.29 -0.19 0.00 0.00 0.00 173.10 173.12 2qhu s TYR 90 N 0.61 3.46 -0.40 1.90 2.02 0.89 -1.02 117.35 124.81 2qhu s TYR 90 Ca -0.13 -2.77 -0.27 0.00 -0.37 0.00 0.00 57.07 53.52 2qhu s TYR 90 Cb -0.17 -3.09 0.02 0.00 -0.40 0.00 0.00 41.96 38.32 2qhu s TYR 90 CO 0.03 -0.87 1.02 -1.25 -1.57 0.00 0.00 175.55 172.92 2qhu s PRO 91 N 0.33 3.82 -0.67 -1.71 0.04 -1.24 -1.27 135.00 134.31 2qhu s PRO 91 Ca 0.14 0.64 -0.09 0.00 0.04 0.00 0.00 61.00 61.73 2qhu s PRO 91 Cb -0.22 -3.83 0.17 0.00 0.04 0.00 0.00 34.50 30.66 2qhu s PRO 91 CO -0.03 -1.10 0.56 0.42 0.04 0.00 0.00 177.00 176.89 2qhu s ILE 92 N 3.83 4.66 0.01 0.56 1.01 0.84 -4.25 121.20 127.86 2qhu s ILE 92 Ca 0.42 -2.45 0.05 0.00 0.00 0.00 0.00 60.65 58.67 2qhu s ILE 92 Cb -0.10 -3.96 -0.02 0.00 0.01 0.00 0.00 42.46 38.39 2qhu s ILE 92 CO 0.23 -0.92 -0.15 -0.36 0.00 0.00 0.00 174.94 173.74 2qhu s PHE 93 N 0.40 1.35 -1.25 3.97 0.40 -1.25 -1.49 117.98 120.11 2qhu s PHE 93 Ca 0.14 -0.29 -0.20 0.00 -0.60 0.00 0.00 56.93 55.98 2qhu s PHE 93 Cb -0.18 -0.84 0.01 0.00 0.51 0.00 0.00 43.02 42.52 2qhu s PHE 93 CO -0.05 0.00 1.81 -1.25 0.70 0.00 0.00 175.22 176.44 2qhu s PRO 94 N -0.64 3.40 0.41 0.24 0.04 -1.26 -1.59 135.00 135.59 2qhu s PRO 94 Ca 0.05 -1.65 0.21 0.00 0.04 0.00 0.00 61.00 59.65 2qhu s PRO 94 Cb -0.07 -5.42 0.28 0.00 0.04 0.00 0.00 34.50 29.34 2qhu s PRO 94 CO 0.00 -2.93 1.57 -0.39 0.04 0.00 0.00 177.00 175.30 2qhu h VAL 95 N 5.84 0.18 0.00 -0.36 -1.51 -1.69 -3.48 116.25 115.22 2qhu h VAL 95 Ca 0.35 -1.25 0.00 0.00 -1.23 0.00 0.00 66.70 64.57 2qhu h VAL 95 Cb 0.90 2.09 0.00 0.00 -2.13 0.00 0.00 31.29 32.15 2qhu h VAL 95 CO 1.37 0.10 0.00 0.61 -1.23 0.00 0.00 177.57 178.42 2qhu n GLY 96 N 1.13 1.78 0.04 5.19 0.00 -0.60 -3.53 105.19 109.20 2qhu n GLY 96 Ca 0.04 -0.50 0.12 0.00 0.00 0.00 0.00 46.02 45.67 2qhu n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2qhu n ARG 97 N 12.95 0.22 -2.50 1.61 1.74 -1.26 -4.61 116.66 124.82 2qhu n ARG 97 Ca 0.00 0.04 -0.43 0.00 -0.77 0.00 0.00 57.85 56.69 2qhu n ARG 97 Cb 0.00 -1.62 0.01 0.00 -1.02 0.00 0.00 32.46 29.83 2qhu n ARG 97 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2qhu n GLU 98 N -1.92 3.84 -0.05 5.56 1.02 -1.23 -4.77 120.64 123.08 2qhu n GLU 98 Ca 0.03 -3.78 -0.14 0.00 -0.02 0.00 0.00 57.16 53.25 2qhu n GLU 98 Cb 0.41 -2.82 -0.07 0.00 -0.02 0.00 0.00 31.44 28.94 2qhu n GLU 98 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2qhu h VAL 99 N 3.66 1.35 -0.97 2.62 2.07 -1.86 -2.65 116.25 120.46 2qhu h VAL 99 Ca 0.35 -1.58 0.04 0.00 0.82 0.00 0.00 66.70 66.32 2qhu h VAL 99 Cb 0.62 1.96 -0.06 0.00 -1.52 0.00 0.00 31.29 32.29 2qhu h VAL 99 CO 1.56 0.48 0.64 0.03 0.02 0.00 0.00 177.57 180.29 2qhu h ARG 100 N 0.15 1.19 -0.59 1.57 3.08 -2.00 -0.39 114.38 117.39 2qhu h ARG 100 Ca 0.01 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 2qhu h ARG 100 Cb 0.93 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 30.68 2qhu h ARG 100 CO 0.07 0.79 0.22 -0.09 -1.07 0.00 0.00 179.97 179.89 2qhu h ARG 101 N 1.23 0.90 -0.55 0.04 2.43 -1.95 -1.59 114.38 114.88 2qhu h ARG 101 Ca 0.39 -0.17 -0.01 0.00 -0.81 0.00 0.00 59.98 59.38 2qhu h ARG 101 Cb 0.01 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.39 2qhu h ARG 101 CO -0.12 0.78 0.31 0.35 -1.51 0.00 0.00 179.97 179.78 2qhu h PHE 102 N 0.83 0.76 -0.80 2.20 3.57 -0.99 -1.58 116.94 120.93 2qhu h PHE 102 Ca 0.20 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.70 2qhu h PHE 102 Cb 0.23 -0.24 -0.05 0.00 2.79 0.00 0.00 35.95 38.68 2qhu h PHE 102 CO 0.01 0.55 0.51 -0.07 -2.23 0.00 0.00 178.31 177.09 2qhu h LEU 103 N 0.75 0.86 -1.07 0.59 3.38 -0.87 -1.37 115.31 117.57 2qhu h LEU 103 Ca 0.20 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.10 2qhu h LEU 103 Cb 0.04 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.57 2qhu h LEU 103 CO -0.03 0.60 0.08 0.03 0.09 0.00 0.00 178.44 179.21 2qhu h ARG 104 N 1.02 0.75 -0.53 1.13 3.08 -0.93 -1.45 114.38 117.45 2qhu h ARG 104 Ca 0.31 -0.16 -0.12 0.00 0.07 0.00 0.00 59.98 60.08 2qhu h ARG 104 Cb -0.03 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.90 2qhu h ARG 104 CO -0.10 0.70 -0.14 1.96 -1.07 0.00 0.00 179.97 181.32 2qhu h GLN 105 N 0.72 1.02 0.05 0.04 4.20 -0.66 0.15 115.11 120.62 2qhu h GLN 105 Ca 0.16 -0.40 -0.00 0.00 0.06 0.00 0.00 58.65 58.47 2qhu h GLN 105 Cb 0.32 -0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.04 2qhu h GLN 105 CO 0.00 1.08 -0.02 0.82 -0.67 0.00 0.00 178.83 180.04 2qhu h ILE 106 N 0.90 1.02 -0.56 2.54 2.04 -1.00 -1.76 117.51 120.68 2qhu h ILE 106 Ca 0.13 -0.22 0.11 0.00 1.00 0.00 0.00 64.86 65.89 2qhu h ILE 106 Cb 0.72 1.17 -0.11 0.00 -0.74 0.00 0.00 36.82 37.85 2qhu h ILE 106 CO 0.05 0.06 -0.17 -0.33 0.00 0.00 0.00 178.15 177.76 2qhu h GLU 107 N -0.16 -0.03 -0.78 2.37 5.08 -1.19 -1.78 114.58 118.11 2qhu h GLU 107 Ca -0.01 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.39 2qhu h GLU 107 Cb 0.14 0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 2qhu h GLU 107 CO 0.01 -0.02 0.49 1.49 -1.00 0.00 0.00 179.01 179.99 2qhu h GLU 108 N -0.03 0.93 -0.53 2.33 4.81 -0.75 -0.66 114.58 120.68 2qhu h GLU 108 Ca 0.27 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 2qhu h GLU 108 Cb 0.44 -0.21 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 2qhu h GLU 108 CO -0.60 0.61 0.29 0.00 -0.73 0.00 0.00 179.01 178.59 2qhu h ALA 109 N 1.33 0.68 -0.62 2.92 0.00 -0.57 -0.59 119.26 122.40 2qhu h ALA 109 Ca 0.31 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 55.04 2qhu h ALA 109 Cb 0.02 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2qhu h ALA 109 CO -0.11 0.20 0.04 0.82 0.00 0.00 0.00 179.25 180.19 2qhu h ILE 110 N 0.71 1.26 -0.66 0.00 1.08 -0.90 -1.20 117.51 117.81 2qhu h ILE 110 Ca 0.19 -1.10 0.01 0.00 -0.39 0.00 0.00 64.86 63.57 2qhu h ILE 110 Cb 0.04 0.74 -0.03 0.00 -3.07 0.00 0.00 36.82 34.49 2qhu h ILE 110 CO -0.03 0.41 0.43 0.58 -0.69 0.00 0.00 178.15 178.85 2qhu h VAL 111 N 0.98 1.15 -0.46 1.67 2.07 -0.67 -1.27 116.25 119.72 2qhu h VAL 111 Ca 0.18 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.40 2qhu h VAL 111 Cb 0.51 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 2qhu h VAL 111 CO 0.02 0.16 0.28 0.03 0.02 0.00 0.00 177.57 178.08 2qhu h ARG 112 N 0.87 0.63 -0.06 1.57 3.08 -0.76 -0.91 114.38 118.81 2qhu h ARG 112 Ca 0.25 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.27 2qhu h ARG 112 Cb -0.08 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 29.81 2qhu h ARG 112 CO -0.06 0.47 -0.15 0.28 -1.07 0.00 0.00 179.97 179.43 2qhu h VAL 113 N 0.62 0.61 -0.76 2.04 2.07 -0.85 -1.57 116.25 118.41 2qhu h VAL 113 Ca 0.17 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.76 2qhu h VAL 113 Cb 0.00 0.61 -0.06 0.00 -1.52 0.00 0.00 31.29 30.32 2qhu h VAL 113 CO -0.03 0.00 0.43 0.00 0.02 0.00 0.00 177.57 177.99 2qhu h ALA 114 N 0.77 1.04 -0.43 1.67 0.00 -1.03 -1.74 119.26 119.54 2qhu h ALA 114 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2qhu h ALA 114 Cb 0.32 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2qhu h ALA 114 CO -0.19 0.10 0.29 0.00 0.00 0.00 0.00 179.25 179.45 2qhu h ALA 115 N 1.40 1.69 0.00 0.00 0.00 -0.74 0.33 119.26 121.94 2qhu h ALA 115 Ca 0.35 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.21 2qhu h ALA 115 Cb 0.25 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.86 2qhu h ALA 115 CO -0.21 0.29 -0.07 0.78 0.00 0.00 0.00 179.25 180.04 2qhu h GLY 116 N 0.59 0.00 -1.47 0.00 0.00 -0.35 -1.57 103.07 100.26 2qhu h GLY 116 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 2qhu h GLY 116 CO -0.03 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.79 2qhu n TYR 117 N -3.75 0.11 -0.84 5.60 4.02 -0.54 -4.93 117.16 116.83 2qhu n TYR 117 Ca -0.02 -0.06 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 2qhu n TYR 117 Cb 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.49 2qhu n TYR 117 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2qhu n GLY 118 N 1.30 0.50 3.52 2.72 0.00 -0.59 -5.05 105.19 107.59 2qhu n GLY 118 Ca 0.17 -0.77 -0.34 0.00 0.00 0.00 0.00 46.02 45.08 2qhu n GLY 118 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2qhu s ILE 119 N -2.00 4.11 -0.46 -0.61 1.01 -0.00 -4.98 121.20 118.26 2qhu s ILE 119 Ca 0.00 -0.28 -0.24 0.00 0.00 0.00 0.00 60.65 60.14 2qhu s ILE 119 Cb 0.00 -2.83 0.03 0.00 0.01 0.00 0.00 42.46 39.67 2qhu s ILE 119 CO 0.00 0.47 0.83 -0.55 0.00 0.00 0.00 174.94 175.69 2qhu s SER 120 N 0.53 6.43 0.23 3.58 0.15 -1.26 -2.56 113.70 120.79 2qhu s SER 120 Ca -0.01 -0.05 0.10 0.00 0.70 0.00 0.00 55.95 56.69 2qhu s SER 120 Cb -0.14 -2.41 -0.04 0.00 -1.71 0.00 0.00 66.02 61.72 2qhu s SER 120 CO 0.02 -0.97 -0.13 0.00 1.20 0.00 0.00 173.24 173.36 2qhu s ALA 121 N 3.45 2.85 0.02 5.45 0.00 -1.26 -4.61 121.76 127.66 2qhu s ALA 121 Ca 0.32 -1.65 -0.12 0.00 0.00 0.00 0.00 51.96 50.50 2qhu s ALA 121 Cb -0.11 -0.53 0.02 0.00 0.00 0.00 0.00 23.12 22.49 2qhu s ALA 121 CO 0.24 0.37 0.27 1.52 0.00 0.00 0.00 175.76 178.15 2qhu s TYR 122 N -2.03 -0.08 0.43 0.00 1.13 0.43 -4.91 117.35 112.33 2qhu s TYR 122 Ca 0.27 -0.01 0.17 0.00 -1.41 0.00 0.00 57.07 56.08 2qhu s TYR 122 Cb -0.07 0.05 1.04 0.00 -1.10 0.00 0.00 41.96 41.88 2qhu s TYR 122 CO 0.15 -0.44 1.98 -1.35 -2.51 0.00 0.00 175.55 173.38 2qhu h PRO 123 N 3.54 0.00 -1.51 -3.49 0.11 -1.86 0.65 132.00 129.44 2qhu h PRO 123 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 2qhu h PRO 123 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 2qhu h PRO 123 CO 0.44 0.21 -0.38 0.25 -0.21 0.00 0.00 178.00 178.31 2qhu n THR 124 N -4.13 -2.40 0.30 -1.15 -2.24 -1.26 -4.47 114.28 98.92 2qhu n THR 124 Ca -0.02 0.89 0.17 0.00 -2.27 0.00 0.00 64.05 62.83 2qhu n THR 124 Cb 0.28 -1.27 0.95 0.00 -2.10 0.00 0.00 70.33 68.18 2qhu n THR 124 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 2qhu h PRO 125 N 0.54 0.00 0.00 -0.78 0.11 -1.99 -3.37 132.00 126.50 2qhu h PRO 125 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2qhu h PRO 125 Cb 0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.20 2qhu h PRO 125 CO 0.00 0.03 -0.15 0.41 -0.21 0.00 0.00 178.00 178.08 2qhu n GLY 126 N -0.90 0.82 3.18 -0.55 0.00 -1.26 -5.03 105.19 101.46 2qhu n GLY 126 Ca -0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 2qhu n GLY 126 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qhu s TYR 127 N -1.02 2.07 0.58 1.61 2.02 -1.26 -4.87 117.35 116.49 2qhu s TYR 127 Ca 0.00 -0.66 -0.20 0.00 -0.37 0.00 0.00 57.07 55.83 2qhu s TYR 127 Cb 0.00 -1.39 -0.03 0.00 -0.40 0.00 0.00 41.96 40.14 2qhu s TYR 127 CO 0.00 -0.23 1.35 0.00 -1.57 0.00 0.00 175.55 175.09 2qhu s ALA 128 N 0.07 2.67 0.00 3.71 0.00 -1.26 -4.61 121.76 122.34 2qhu s ALA 128 Ca -0.07 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.20 2qhu s ALA 128 Cb -0.14 -3.57 0.00 0.00 0.00 0.00 0.00 23.12 19.41 2qhu s ALA 128 CO 0.04 -1.48 0.00 0.41 0.00 0.00 0.00 175.76 174.73 2qhu n GLY 129 N 0.79 -2.95 3.38 0.00 0.00 -1.26 -4.87 105.19 100.28 2qhu n GLY 129 Ca 0.12 -1.86 -0.33 0.00 0.00 0.00 0.00 46.02 43.96 2qhu n GLY 129 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qhu s VAL 130 N -0.65 2.81 0.17 1.61 1.01 0.61 -4.50 120.40 121.46 2qhu s VAL 130 Ca 0.00 -0.78 0.10 0.00 0.00 0.00 0.00 61.98 61.31 2qhu s VAL 130 Cb 0.00 -2.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.21 2qhu s VAL 130 CO 0.00 0.56 -0.22 0.26 0.00 0.00 0.00 175.10 175.70 2qhu s TRP 131 N -0.08 2.10 -0.25 5.22 0.52 0.22 -0.49 118.94 126.18 2qhu s TRP 131 Ca -0.03 -0.40 0.01 0.00 0.02 0.00 0.00 56.10 55.69 2qhu s TRP 131 Cb -0.14 -1.06 0.07 0.00 -1.15 0.00 0.00 33.47 31.19 2qhu s TRP 131 CO 0.04 0.41 -0.02 0.08 0.02 0.00 0.00 176.95 177.48 2qhu s VAL 132 N -1.71 1.45 0.00 4.03 1.01 -0.31 -0.43 120.40 124.44 2qhu s VAL 132 Ca 0.17 -1.28 0.00 0.00 0.00 0.00 0.00 61.98 60.88 2qhu s VAL 132 Cb -0.07 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.51 2qhu s VAL 132 CO 0.08 -0.20 0.00 0.61 0.00 0.00 0.00 175.10 175.59 2qhu n GLY 133 N 4.68 3.64 0.65 4.51 0.00 -1.26 -2.15 105.19 115.26 2qhu n GLY 133 Ca -0.10 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 45.95 2qhu n GLY 133 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2qhu n GLU 134 N 14.00 1.83 -5.17 1.61 0.28 -1.26 -4.90 120.64 127.02 2qhu n GLU 134 Ca 0.00 -1.27 -0.31 0.00 -0.16 0.00 0.00 57.16 55.42 2qhu n GLU 134 Cb 0.00 -1.34 -0.15 0.00 1.43 0.00 0.00 31.44 31.38 2qhu n GLU 134 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 2qhu s ASP 135 N -1.25 3.26 -0.27 -1.84 1.01 -0.91 -0.55 116.67 116.11 2qhu s ASP 135 Ca 0.29 -0.44 -0.23 0.00 0.71 0.00 0.00 52.55 52.88 2qhu s ASP 135 Cb 0.15 -0.43 -0.01 0.00 1.01 0.00 0.00 42.92 43.65 2qhu s ASP 135 CO 0.21 0.31 0.77 -0.75 0.21 0.00 0.00 175.17 175.93 2qhu s LYS 136 N -0.74 4.08 -0.01 8.23 2.20 -0.20 -1.16 119.74 132.13 2qhu s LYS 136 Ca 0.11 0.72 0.03 0.00 -0.36 0.00 0.00 55.97 56.47 2qhu s LYS 136 Cb -0.10 -3.68 -0.25 0.00 -1.51 0.00 0.00 37.83 32.29 2qhu s LYS 136 CO -0.00 -0.56 0.78 1.25 -0.36 0.00 0.00 175.35 176.46 2qhu h LEU 137 N 9.25 0.22 -7.28 5.43 5.85 -0.97 -1.19 115.31 126.61 2qhu h LEU 137 Ca -0.24 -0.35 -0.27 0.00 0.84 0.00 0.00 57.88 57.85 2qhu h LEU 137 Cb 1.10 -0.07 -0.34 0.00 0.37 0.00 0.00 40.66 41.71 2qhu h LEU 137 CO 0.86 1.30 -0.61 0.00 -0.34 0.00 0.00 178.44 179.65 2qhu s ALA 139 N 2.08 3.18 -0.03 0.00 0.00 -0.87 -0.29 121.76 125.84 2qhu s ALA 139 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.33 2qhu s ALA 139 Cb -0.12 -3.07 0.03 0.00 0.00 0.00 0.00 23.12 19.96 2qhu s ALA 139 CO -0.06 0.20 -0.00 0.42 0.00 0.00 0.00 175.76 176.31 2qhu s ILE 140 N -1.87 0.23 -0.29 0.00 1.01 -1.26 -0.58 121.20 118.44 2qhu s ILE 140 Ca 0.54 0.07 -0.02 0.00 0.00 0.00 0.00 60.65 61.24 2qhu s ILE 140 Cb -0.14 -0.33 0.18 0.00 0.01 0.00 0.00 42.46 42.18 2qhu s ILE 140 CO 0.18 0.16 0.58 -0.83 0.00 0.00 0.00 174.94 175.04 2qhu s GLY 141 N 1.10 -0.90 0.30 6.18 0.00 -0.09 -4.62 107.32 109.29 2qhu s GLY 141 Ca -0.09 1.80 0.09 0.00 0.00 0.00 0.00 44.72 46.52 2qhu s GLY 141 CO -0.02 3.25 0.02 -1.34 0.00 0.00 0.00 173.10 175.01 2qhu s VAL 142 N 2.83 3.16 0.07 1.40 -7.23 -1.26 -2.26 120.40 117.10 2qhu s VAL 142 Ca 0.17 -1.91 0.06 0.00 -1.81 0.00 0.00 61.98 58.49 2qhu s VAL 142 Cb -0.15 -2.83 -0.03 0.00 0.56 0.00 0.00 36.38 33.93 2qhu s VAL 142 CO -0.20 -0.31 -0.17 0.00 -0.31 0.00 0.00 175.10 174.11 2qhu s ALA 143 N -2.39 1.45 -0.06 1.32 0.00 -0.71 -1.41 121.76 119.97 2qhu s ALA 143 Ca 0.33 -1.06 0.01 0.00 0.00 0.00 0.00 51.96 51.24 2qhu s ALA 143 Cb -0.04 -0.19 0.02 0.00 0.00 0.00 0.00 23.12 22.91 2qhu s ALA 143 CO 0.20 0.27 -0.07 0.08 0.00 0.00 0.00 175.76 176.24 2qhu s VAL 144 N -1.11 0.74 -0.02 0.00 1.01 -1.26 -0.66 120.40 119.10 2qhu s VAL 144 Ca 0.02 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.79 2qhu s VAL 144 Cb -0.09 -0.74 0.02 0.00 0.00 0.00 0.00 36.38 35.56 2qhu s VAL 144 CO 0.03 0.28 -0.01 -0.75 0.00 0.00 0.00 175.10 174.64 2qhu s LYS 145 N 0.98 0.34 -1.43 2.72 2.20 -0.62 -4.83 119.74 119.10 2qhu s LYS 145 Ca -0.10 -0.00 -0.10 0.00 -0.36 0.00 0.00 55.97 55.41 2qhu s LYS 145 Cb -0.14 -0.44 0.07 0.00 -1.51 0.00 0.00 37.83 35.80 2qhu s LYS 145 CO 0.00 -0.06 0.68 0.39 -0.36 0.00 0.00 175.35 176.00 2qhu n GLU 146 N 3.77 -4.35 -1.10 4.03 1.02 -1.26 -1.64 120.64 121.11 2qhu n GLU 146 Ca -0.23 0.59 -0.03 0.00 -0.02 0.00 0.00 57.16 57.47 2qhu n GLU 146 Cb 0.53 -5.39 -0.01 0.00 -0.02 0.00 0.00 31.44 26.55 2qhu n GLU 146 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2qhu n GLY 147 N -1.41 0.58 3.12 0.62 0.00 -1.26 -4.94 105.19 101.90 2qhu n GLY 147 Ca -0.01 -0.24 -0.26 0.00 0.00 0.00 0.00 46.02 45.51 2qhu n GLY 147 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2qhu s VAL 148 N -1.86 1.40 0.56 1.61 1.01 -0.65 -1.56 120.40 120.91 2qhu s VAL 148 Ca 0.00 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.15 2qhu s VAL 148 Cb 0.00 -1.22 -0.06 0.00 0.00 0.00 0.00 36.38 35.10 2qhu s VAL 148 CO 0.00 0.41 1.01 -0.94 0.00 0.00 0.00 175.10 175.58 2qhu s SER 149 N 0.16 6.38 0.15 3.32 1.04 -0.62 -1.59 113.70 122.53 2qhu s SER 149 Ca -0.06 1.55 -0.02 0.00 0.48 0.00 0.00 55.95 57.90 2qhu s SER 149 Cb -0.12 -2.50 0.01 0.00 0.10 0.00 0.00 66.02 63.50 2qhu s SER 149 CO 0.03 -0.76 0.22 2.22 0.98 0.00 0.00 173.24 175.92 2qhu n PHE 150 N -2.04 -0.96 -2.71 5.02 1.16 0.16 -3.85 117.46 114.24 2qhu n PHE 150 Ca 0.07 -0.94 0.00 0.00 -1.87 0.00 0.00 57.45 54.71 2qhu n PHE 150 Cb 0.54 0.25 0.00 0.00 -1.61 0.00 0.00 39.48 38.66 2qhu n PHE 150 CO 0.00 0.00 0.00 0.72 -1.87 0.00 0.00 176.76 175.61 2qhu n HIS 151 N -0.24 -0.20 0.00 2.97 8.25 -1.26 -1.73 115.22 123.01 2qhu n HIS 151 Ca -0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2qhu n HIS 151 Cb 0.24 0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.43 2qhu n HIS 151 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2qhu n GLY 152 N 0.00 -0.62 3.27 -1.41 0.00 -0.96 -3.62 105.19 101.85 2qhu n GLY 152 Ca 0.00 0.26 -0.15 0.00 0.00 0.00 0.00 46.02 46.14 2qhu n GLY 152 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2qhu s PHE 153 N 0.00 1.32 -0.32 1.61 -0.12 -0.19 -0.92 117.98 119.36 2qhu s PHE 153 Ca 0.00 -0.97 -0.02 0.00 -0.05 0.00 0.00 56.93 55.90 2qhu s PHE 153 Cb 0.00 -0.75 0.12 0.00 -0.63 0.00 0.00 43.02 41.76 2qhu s PHE 153 CO 0.00 -0.14 0.20 0.00 -0.05 0.00 0.00 175.22 175.23 2qhu s ALA 154 N -3.56 0.47 -0.24 1.99 0.00 0.26 -1.43 121.76 119.25 2qhu s ALA 154 Ca 0.25 -1.21 -0.22 0.00 0.00 0.00 0.00 51.96 50.78 2qhu s ALA 154 Cb 0.06 -1.57 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 2qhu s ALA 154 CO 0.05 -1.85 0.69 -1.17 0.00 0.00 0.00 175.76 173.48 2qhu s LEU 155 N 1.75 4.09 -0.40 0.00 2.96 0.01 -2.04 118.68 125.05 2qhu s LEU 155 Ca 0.13 0.84 -0.29 0.00 -0.22 0.00 0.00 54.13 54.59 2qhu s LEU 155 Cb -0.18 -2.97 0.01 0.00 0.50 0.00 0.00 46.19 43.55 2qhu s LEU 155 CO -0.21 -0.39 1.43 0.20 -1.32 0.00 0.00 176.35 176.05 2qhu s ASN 156 N 1.38 6.33 0.00 3.68 0.01 -0.62 -0.39 114.94 125.32 2qhu s ASN 156 Ca 0.29 0.87 0.00 0.00 -0.71 0.00 0.00 52.86 53.31 2qhu s ASN 156 Cb -0.16 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 38.97 2qhu s ASN 156 CO 0.09 -1.43 0.00 0.52 -1.51 0.00 0.00 177.10 174.76 2qhu n VAL 157 N 7.06 0.00 -1.56 1.60 0.31 -0.93 -1.28 118.33 123.53 2qhu n VAL 157 Ca 0.17 0.39 0.06 0.00 -0.01 0.00 0.00 64.34 64.95 2qhu n VAL 157 Cb 0.48 -1.38 0.19 0.00 -0.91 0.00 0.00 33.84 32.22 2qhu n VAL 157 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2qhu n ASN 158 N -2.31 1.77 -4.64 4.52 5.03 0.46 -0.83 115.26 119.26 2qhu n ASN 158 Ca 0.00 -3.73 -0.40 0.00 0.87 0.00 0.00 54.58 51.32 2qhu n ASN 158 Cb 0.00 -0.51 0.03 0.00 -1.02 0.00 0.00 39.78 38.28 2qhu n ASN 158 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.26 175.84 2qhu n THR 159 N -1.11 3.05 -2.47 3.41 -1.04 -1.14 -4.59 114.28 110.40 2qhu n THR 159 Ca 0.18 -0.50 -0.39 0.00 -2.04 0.00 0.00 64.05 61.30 2qhu n THR 159 Cb 0.70 -1.29 -0.03 0.00 -1.82 0.00 0.00 70.33 67.89 2qhu n THR 159 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2qhu s ASP 160 N -0.90 6.17 0.59 8.00 -1.08 -1.26 -4.86 116.67 123.32 2qhu s ASP 160 Ca 0.68 -0.91 0.37 0.00 -0.52 0.00 0.00 52.55 52.17 2qhu s ASP 160 Cb -0.48 -2.56 1.69 0.00 -1.46 0.00 0.00 42.92 40.11 2qhu s ASP 160 CO 0.53 -1.80 2.10 -0.07 0.52 0.00 0.00 175.17 176.45 2qhu h LEU 161 N 13.63 0.00 -2.13 -1.34 3.38 -1.97 -2.34 115.31 124.53 2qhu h LEU 161 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2qhu h LEU 161 Cb 1.03 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 2qhu h LEU 161 CO 1.34 0.01 -0.05 0.78 0.09 0.00 0.00 178.44 180.61 2qhu h ASN 162 N 0.00 0.00 0.64 -0.43 2.35 -2.00 -2.13 115.58 114.01 2qhu h ASN 162 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 2qhu h ASN 162 Cb 0.36 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.73 2qhu h ASN 162 CO 0.00 0.05 0.00 0.44 -1.65 0.00 0.00 177.43 176.27 2qhu h ASP 163 N 0.00 0.00 1.39 5.81 3.32 -1.84 -2.65 116.42 122.45 2qhu h ASP 163 Ca -0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2qhu h ASP 163 Cb 0.10 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 2qhu h ASP 163 CO 0.01 0.00 -0.02 -0.26 -1.72 0.00 0.00 179.24 177.25 2qhu h PHE 164 N 0.00 0.00 0.00 4.55 0.04 -1.58 -3.28 116.94 116.66 2qhu h PHE 164 Ca 0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 2qhu h PHE 164 Cb 0.32 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.47 2qhu h PHE 164 CO 0.00 0.02 -0.13 1.15 -0.60 0.00 0.00 178.31 178.75 2qhu h THR 165 N 0.00 0.49 -0.00 -1.55 2.02 -1.64 -2.47 112.91 109.75 2qhu h THR 165 Ca -0.00 -0.64 0.00 0.00 0.77 0.00 0.00 66.41 66.54 2qhu h THR 165 Cb 0.71 1.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.56 2qhu h THR 165 CO 0.00 0.13 -0.05 1.33 0.37 0.00 0.00 175.52 177.30 2qhu n VAL 166 N -3.50 0.00 -4.29 3.16 0.24 -1.24 -4.81 118.33 107.89 2qhu n VAL 166 Ca -0.01 -0.04 -0.29 0.00 -2.04 0.00 0.00 64.34 61.96 2qhu n VAL 166 Cb 0.28 -0.26 -0.11 0.00 -1.47 0.00 0.00 33.84 32.28 2qhu n VAL 166 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2qhu s ILE 167 N -2.36 2.99 -0.51 1.34 -4.36 -0.93 -2.37 121.20 114.99 2qhu s ILE 167 Ca 0.34 -1.50 0.04 0.00 -0.26 0.00 0.00 60.65 59.26 2qhu s ILE 167 Cb 0.21 -2.40 0.16 0.00 1.25 0.00 0.00 42.46 41.67 2qhu s ILE 167 CO 0.44 0.06 0.35 -0.69 0.24 0.00 0.00 174.94 175.34 2qhu s VAL 168 N -1.27 1.48 0.74 8.37 1.01 0.10 -4.91 120.40 125.92 2qhu s VAL 168 Ca 0.20 -3.09 -0.14 0.00 0.00 0.00 0.00 61.98 58.95 2qhu s VAL 168 Cb -0.10 -2.01 0.05 0.00 0.00 0.00 0.00 36.38 34.32 2qhu s VAL 168 CO 0.12 -1.04 1.17 -2.16 0.00 0.00 0.00 175.10 173.18 2qhu s PRO 169 N -0.28 2.15 0.20 2.72 0.04 -1.26 -4.18 135.00 134.40 2qhu s PRO 169 Ca 0.25 1.60 0.07 0.00 0.04 0.00 0.00 61.00 62.96 2qhu s PRO 169 Cb -0.09 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 2qhu s PRO 169 CO -0.11 -1.79 0.07 0.00 0.04 0.00 0.00 177.00 175.21 2qhu n GLY 171 N -0.51 -1.73 3.70 0.00 0.00 -1.26 -4.95 105.19 100.44 2qhu n GLY 171 Ca -0.08 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 2qhu n GLY 171 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qhu s LEU 172 N 0.00 4.33 0.22 0.99 1.43 -1.26 -5.02 118.68 119.38 2qhu s LEU 172 Ca 0.00 1.91 -0.21 0.00 -1.03 0.00 0.00 54.13 54.79 2qhu s LEU 172 Cb 0.00 -3.57 0.04 0.00 0.03 0.00 0.00 46.19 42.69 2qhu s LEU 172 CO 0.00 -0.50 0.65 -1.59 0.23 0.00 0.00 176.35 175.14 2qhu s LYS 173 N 1.52 1.55 0.00 1.70 -2.85 -1.26 -4.74 119.74 115.65 2qhu s LYS 173 Ca 0.57 -0.78 0.00 0.00 -1.00 0.00 0.00 55.97 54.76 2qhu s LYS 173 Cb -0.27 0.59 0.00 0.00 -2.06 0.00 0.00 37.83 36.09 2qhu s LYS 173 CO 0.26 -0.69 0.00 0.41 0.10 0.00 0.00 175.35 175.43 2qhu n GLY 174 N -0.42 -0.89 0.12 0.59 0.00 -1.26 -5.04 105.19 98.29 2qhu n GLY 174 Ca -0.10 -1.43 -0.14 0.00 0.00 0.00 0.00 46.02 44.35 2qhu n GLY 174 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qhu n LYS 175 N 0.00 0.68 0.00 1.61 5.02 0.29 -5.03 118.16 120.73 2qhu n LYS 175 Ca 0.00 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 2qhu n LYS 175 Cb 0.00 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.50 2qhu n LYS 175 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qhu n GLY 176 N 2.05 4.83 3.15 0.72 0.00 -0.97 -5.04 105.19 109.94 2qhu n GLY 176 Ca -0.40 -1.20 -0.13 0.00 0.00 0.00 0.00 46.02 44.30 2qhu n GLY 176 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2qhu s VAL 177 N -0.79 0.77 0.24 1.61 -7.23 -1.26 -1.03 120.40 112.71 2qhu s VAL 177 Ca 0.00 -1.66 -0.10 0.00 -1.81 0.00 0.00 61.98 58.41 2qhu s VAL 177 Cb 0.00 -1.35 -0.01 0.00 0.56 0.00 0.00 36.38 35.58 2qhu s VAL 177 CO 0.00 -0.65 0.40 0.28 -0.31 0.00 0.00 175.10 174.82 2qhu s THR 178 N -2.72 0.00 0.15 5.32 -1.32 -0.45 -4.68 115.64 111.94 2qhu s THR 178 Ca 0.05 -1.55 -0.04 0.00 -1.21 0.00 0.00 61.69 58.94 2qhu s THR 178 Cb -0.01 -2.29 -0.03 0.00 -1.51 0.00 0.00 72.50 68.66 2qhu s THR 178 CO -0.02 0.00 0.15 -0.94 -2.21 0.00 0.00 174.62 171.61 2qhu s SER 179 N -3.06 0.19 0.21 8.08 1.04 -1.26 -4.30 113.70 114.61 2qhu s SER 179 Ca 0.26 -1.07 -0.10 0.00 0.48 0.00 0.00 55.95 55.52 2qhu s SER 179 Cb 0.01 0.36 0.16 0.00 0.10 0.00 0.00 66.02 66.65 2qhu s SER 179 CO 0.10 -0.80 1.86 -0.07 0.98 0.00 0.00 173.24 175.31 2qhu h LEU 180 N 2.72 0.91 -0.30 2.42 3.38 -0.98 -1.77 115.31 121.69 2qhu h LEU 180 Ca -0.34 -0.05 0.06 0.00 0.09 0.00 0.00 57.88 57.64 2qhu h LEU 180 Cb 1.21 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.68 2qhu h LEU 180 CO 0.54 0.69 -0.06 -0.08 0.09 0.00 0.00 178.44 179.63 2qhu h GLU 181 N 1.05 0.02 -0.55 1.13 4.81 -1.13 0.74 114.58 120.65 2qhu h GLU 181 Ca 0.28 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.46 2qhu h GLU 181 Cb -0.06 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 2qhu h GLU 181 CO -0.05 0.01 0.15 -0.22 -0.73 0.00 0.00 179.01 178.17 2qhu h LYS 182 N 0.02 0.87 -0.18 1.92 3.64 -1.76 0.36 116.57 121.44 2qhu h LYS 182 Ca 0.15 -0.20 -0.14 0.00 -1.27 0.00 0.00 60.65 59.19 2qhu h LYS 182 Cb 0.22 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 2qhu h LYS 182 CO -0.29 0.81 -0.48 -0.07 -2.27 0.00 0.00 179.45 177.14 2qhu h LEU 183 N 0.78 0.51 0.00 5.20 3.38 -1.04 -3.24 115.31 120.90 2qhu h LEU 183 Ca 0.18 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2qhu h LEU 183 Cb 0.31 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.92 2qhu h LEU 183 CO -0.00 0.91 -1.05 0.18 0.09 0.00 0.00 178.44 178.56 2qhu n LEU 184 N -3.98 0.72 -0.34 1.67 4.77 0.23 -4.99 117.00 115.07 2qhu n LEU 184 Ca -0.02 -0.25 -0.04 0.00 -0.03 0.00 0.00 56.01 55.67 2qhu n LEU 184 Cb 0.55 -0.06 -0.01 0.00 -2.33 0.00 0.00 43.42 41.57 2qhu n LEU 184 CO 0.45 0.15 -0.04 0.61 -1.33 0.00 0.00 177.39 177.23 2qhu n GLY 185 N 1.44 0.46 3.59 -0.72 0.00 0.12 -5.00 105.19 105.08 2qhu n GLY 185 Ca 0.03 -0.83 -0.08 0.00 0.00 0.00 0.00 46.02 45.13 2qhu n GLY 185 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2qhu s ARG 186 N -3.14 0.48 0.50 1.61 1.70 -0.92 -5.04 118.95 114.14 2qhu s ARG 186 Ca 0.00 0.06 -0.22 0.00 -0.47 0.00 0.00 55.73 55.10 2qhu s ARG 186 Cb 0.00 0.22 -0.06 0.00 -0.57 0.00 0.00 34.95 34.54 2qhu s ARG 186 CO 0.00 -0.16 1.24 0.15 -1.08 0.00 0.00 175.30 175.44 2qhu s LYS 187 N -1.37 3.51 -0.12 3.89 1.02 -1.26 -4.08 119.74 121.32 2qhu s LYS 187 Ca 0.02 1.94 -0.00 0.00 0.02 0.00 0.00 55.97 57.94 2qhu s LYS 187 Cb -0.01 -2.34 -0.02 0.00 -0.52 0.00 0.00 37.83 34.95 2qhu s LYS 187 CO -0.02 -0.80 -0.11 0.08 -0.92 0.00 0.00 175.35 173.58 2qhu s VAL 188 N -1.46 3.25 0.17 3.17 1.01 -1.26 -5.00 120.40 120.29 2qhu s VAL 188 Ca 0.67 -0.60 -0.31 0.00 0.00 0.00 0.00 61.98 61.74 2qhu s VAL 188 Cb -0.33 -2.37 -0.10 0.00 0.00 0.00 0.00 36.38 33.58 2qhu s VAL 188 CO 0.39 0.53 1.53 -2.84 0.00 0.00 0.00 175.10 174.71 2qhu s PRO 189 N 0.20 4.23 0.31 2.72 0.02 -1.26 -4.80 135.00 136.42 2qhu s PRO 189 Ca -0.07 2.32 0.04 0.00 0.02 0.00 0.00 61.00 63.31 2qhu s PRO 189 Cb -0.15 -3.16 0.64 0.00 0.02 0.00 0.00 34.50 31.85 2qhu s PRO 189 CO 0.05 -0.56 1.85 1.98 -0.33 0.00 0.00 177.00 179.98 2qhu h MET 190 N 6.54 0.87 -0.61 5.54 4.05 -1.98 -1.47 114.93 127.87 2qhu h MET 190 Ca -0.43 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 58.94 2qhu h MET 190 Cb 1.21 -0.20 -0.03 0.00 -0.80 0.00 0.00 31.60 31.78 2qhu h MET 190 CO 0.89 0.58 0.37 1.49 0.23 0.00 0.00 176.91 180.47 2qhu h GLU 191 N 0.90 0.81 -0.08 0.39 4.81 -2.00 -0.45 114.58 118.96 2qhu h GLU 191 Ca 0.48 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.61 2qhu h GLU 191 Cb 0.56 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 2qhu h GLU 191 CO -0.24 0.56 -0.09 1.49 -0.73 0.00 0.00 179.01 180.00 2qhu h GLU 192 N 0.83 0.21 -0.77 1.92 4.81 -1.66 -2.09 114.58 117.82 2qhu h GLU 192 Ca 0.22 -0.11 0.07 0.00 -0.13 0.00 0.00 59.36 59.41 2qhu h GLU 192 Cb -0.05 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.27 2qhu h GLU 192 CO -0.04 0.64 0.45 0.00 -0.73 0.00 0.00 179.01 179.33 2qhu h ALA 193 N 0.57 1.07 -0.20 2.92 0.00 -1.07 -1.18 119.26 121.36 2qhu h ALA 193 Ca 0.01 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2qhu h ALA 193 Cb 0.60 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 2qhu h ALA 193 CO 0.02 0.14 0.06 0.87 0.00 0.00 0.00 179.25 180.35 2qhu h LYS 194 N 0.81 0.15 -0.83 0.00 1.57 -1.05 -0.43 116.57 116.80 2qhu h LYS 194 Ca 0.35 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 59.18 2qhu h LYS 194 Cb 0.23 -0.03 -0.06 0.00 0.08 0.00 0.00 32.23 32.44 2qhu h LYS 194 CO -0.20 0.10 0.51 0.00 -0.57 0.00 0.00 179.45 179.29 2qhu h ALA 195 N 1.13 1.13 -0.13 3.86 0.00 -0.86 -0.62 119.26 123.77 2qhu h ALA 195 Ca 0.09 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 2qhu h ALA 195 Cb 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 2qhu h ALA 195 CO -0.10 0.25 -0.60 0.00 0.00 0.00 0.00 179.25 178.81 2qhu h ARG 196 N 0.94 0.43 -0.15 0.00 3.08 -0.79 -1.28 114.38 116.61 2qhu h ARG 196 Ca 0.36 -0.29 -0.01 0.00 0.07 0.00 0.00 59.98 60.11 2qhu h ARG 196 Cb 0.16 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 2qhu h ARG 196 CO -0.17 0.90 0.06 0.28 -1.07 0.00 0.00 179.97 179.97 2qhu h VAL 197 N 0.32 1.16 -0.30 2.04 2.07 -0.60 -0.29 116.25 120.65 2qhu h VAL 197 Ca -0.00 -0.50 0.06 0.00 0.82 0.00 0.00 66.70 67.07 2qhu h VAL 197 Cb 1.13 1.21 -0.05 0.00 -1.52 0.00 0.00 31.29 32.07 2qhu h VAL 197 CO 0.10 0.15 -0.04 0.58 0.02 0.00 0.00 177.57 178.39 2qhu h VAL 198 N 0.08 0.74 -0.59 2.57 2.07 -0.92 0.10 116.25 120.30 2qhu h VAL 198 Ca 0.05 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.59 2qhu h VAL 198 Cb 0.19 0.69 -0.04 0.00 -1.52 0.00 0.00 31.29 30.61 2qhu h VAL 198 CO -0.00 0.01 0.36 0.00 0.02 0.00 0.00 177.57 177.95 2qhu h ALA 199 N 1.28 0.77 -0.29 1.67 0.00 -1.07 -0.51 119.26 121.12 2qhu h ALA 199 Ca 0.14 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2qhu h ALA 199 Cb 0.21 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 2qhu h ALA 199 CO -0.28 0.08 0.12 0.00 0.00 0.00 0.00 179.25 179.17 2qhu h ALA 200 N 1.27 0.38 -0.74 0.00 0.00 -0.38 -2.05 119.26 117.74 2qhu h ALA 200 Ca 0.24 -0.12 0.04 0.00 0.00 0.00 0.00 54.91 55.07 2qhu h ALA 200 Cb 0.04 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.67 2qhu h ALA 200 CO -0.11 -0.03 0.45 0.74 0.00 0.00 0.00 179.25 180.30 2qhu h PHE 201 N 0.32 0.84 -0.67 0.00 0.04 -0.46 -1.12 116.94 115.89 2qhu h PHE 201 Ca 0.10 0.02 0.04 0.00 2.80 0.00 0.00 57.97 60.93 2qhu h PHE 201 Cb 0.17 -0.27 -0.05 0.00 2.20 0.00 0.00 35.95 38.00 2qhu h PHE 201 CO -0.01 0.46 0.40 0.00 -0.60 0.00 0.00 178.31 178.56 2qhu h ALA 202 N 1.33 0.89 0.15 2.45 0.00 -0.86 -1.10 119.26 122.13 2qhu h ALA 202 Ca 0.31 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2qhu h ALA 202 Cb 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.69 2qhu h ALA 202 CO -0.13 0.12 -0.07 1.49 0.00 0.00 0.00 179.25 180.66 2qhu h GLU 203 N 0.76 -0.20 -0.40 0.00 4.57 -1.05 -0.40 114.58 117.87 2qhu h GLU 203 Ca 0.29 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 58.45 2qhu h GLU 203 Cb 0.10 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.72 2qhu h GLU 203 CO -0.14 0.11 0.13 0.28 -1.18 0.00 0.00 179.01 178.22 2qhu h VAL 204 N -0.52 1.21 0.00 0.32 2.07 -1.05 -3.06 116.25 115.22 2qhu h VAL 204 Ca -0.02 -0.67 0.00 0.00 0.82 0.00 0.00 66.70 66.82 2qhu h VAL 204 Cb 0.40 0.91 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 2qhu h VAL 204 CO 0.03 0.24 -0.53 -0.26 0.02 0.00 0.00 177.57 177.08 2qhu h PHE 205 N 0.49 0.00 -4.29 1.57 -1.00 -1.30 -3.48 116.94 108.94 2qhu h PHE 205 Ca 0.13 0.00 -0.22 0.00 2.81 0.00 0.00 57.97 60.69 2qhu h PHE 205 Cb 0.24 0.00 0.10 0.00 3.61 0.00 0.00 35.95 39.90 2qhu h PHE 205 CO 0.01 0.00 -0.48 0.41 -1.61 0.00 0.00 178.31 176.64 2qhu n GLY 206 N 1.23 -0.06 3.20 -1.45 0.00 -0.22 -5.05 105.19 102.84 2qhu n GLY 206 Ca 0.03 -0.10 -0.20 0.00 0.00 0.00 0.00 46.02 45.74 2qhu n GLY 206 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2qhu s LEU 207 N -4.86 2.27 -0.02 0.99 1.43 -0.82 -4.87 118.68 112.81 2qhu s LEU 207 Ca 0.09 -0.62 -0.21 0.00 -1.03 0.00 0.00 54.13 52.36 2qhu s LEU 207 Cb -0.04 -0.64 -0.05 0.00 0.03 0.00 0.00 46.19 45.49 2qhu s LEU 207 CO 0.47 -0.03 0.62 0.00 0.23 0.00 0.00 176.35 177.64 2qhu s ARG 208 N -1.73 4.35 0.17 1.70 1.70 -0.15 -4.46 118.95 120.52 2qhu s ARG 208 Ca 0.01 0.76 -0.29 0.00 -0.47 0.00 0.00 55.73 55.74 2qhu s ARG 208 Cb -0.10 -3.37 -0.07 0.00 -0.57 0.00 0.00 34.95 30.84 2qhu s ARG 208 CO 0.03 0.30 0.92 -1.25 -1.08 0.00 0.00 175.30 174.22 2qhu s PRO 209 N 0.03 4.74 0.00 3.89 0.04 -1.26 -1.90 135.00 140.54 2qhu s PRO 209 Ca 0.32 1.41 0.03 0.00 0.04 0.00 0.00 61.00 62.80 2qhu s PRO 209 Cb -0.18 -3.32 0.02 0.00 0.04 0.00 0.00 34.50 31.06 2qhu s PRO 209 CO 0.17 0.38 0.59 1.33 0.04 0.00 0.00 177.00 179.51