#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xhm h GLU 3 N 0.00 0.14 0.00 -1.46 4.57 -2.07 -0.08 114.58 115.69 1xhm h GLU 3 Ca 0.00 -0.01 -0.13 0.00 -1.18 0.00 0.00 59.36 58.04 1xhm h GLU 3 Cb 0.00 -0.03 0.01 0.00 -0.16 0.00 0.00 28.75 28.57 1xhm h GLU 3 CO 0.00 0.10 -0.50 1.25 -1.18 0.00 0.00 179.01 178.67 1xhm h LEU 4 N 0.15 0.44 -2.02 1.64 5.85 -2.05 -3.27 115.31 116.05 1xhm h LEU 4 Ca 0.80 -0.77 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1xhm h LEU 4 Cb 2.06 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 42.96 1xhm h LEU 4 CO -0.64 1.15 -0.02 0.44 -0.34 0.00 0.00 178.44 179.03 1xhm h ASP 5 N -0.23 0.00 0.42 1.25 5.19 -1.48 -0.99 116.42 120.59 1xhm h ASP 5 Ca -0.06 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.33 1xhm h ASP 5 Cb 1.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.75 1xhm h ASP 5 CO 0.10 0.02 -0.20 -0.61 -3.12 0.00 0.00 179.24 175.43 1xhm h GLN 6 N 0.00 -0.55 -0.87 3.56 4.15 -1.35 -2.44 115.11 117.62 1xhm h GLN 6 Ca -0.00 0.04 -0.00 0.00 0.77 0.00 0.00 58.65 59.45 1xhm h GLN 6 Cb 0.05 0.12 -0.04 0.00 0.21 0.00 0.00 27.48 27.82 1xhm h GLN 6 CO 0.00 -0.28 0.53 -0.07 -1.93 0.00 0.00 178.83 177.09 1xhm h LEU 7 N -0.75 1.03 -2.19 -2.39 3.38 -1.51 0.12 115.31 113.00 1xhm h LEU 7 Ca -0.06 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 1xhm h LEU 7 Cb 0.53 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.01 1xhm h LEU 7 CO 0.10 0.79 -0.05 0.03 0.09 0.00 0.00 178.44 179.39 1xhm h ARG 8 N 1.19 0.00 0.07 1.13 3.08 -1.11 -0.16 114.38 118.58 1xhm h ARG 8 Ca 0.31 0.00 -0.37 0.00 0.07 0.00 0.00 59.98 59.99 1xhm h ARG 8 Cb -0.06 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 29.95 1xhm h ARG 8 CO -0.06 0.05 -2.15 0.94 -1.07 0.00 0.00 179.97 177.68 1xhm n GLN 9 N -3.93 0.70 -0.13 0.04 7.27 -0.68 -3.51 117.38 117.15 1xhm n GLN 9 Ca -0.03 0.24 0.01 0.00 0.07 0.00 0.00 57.00 57.30 1xhm n GLN 9 Cb 0.14 -1.63 0.30 0.00 2.41 0.00 0.00 30.24 31.46 1xhm n GLN 9 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1xhm h GLU 10 N -0.08 0.81 -0.50 3.69 5.08 -0.63 0.15 114.58 123.10 1xhm h GLU 10 Ca -0.49 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 57.72 1xhm h GLU 10 Cb 1.92 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.97 1xhm h GLU 10 CO -0.02 0.56 -0.05 0.00 -1.00 0.00 0.00 179.01 178.50 1xhm h ALA 11 N 1.58 0.98 -0.19 3.43 0.00 -1.19 -0.75 119.26 123.12 1xhm h ALA 11 Ca 0.22 -0.30 -0.13 0.00 0.00 0.00 0.00 54.91 54.69 1xhm h ALA 11 Cb -0.04 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1xhm h ALA 11 CO -0.04 0.62 -0.40 1.49 0.00 0.00 0.00 179.25 180.91 1xhm h GLU 12 N 0.80 0.60 -0.58 0.00 4.57 -1.21 -2.02 114.58 116.74 1xhm h GLU 12 Ca 0.14 -0.40 -0.09 0.00 -1.18 0.00 0.00 59.36 57.83 1xhm h GLU 12 Cb 0.55 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 1xhm h GLU 12 CO 0.03 1.01 -0.00 1.96 -1.18 0.00 0.00 179.01 180.83 1xhm h GLN 13 N 0.27 1.02 -0.15 1.92 1.08 -0.68 -1.25 115.11 117.32 1xhm h GLN 13 Ca 0.00 -0.33 -0.03 0.00 -1.45 0.00 0.00 58.65 56.85 1xhm h GLN 13 Cb 1.01 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 28.34 1xhm h GLN 13 CO 0.09 1.01 -0.03 -0.07 -0.95 0.00 0.00 178.83 178.88 1xhm h LEU 14 N 0.92 0.20 -0.53 1.46 3.38 -1.14 0.54 115.31 120.13 1xhm h LEU 14 Ca 0.16 -0.02 -0.12 0.00 0.09 0.00 0.00 57.88 57.99 1xhm h LEU 14 Cb 0.55 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1xhm h LEU 14 CO 0.03 0.27 -0.12 0.11 0.09 0.00 0.00 178.44 178.81 1xhm h LYS 15 N 0.21 1.01 -0.36 1.13 1.57 -0.52 -1.07 116.57 118.55 1xhm h LYS 15 Ca 0.05 -0.39 -0.11 0.00 -1.87 0.00 0.00 60.65 58.33 1xhm h LYS 15 Cb 0.20 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1xhm h LYS 15 CO 0.01 1.07 -0.21 -0.91 -0.57 0.00 0.00 179.45 178.84 1xhm h ASN 16 N 0.88 0.81 -0.30 0.86 2.35 -0.27 -0.74 115.58 119.17 1xhm h ASN 16 Ca 0.13 -0.42 0.04 0.00 -0.55 0.00 0.00 56.30 55.51 1xhm h ASN 16 Cb 0.70 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 1xhm h ASN 16 CO 0.05 1.05 0.07 -0.61 -1.65 0.00 0.00 177.43 176.34 1xhm h GLN 17 N 0.57 0.18 -0.46 0.81 5.75 -0.78 0.33 115.11 121.50 1xhm h GLN 17 Ca 0.08 -0.01 0.01 0.00 -0.15 0.00 0.00 58.65 58.57 1xhm h GLN 17 Cb 0.76 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 29.25 1xhm h GLN 17 CO 0.06 0.12 0.30 0.82 -2.65 0.00 0.00 178.83 177.48 1xhm h ILE 18 N 0.18 1.10 -0.58 2.39 2.04 -1.08 -0.54 117.51 121.02 1xhm h ILE 18 Ca 0.14 -0.21 0.02 0.00 1.00 0.00 0.00 64.86 65.81 1xhm h ILE 18 Cb 0.14 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 1xhm h ILE 18 CO -0.18 0.11 0.38 -0.09 0.00 0.00 0.00 178.15 178.38 1xhm h ARG 19 N 0.61 0.72 -0.13 2.37 1.12 -0.14 -1.58 114.38 117.35 1xhm h ARG 19 Ca 0.17 -0.04 -0.18 0.00 -1.11 0.00 0.00 59.98 58.82 1xhm h ARG 19 Cb -0.05 -0.16 -0.00 0.00 -0.01 0.00 0.00 29.97 29.74 1xhm h ARG 19 CO -0.05 0.48 -0.66 -0.44 -3.11 0.00 0.00 179.97 176.19 1xhm h ASP 20 N 0.74 0.60 -0.29 -3.80 3.32 0.48 -2.14 116.42 115.32 1xhm h ASP 20 Ca 0.22 -0.36 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 1xhm h ASP 20 Cb -0.03 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 39.33 1xhm h ASP 20 CO -0.05 1.10 0.13 0.00 -1.72 0.00 0.00 179.24 178.70 1xhm h ALA 21 N 0.90 0.38 -0.56 3.45 0.00 -0.25 -1.52 119.26 121.66 1xhm h ALA 21 Ca -0.02 -0.10 -0.10 0.00 0.00 0.00 0.00 54.91 54.69 1xhm h ALA 21 Cb 1.23 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 1xhm h ALA 21 CO 0.12 -0.05 -0.05 0.00 0.00 0.00 0.00 179.25 179.27 1xhm h ARG 22 N 0.33 1.00 -0.54 0.00 3.08 -1.31 -2.88 114.38 114.07 1xhm h ARG 22 Ca 0.10 -0.34 -0.04 0.00 0.07 0.00 0.00 59.98 59.77 1xhm h ARG 22 Cb 0.14 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.08 1xhm h ARG 22 CO -0.01 1.02 0.18 0.87 -1.07 0.00 0.00 179.97 180.95 1xhm h LYS 23 N 0.91 0.83 -0.07 0.04 1.57 -1.27 -2.46 116.57 116.12 1xhm h LYS 23 Ca 0.15 -0.17 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1xhm h LYS 23 Cb 0.60 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 1xhm h LYS 23 CO 0.04 0.76 0.06 0.00 -0.57 0.00 0.00 179.45 179.74 1xhm h ALA 24 N 1.04 1.85 0.00 3.86 0.00 -1.10 -0.57 119.26 124.33 1xhm h ALA 24 Ca 0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1xhm h ALA 24 Cb 0.26 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1xhm h ALA 24 CO -0.01 -0.10 -0.56 0.00 0.00 0.00 0.00 179.25 178.58 1xhm n ALA 26 N -1.96 6.61 0.08 0.00 0.00 -0.22 -4.40 120.51 120.62 1xhm n ALA 26 Ca 0.03 -3.16 -0.04 0.00 0.00 0.00 0.00 53.44 50.28 1xhm n ALA 26 Cb 0.48 -3.30 -0.07 0.00 0.00 0.00 0.00 19.45 16.56 1xhm n ALA 26 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1xhm h ASP 27 N 5.48 0.00 -5.07 0.00 2.03 -1.79 -3.46 116.42 113.60 1xhm h ASP 27 Ca 0.75 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.91 1xhm h ASP 27 Cb 0.28 0.00 -0.18 0.00 -0.83 0.00 0.00 39.33 38.60 1xhm h ASP 27 CO 1.71 0.82 -0.59 0.00 -1.03 0.00 0.00 179.24 180.15 1xhm s ALA 28 N -2.80 0.05 0.29 4.15 0.00 -1.26 -5.17 121.76 117.03 1xhm s ALA 28 Ca 0.02 -0.62 -0.01 0.00 0.00 0.00 0.00 51.96 51.34 1xhm s ALA 28 Cb 0.09 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 1xhm s ALA 28 CO 0.79 -0.27 0.51 0.99 0.00 0.00 0.00 175.76 177.78 1xhm s THR 29 N -2.37 5.11 0.22 0.00 2.01 -1.26 -4.99 115.64 114.36 1xhm s THR 29 Ca -0.07 -0.30 -0.07 0.00 0.31 0.00 0.00 61.69 61.55 1xhm s THR 29 Cb -0.03 -3.79 0.15 0.00 0.01 0.00 0.00 72.50 68.83 1xhm s THR 29 CO -0.04 -0.39 1.77 0.25 -0.69 0.00 0.00 174.62 175.52 1xhm h LEU 30 N 1.34 1.08 -1.53 4.42 5.85 -1.95 -1.75 115.31 122.76 1xhm h LEU 30 Ca -0.49 -0.19 -0.05 0.00 0.84 0.00 0.00 57.88 57.99 1xhm h LEU 30 Cb 1.20 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 1xhm h LEU 30 CO 0.64 0.98 -0.24 0.77 -0.34 0.00 0.00 178.44 180.25 1xhm h SER 31 N 1.12 0.00 -0.42 1.25 4.64 -1.86 -0.83 113.55 117.45 1xhm h SER 31 Ca 0.25 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.46 1xhm h SER 31 Cb 0.27 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.35 1xhm h SER 31 CO -0.01 0.24 -0.16 1.56 -0.87 0.00 0.00 176.83 177.59 1xhm h GLN 32 N 0.00 0.84 0.00 4.77 4.20 -1.71 -1.15 115.11 122.06 1xhm h GLN 32 Ca -0.00 -0.35 0.00 0.00 0.06 0.00 0.00 58.65 58.36 1xhm h GLN 32 Cb 0.45 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.19 1xhm h GLN 32 CO 0.03 0.98 -0.65 0.82 -0.67 0.00 0.00 178.83 179.35 1xhm h ILE 33 N 0.66 0.00 -0.04 2.54 2.04 -1.29 -3.32 117.51 118.10 1xhm h ILE 33 Ca 0.10 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.13 1xhm h ILE 33 Cb 0.70 1.47 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 1xhm h ILE 33 CO 0.05 0.00 0.00 0.35 0.00 0.00 0.00 178.15 178.55 1xhm n THR 34 N -2.58 0.02 0.94 -0.27 -2.24 -0.33 -4.19 114.28 105.62 1xhm n THR 34 Ca 0.02 -0.46 0.10 0.00 -2.27 0.00 0.00 64.05 61.44 1xhm n THR 34 Cb 0.51 1.28 0.50 0.00 -2.10 0.00 0.00 70.33 70.52 1xhm n THR 34 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1xhm n ASN 35 N 1.11 0.00 -1.33 3.42 0.23 -0.44 -2.12 115.26 116.13 1xhm n ASN 35 Ca 0.15 0.04 0.09 0.00 -0.53 0.00 0.00 54.58 54.33 1xhm n ASN 35 Cb 0.55 -0.31 0.31 0.00 -2.08 0.00 0.00 39.78 38.25 1xhm n ASN 35 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1xhm n ASN 36 N -1.31 4.33 -4.60 0.53 3.02 -1.26 -4.89 115.26 111.08 1xhm n ASN 36 Ca 0.09 -2.45 -0.35 0.00 -0.03 0.00 0.00 54.58 51.84 1xhm n ASN 36 Cb 0.17 -0.51 -0.10 0.00 -0.61 0.00 0.00 39.78 38.72 1xhm n ASN 36 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1xhm s ILE 37 N -1.83 4.84 0.04 2.41 1.01 -0.90 -5.05 121.20 121.73 1xhm s ILE 37 Ca 0.45 -0.01 -0.31 0.00 0.00 0.00 0.00 60.65 60.78 1xhm s ILE 37 Cb 0.30 -3.22 -0.10 0.00 0.01 0.00 0.00 42.46 39.45 1xhm s ILE 37 CO 0.21 0.41 1.91 0.47 0.00 0.00 0.00 174.94 177.93 1xhm n ASP 38 N 4.01 3.97 -4.47 3.58 8.00 -1.26 -4.91 116.55 125.47 1xhm n ASP 38 Ca -0.16 0.95 -0.35 0.00 0.71 0.00 0.00 54.79 55.93 1xhm n ASP 38 Cb 0.52 -1.50 0.08 0.00 -0.02 0.00 0.00 41.12 40.20 1xhm n ASP 38 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1xhm n PRO 39 N 6.68 0.21 0.28 -0.24 -0.02 -1.26 -4.83 135.00 135.81 1xhm n PRO 39 Ca 0.20 0.12 0.13 0.00 -2.02 0.00 0.00 63.50 61.92 1xhm n PRO 39 Cb 0.37 -1.88 0.79 0.00 -0.02 0.00 0.00 33.50 32.76 1xhm n PRO 39 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1xhm h VAL 40 N -0.59 0.60 0.00 -1.45 2.07 -1.97 -3.47 116.25 111.44 1xhm h VAL 40 Ca -0.45 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 66.77 1xhm h VAL 40 Cb 1.33 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.29 1xhm h VAL 40 CO 0.41 0.07 0.00 0.61 0.02 0.00 0.00 177.57 178.68 1xhm n GLY 41 N -1.00 1.49 3.38 2.17 0.00 -1.26 -4.78 105.19 105.18 1xhm n GLY 41 Ca -0.02 -0.34 -0.10 0.00 0.00 0.00 0.00 46.02 45.56 1xhm n GLY 41 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xhm s ARG 42 N 0.00 0.48 -0.22 1.61 3.52 -1.26 -4.86 118.95 118.22 1xhm s ARG 42 Ca 0.00 0.91 -0.01 0.00 -0.13 0.00 0.00 55.73 56.50 1xhm s ARG 42 Cb 0.00 0.03 0.02 0.00 -1.56 0.00 0.00 34.95 33.44 1xhm s ARG 42 CO 0.00 -0.15 -0.11 0.42 -0.81 0.00 0.00 175.30 174.65 1xhm s ILE 43 N 1.44 2.60 -0.73 4.11 1.01 -0.35 -5.02 121.20 124.25 1xhm s ILE 43 Ca -0.09 -0.99 -0.00 0.00 0.00 0.00 0.00 60.65 59.56 1xhm s ILE 43 Cb -0.07 -2.25 0.18 0.00 0.01 0.00 0.00 42.46 40.33 1xhm s ILE 43 CO -0.14 0.32 0.56 -1.10 0.00 0.00 0.00 174.94 174.58 1xhm s GLN 44 N 1.31 2.77 0.13 2.79 -0.21 -1.26 -4.20 119.66 120.98 1xhm s GLN 44 Ca 0.02 -2.97 -0.23 0.00 0.02 0.00 0.00 55.36 52.20 1xhm s GLN 44 Cb -0.15 -3.73 -0.07 0.00 1.00 0.00 0.00 33.01 30.05 1xhm s GLN 44 CO -0.07 -1.22 0.70 -1.64 -2.12 0.00 0.00 175.29 170.93 1xhm s MET 45 N -0.81 4.43 0.29 2.91 -1.94 -1.26 -5.01 119.30 117.91 1xhm s MET 45 Ca 0.22 0.99 0.09 0.00 -1.71 0.00 0.00 55.69 55.29 1xhm s MET 45 Cb -0.13 -3.26 -0.05 0.00 2.01 0.00 0.00 34.83 33.41 1xhm s MET 45 CO -0.09 0.59 0.00 1.03 -0.01 0.00 0.00 175.02 176.54 1xhm s ARG 46 N -1.10 2.20 -0.31 2.03 1.81 0.35 -4.83 118.95 119.10 1xhm s ARG 46 Ca 0.33 -1.54 -0.28 0.00 -1.72 0.00 0.00 55.73 52.52 1xhm s ARG 46 Cb -0.22 -2.07 0.01 0.00 -0.45 0.00 0.00 34.95 32.22 1xhm s ARG 46 CO 0.23 0.27 1.04 0.99 -0.68 0.00 0.00 175.30 177.16 1xhm s THR 47 N -2.40 4.56 -0.14 0.02 2.01 -1.26 -2.60 115.64 115.83 1xhm s THR 47 Ca 0.33 1.71 0.18 0.00 0.31 0.00 0.00 61.69 64.22 1xhm s THR 47 Cb -0.04 -4.37 -0.25 0.00 0.01 0.00 0.00 72.50 67.84 1xhm s THR 47 CO 0.20 -0.42 0.33 0.54 -0.69 0.00 0.00 174.62 174.57 1xhm n ARG 48 N 6.73 0.67 -4.03 4.92 5.12 0.81 -4.98 116.66 125.90 1xhm n ARG 48 Ca 0.11 0.02 -0.08 0.00 -1.93 0.00 0.00 57.85 55.97 1xhm n ARG 48 Cb 0.47 -1.59 -0.10 0.00 -1.16 0.00 0.00 32.46 30.08 1xhm n ARG 48 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1xhm s ARG 49 N -2.78 0.57 -0.07 5.56 1.81 -1.18 -5.01 118.95 117.85 1xhm s ARG 49 Ca -0.08 -1.01 -0.03 0.00 -1.72 0.00 0.00 55.73 52.89 1xhm s ARG 49 Cb 0.08 0.20 0.04 0.00 -0.45 0.00 0.00 34.95 34.82 1xhm s ARG 49 CO 0.84 -0.12 0.08 0.99 -0.68 0.00 0.00 175.30 176.41 1xhm s THR 50 N -3.26 -0.12 -0.39 0.02 2.01 -1.26 -1.21 115.64 111.43 1xhm s THR 50 Ca 0.01 0.31 -0.23 0.00 0.31 0.00 0.00 61.69 62.09 1xhm s THR 50 Cb 0.03 -0.25 0.01 0.00 0.01 0.00 0.00 72.50 72.31 1xhm s THR 50 CO -0.08 0.09 0.78 -0.76 -0.69 0.00 0.00 174.62 173.97 1xhm s LEU 51 N 2.18 4.15 -0.25 4.42 1.43 0.78 -4.96 118.68 126.43 1xhm s LEU 51 Ca 0.04 0.24 -0.00 0.00 -1.03 0.00 0.00 54.13 53.38 1xhm s LEU 51 Cb -0.13 -3.01 0.04 0.00 0.03 0.00 0.00 46.19 43.12 1xhm s LEU 51 CO -0.04 -0.78 -0.08 -0.13 0.23 0.00 0.00 176.35 175.55 1xhm s ARG 52 N 3.15 2.60 0.00 1.70 0.52 -1.26 -2.92 118.95 122.75 1xhm s ARG 52 Ca 0.31 -1.12 0.00 0.00 -0.52 0.00 0.00 55.73 54.40 1xhm s ARG 52 Cb -0.13 -2.95 0.00 0.00 0.52 0.00 0.00 34.95 32.39 1xhm s ARG 52 CO 0.18 -0.47 0.00 0.41 0.02 0.00 0.00 175.30 175.44 1xhm n GLY 53 N 4.59 0.00 3.74 -3.53 0.00 -1.26 -5.09 105.19 103.64 1xhm n GLY 53 Ca -0.16 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.46 1xhm n GLY 53 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xhm s HIS 54 N -0.09 3.79 -0.87 1.61 3.76 -1.26 -4.94 115.29 117.29 1xhm s HIS 54 Ca 0.00 1.78 0.24 0.00 -0.15 0.00 0.00 55.06 56.93 1xhm s HIS 54 Cb 0.00 -3.12 0.24 0.00 1.11 0.00 0.00 32.58 30.82 1xhm s HIS 54 CO 0.00 -0.01 1.21 1.28 -0.85 0.00 0.00 174.74 176.37 1xhm n LEU 55 N 1.90 0.63 0.00 0.89 4.77 -1.26 -4.87 117.00 119.06 1xhm n LEU 55 Ca 0.00 -0.07 -0.15 0.00 -0.03 0.00 0.00 56.01 55.75 1xhm n LEU 55 Cb 0.47 -0.16 -0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1xhm n LEU 55 CO 0.52 0.11 -0.10 0.00 -1.33 0.00 0.00 177.39 176.59 1xhm n ALA 56 N -1.61 0.39 -1.82 -1.18 0.00 -1.26 -4.95 120.51 110.07 1xhm n ALA 56 Ca 0.04 -1.31 -0.41 0.00 0.00 0.00 0.00 53.44 51.76 1xhm n ALA 56 Cb 0.37 0.92 -0.02 0.00 0.00 0.00 0.00 19.45 20.72 1xhm n ALA 56 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 1xhm s LYS 57 N -2.97 4.33 0.10 0.00 -2.85 -1.26 -4.08 119.74 113.01 1xhm s LYS 57 Ca 0.16 2.23 -0.25 0.00 -1.00 0.00 0.00 55.97 57.10 1xhm s LYS 57 Cb 0.01 -3.09 -0.06 0.00 -2.06 0.00 0.00 37.83 32.62 1xhm s LYS 57 CO 0.11 -0.26 0.77 0.42 0.10 0.00 0.00 175.35 176.50 1xhm s ILE 58 N -0.71 4.58 -0.26 3.79 1.01 -0.61 -0.19 121.20 128.80 1xhm s ILE 58 Ca 0.52 1.67 -0.07 0.00 0.00 0.00 0.00 60.65 62.78 1xhm s ILE 58 Cb -0.40 -4.13 -0.15 0.00 0.01 0.00 0.00 42.46 37.79 1xhm s ILE 58 CO 0.49 0.43 -0.24 -1.22 0.00 0.00 0.00 174.94 174.40 1xhm n TYR 59 N 2.30 0.11 -4.13 3.97 4.01 0.16 -4.38 117.16 119.20 1xhm n TYR 59 Ca -0.04 0.03 -0.12 0.00 -0.16 0.00 0.00 57.90 57.62 1xhm n TYR 59 Cb 0.50 -1.01 -0.08 0.00 -0.31 0.00 0.00 39.34 38.44 1xhm n TYR 59 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1xhm s ALA 60 N -2.51 0.74 -0.16 -0.72 0.00 -1.20 -4.35 121.76 113.57 1xhm s ALA 60 Ca -0.36 -1.46 -0.29 0.00 0.00 0.00 0.00 51.96 49.86 1xhm s ALA 60 Cb 0.11 1.27 0.10 0.00 0.00 0.00 0.00 23.12 24.61 1xhm s ALA 60 CO 0.56 -0.70 0.87 0.00 0.00 0.00 0.00 175.76 176.49 1xhm s MET 61 N -3.93 0.75 -0.10 0.00 0.23 -1.26 -2.05 119.30 112.94 1xhm s MET 61 Ca 0.33 0.36 -0.04 0.00 -1.03 0.00 0.00 55.69 55.31 1xhm s MET 61 Cb 0.03 0.36 0.05 0.00 -1.53 0.00 0.00 34.83 33.74 1xhm s MET 61 CO 0.13 -0.20 0.20 -1.58 -2.03 0.00 0.00 175.02 171.54 1xhm s HIS 62 N -0.72 -0.26 0.63 3.16 2.46 -0.29 -4.80 115.29 115.46 1xhm s HIS 62 Ca -0.04 0.72 -0.17 0.00 0.47 0.00 0.00 55.06 56.04 1xhm s HIS 62 Cb -0.02 -0.14 -0.01 0.00 -0.13 0.00 0.00 32.58 32.28 1xhm s HIS 62 CO 0.03 -0.28 1.18 -1.58 -2.47 0.00 0.00 174.74 171.62 1xhm s TRP 63 N 2.09 2.39 0.44 3.88 0.52 -1.26 -2.07 118.94 124.93 1xhm s TRP 63 Ca -0.00 1.55 0.00 0.00 0.02 0.00 0.00 56.10 57.67 1xhm s TRP 63 Cb -0.12 -3.39 -0.01 0.00 -1.15 0.00 0.00 33.47 28.80 1xhm s TRP 63 CO -0.07 -2.13 0.66 0.20 0.02 0.00 0.00 176.95 175.64 1xhm s GLY 64 N -1.92 1.55 0.32 0.98 0.00 0.64 -4.70 107.32 104.18 1xhm s GLY 64 Ca 0.74 -1.03 0.01 0.00 0.00 0.00 0.00 44.72 44.44 1xhm s GLY 64 CO 0.37 -0.87 1.95 -0.84 0.00 0.00 0.00 173.10 173.72 1xhm h THR 65 N 0.42 1.12 0.00 0.90 2.02 -1.84 -1.57 112.91 113.95 1xhm h THR 65 Ca -0.46 -0.34 0.00 0.00 0.77 0.00 0.00 66.41 66.38 1xhm h THR 65 Cb 1.25 0.05 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 1xhm h THR 65 CO 0.58 0.18 0.00 -0.90 0.37 0.00 0.00 175.52 175.75 1xhm n ASP 66 N -4.45 0.00 -1.62 4.18 5.75 -1.26 -4.64 116.55 114.50 1xhm n ASP 66 Ca 0.11 -0.28 -0.17 0.00 -0.01 0.00 0.00 54.79 54.44 1xhm n ASP 66 Cb 0.13 -0.01 -0.06 0.00 -1.03 0.00 0.00 41.12 40.15 1xhm n ASP 66 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1xhm n SER 67 N -1.01 -4.46 0.04 -1.12 7.64 -0.59 -4.74 113.62 109.37 1xhm n SER 67 Ca 0.07 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.31 1xhm n SER 67 Cb 0.03 -3.99 0.00 0.00 -1.01 0.00 0.00 64.21 59.24 1xhm n SER 67 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1xhm n ARG 68 N -2.22 0.00 -2.62 1.43 0.63 -1.26 -4.92 116.66 107.69 1xhm n ARG 68 Ca -0.17 0.00 -0.29 0.00 -0.92 0.00 0.00 57.85 56.47 1xhm n ARG 68 Cb 0.56 -0.49 -0.01 0.00 0.45 0.00 0.00 32.46 32.97 1xhm n ARG 68 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1xhm s LEU 69 N -6.70 3.65 -0.14 6.15 1.43 -1.26 -2.32 118.68 119.49 1xhm s LEU 69 Ca 0.00 1.03 -0.26 0.00 -1.03 0.00 0.00 54.13 53.87 1xhm s LEU 69 Cb 0.00 -3.98 0.06 0.00 0.03 0.00 0.00 46.19 42.31 1xhm s LEU 69 CO 0.00 -0.55 0.65 -1.48 0.23 0.00 0.00 176.35 175.19 1xhm s LEU 70 N -4.53 -0.50 0.14 1.79 0.05 -0.62 -0.26 118.68 114.74 1xhm s LEU 70 Ca 0.49 0.98 0.04 0.00 0.05 0.00 0.00 54.13 55.69 1xhm s LEU 70 Cb -0.10 2.33 -0.04 0.00 -2.05 0.00 0.00 46.19 46.33 1xhm s LEU 70 CO 0.42 -0.42 0.16 0.68 -0.55 0.00 0.00 176.35 176.65 1xhm s VAL 71 N -0.46 4.73 -0.16 1.48 -7.23 -0.88 -0.07 120.40 117.82 1xhm s VAL 71 Ca -0.06 -0.90 -0.12 0.00 -1.81 0.00 0.00 61.98 59.09 1xhm s VAL 71 Cb -0.03 -3.39 0.05 0.00 0.56 0.00 0.00 36.38 33.57 1xhm s VAL 71 CO 0.05 -0.05 0.41 -0.94 -0.31 0.00 0.00 175.10 174.26 1xhm s SER 72 N -2.99 -0.46 -0.10 4.85 1.04 -0.53 -1.14 113.70 114.37 1xhm s SER 72 Ca 0.32 0.85 -0.02 0.00 0.48 0.00 0.00 55.95 57.58 1xhm s SER 72 Cb -0.11 0.81 -0.03 0.00 0.10 0.00 0.00 66.02 66.79 1xhm s SER 72 CO 0.25 -0.16 -0.01 0.00 0.98 0.00 0.00 173.24 174.29 1xhm s ALA 73 N 0.72 3.21 0.12 5.32 0.00 -0.87 -1.57 121.76 128.69 1xhm s ALA 73 Ca -0.04 -0.82 0.04 0.00 0.00 0.00 0.00 51.96 51.15 1xhm s ALA 73 Cb -0.05 -1.48 -0.04 0.00 0.00 0.00 0.00 23.12 21.54 1xhm s ALA 73 CO -0.05 0.50 -0.11 0.45 0.00 0.00 0.00 175.76 176.55 1xhm s SER 74 N -0.60 1.65 0.51 0.00 0.15 -0.62 -0.66 113.70 114.13 1xhm s SER 74 Ca 0.10 -0.89 0.25 0.00 0.70 0.00 0.00 55.95 56.10 1xhm s SER 74 Cb -0.12 -0.01 1.36 0.00 -1.71 0.00 0.00 66.02 65.54 1xhm s SER 74 CO 0.02 -0.28 1.73 -0.61 1.20 0.00 0.00 173.24 175.31 1xhm h GLN 75 N 3.25 0.00 0.00 5.44 4.15 -0.79 0.21 115.11 127.37 1xhm h GLN 75 Ca -0.37 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.05 1xhm h GLN 75 Cb 1.19 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.88 1xhm h GLN 75 CO 0.57 0.00 0.00 -0.40 -1.93 0.00 0.00 178.83 177.07 1xhm n ASP 76 N -2.55 0.00 -0.95 -0.69 5.75 -1.26 -4.82 116.55 112.03 1xhm n ASP 76 Ca -0.02 -1.29 -0.09 0.00 -0.01 0.00 0.00 54.79 53.38 1xhm n ASP 76 Cb 0.27 0.00 -0.02 0.00 -1.03 0.00 0.00 41.12 40.35 1xhm n ASP 76 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xhm n GLY 77 N 0.40 0.34 3.42 6.12 0.00 0.06 -4.98 105.19 110.55 1xhm n GLY 77 Ca 0.07 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 45.26 1xhm n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xhm s LYS 78 N -3.93 1.63 -0.30 1.61 -0.14 -1.21 -0.66 119.74 116.74 1xhm s LYS 78 Ca 0.00 -1.23 0.01 0.00 -1.36 0.00 0.00 55.97 53.39 1xhm s LYS 78 Cb 0.00 -2.00 0.09 0.00 -1.68 0.00 0.00 37.83 34.24 1xhm s LYS 78 CO 0.00 0.48 0.06 -1.17 -0.76 0.00 0.00 175.35 173.95 1xhm s LEU 79 N -1.91 3.05 -0.05 3.17 2.96 -0.82 -1.59 118.68 123.47 1xhm s LEU 79 Ca 0.15 -1.70 -0.01 0.00 -0.22 0.00 0.00 54.13 52.35 1xhm s LEU 79 Cb -0.10 -1.15 -0.03 0.00 0.50 0.00 0.00 46.19 45.41 1xhm s LEU 79 CO 0.07 -0.37 0.02 -0.63 -1.32 0.00 0.00 176.35 174.11 1xhm s ILE 80 N 1.37 4.38 -0.30 6.68 1.01 -0.61 -1.08 121.20 132.65 1xhm s ILE 80 Ca 0.07 -0.34 -0.08 0.00 0.00 0.00 0.00 60.65 60.31 1xhm s ILE 80 Cb -0.18 -2.90 0.01 0.00 0.01 0.00 0.00 42.46 39.40 1xhm s ILE 80 CO -0.16 0.51 0.10 -0.63 0.00 0.00 0.00 174.94 174.76 1xhm s ILE 81 N -0.99 4.12 0.06 2.92 1.01 -0.84 -1.45 121.20 126.03 1xhm s ILE 81 Ca 0.16 -0.64 0.02 0.00 0.00 0.00 0.00 60.65 60.19 1xhm s ILE 81 Cb -0.11 -3.12 -0.04 0.00 0.01 0.00 0.00 42.46 39.19 1xhm s ILE 81 CO 0.06 0.07 0.12 0.26 0.00 0.00 0.00 174.94 175.45 1xhm s TRP 82 N 1.53 3.31 -0.53 3.97 0.52 0.90 0.15 118.94 128.78 1xhm s TRP 82 Ca 0.03 0.15 -0.13 0.00 0.02 0.00 0.00 56.10 56.17 1xhm s TRP 82 Cb -0.17 -1.68 0.13 0.00 -1.15 0.00 0.00 33.47 30.60 1xhm s TRP 82 CO 0.03 0.55 0.46 0.34 0.02 0.00 0.00 176.95 178.36 1xhm s ASP 83 N -2.35 6.04 0.57 2.95 -1.08 -0.56 -1.60 116.67 120.65 1xhm s ASP 83 Ca 0.30 -1.90 0.28 0.00 -0.52 0.00 0.00 52.55 50.71 1xhm s ASP 83 Cb -0.12 -2.14 1.49 0.00 -1.46 0.00 0.00 42.92 40.69 1xhm s ASP 83 CO 0.23 -0.78 1.98 0.77 0.52 0.00 0.00 175.17 177.89 1xhm h SER 84 N 8.65 0.00 -0.04 -0.34 4.64 -1.75 0.13 113.55 124.83 1xhm h SER 84 Ca -0.24 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.04 1xhm h SER 84 Cb 1.08 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 1xhm h SER 84 CO 0.96 0.00 -0.14 1.88 -0.87 0.00 0.00 176.83 178.66 1xhm h TYR 85 N 0.00 0.22 0.00 4.77 -1.99 -1.92 -3.35 116.97 114.70 1xhm h TYR 85 Ca 0.21 -0.09 0.00 0.00 2.00 0.00 0.00 58.73 60.85 1xhm h TYR 85 Cb 0.98 -0.04 0.00 0.00 2.00 0.00 0.00 36.73 39.67 1xhm h TYR 85 CO 0.00 0.76 -1.23 0.25 -0.00 0.00 0.00 178.16 177.95 1xhm n THR 86 N -4.62 0.19 -0.70 -2.88 -2.24 -1.06 -4.94 114.28 98.03 1xhm n THR 86 Ca -0.08 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1xhm n THR 86 Cb 0.39 0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 1xhm n THR 86 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1xhm n THR 87 N -2.11 0.00 -1.40 4.28 -1.04 0.42 -5.00 114.28 109.44 1xhm n THR 87 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.05 61.71 1xhm n THR 87 Cb 0.48 -0.03 0.08 0.00 -1.82 0.00 0.00 70.33 69.04 1xhm n THR 87 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1xhm s ASN 88 N -3.17 4.78 0.05 8.00 0.02 -1.24 -4.75 114.94 118.63 1xhm s ASN 88 Ca 0.00 1.69 -0.03 0.00 -1.02 0.00 0.00 52.86 53.49 1xhm s ASN 88 Cb 0.00 -2.46 -0.05 0.00 0.02 0.00 0.00 41.25 38.77 1xhm s ASN 88 CO 0.00 -1.84 0.26 -1.59 0.02 0.00 0.00 177.10 173.95 1xhm s LYS 89 N -4.98 3.52 -0.22 -0.60 -2.85 -1.26 -1.50 119.74 111.86 1xhm s LYS 89 Ca 0.60 -0.24 -0.16 0.00 -1.00 0.00 0.00 55.97 55.17 1xhm s LYS 89 Cb -0.16 -3.02 -0.09 0.00 -2.06 0.00 0.00 37.83 32.50 1xhm s LYS 89 CO 0.56 0.60 -0.31 0.28 0.10 0.00 0.00 175.35 176.58 1xhm n VAL 90 N 0.61 1.51 -4.33 1.79 0.31 0.12 -4.89 118.33 113.44 1xhm n VAL 90 Ca -0.07 -0.06 -0.17 0.00 -0.01 0.00 0.00 64.34 64.03 1xhm n VAL 90 Cb 0.52 -2.16 -0.10 0.00 -0.91 0.00 0.00 33.84 31.18 1xhm n VAL 90 CO 0.00 0.00 0.00 -1.00 -1.32 0.00 0.00 176.83 174.51 1xhm s HIS 91 N -2.68 1.58 -0.46 3.52 3.76 -1.20 -4.99 115.29 114.82 1xhm s HIS 91 Ca -0.32 -0.96 0.06 0.00 -0.15 0.00 0.00 55.06 53.69 1xhm s HIS 91 Cb 0.08 -0.93 0.18 0.00 1.11 0.00 0.00 32.58 33.02 1xhm s HIS 91 CO 0.44 -0.08 0.56 0.00 -0.85 0.00 0.00 174.74 174.81 1xhm s ALA 92 N -3.46 -0.94 0.18 -1.40 0.00 -1.26 -1.99 121.76 112.89 1xhm s ALA 92 Ca 0.30 -0.99 -0.30 0.00 0.00 0.00 0.00 51.96 50.97 1xhm s ALA 92 Cb 0.06 -2.32 -0.08 0.00 0.00 0.00 0.00 23.12 20.79 1xhm s ALA 92 CO 0.10 -2.15 1.13 0.42 0.00 0.00 0.00 175.76 175.25 1xhm s ILE 93 N 0.84 3.78 -0.27 0.00 1.09 -0.24 -4.87 121.20 121.53 1xhm s ILE 93 Ca 0.27 1.52 -0.28 0.00 -1.10 0.00 0.00 60.65 61.07 1xhm s ILE 93 Cb -0.02 -3.97 0.01 0.00 -1.06 0.00 0.00 42.46 37.42 1xhm s ILE 93 CO -0.09 0.26 1.00 -2.84 -0.10 0.00 0.00 174.94 173.17 1xhm s PRO 94 N -0.32 4.15 0.12 2.79 0.02 -1.26 -1.95 135.00 138.55 1xhm s PRO 94 Ca 0.50 1.14 -0.27 0.00 0.02 0.00 0.00 61.00 62.39 1xhm s PRO 94 Cb -0.30 -3.68 -0.07 0.00 0.02 0.00 0.00 34.50 30.47 1xhm s PRO 94 CO 0.35 -0.72 0.85 -0.51 -0.33 0.00 0.00 177.00 176.65 1xhm s LEU 95 N 3.29 4.53 0.07 -5.54 1.43 0.16 -4.91 118.68 117.71 1xhm s LEU 95 Ca 0.42 1.67 0.21 0.00 -1.03 0.00 0.00 54.13 55.40 1xhm s LEU 95 Cb -0.14 -3.40 0.86 0.00 0.03 0.00 0.00 46.19 43.54 1xhm s LEU 95 CO 0.10 0.06 1.65 -1.14 0.23 0.00 0.00 176.35 177.26 1xhm n ARG 96 N 2.31 0.06 -4.46 1.70 0.63 -1.26 -4.77 116.66 110.86 1xhm n ARG 96 Ca -0.02 0.22 -0.23 0.00 -0.92 0.00 0.00 57.85 56.90 1xhm n ARG 96 Cb 0.49 -1.60 -0.10 0.00 0.45 0.00 0.00 32.46 31.71 1xhm n ARG 96 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 1xhm s SER 97 N -3.37 2.42 0.00 6.15 0.15 -1.26 -5.05 113.70 112.74 1xhm s SER 97 Ca 0.09 -1.50 0.00 0.00 0.70 0.00 0.00 55.95 55.23 1xhm s SER 97 Cb 0.12 0.19 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 1xhm s SER 97 CO 0.38 -0.76 0.00 -1.54 1.20 0.00 0.00 173.24 172.53 1xhm n SER 98 N -0.92 3.41 -3.56 5.45 3.41 -1.26 -4.48 113.62 115.66 1xhm n SER 98 Ca -0.04 -0.11 -0.41 0.00 -0.26 0.00 0.00 58.87 58.06 1xhm n SER 98 Cb 0.66 0.89 -0.00 0.00 -0.26 0.00 0.00 64.21 65.50 1xhm n SER 98 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 1xhm n TRP 99 N -1.23 2.65 -3.36 7.33 8.01 -1.26 -4.44 117.44 125.14 1xhm n TRP 99 Ca 0.00 -2.80 -0.38 0.00 -1.31 0.00 0.00 57.50 53.01 1xhm n TRP 99 Cb 0.00 -1.82 -0.06 0.00 -2.01 0.00 0.00 31.31 27.42 1xhm n TRP 99 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.69 176.76 1xhm s VAL 100 N -1.04 5.10 -0.16 -0.99 1.01 -1.26 -2.31 120.40 120.75 1xhm s VAL 100 Ca 0.50 0.95 0.06 0.00 0.00 0.00 0.00 61.98 63.49 1xhm s VAL 100 Cb 0.17 -3.80 -0.14 0.00 0.00 0.00 0.00 36.38 32.61 1xhm s VAL 100 CO -0.07 0.41 -0.08 0.23 0.00 0.00 0.00 175.10 175.59 1xhm n MET 101 N 3.01 0.96 -4.00 2.72 2.81 0.12 -4.83 117.12 117.92 1xhm n MET 101 Ca -0.09 0.06 -0.08 0.00 -1.81 0.00 0.00 57.70 55.78 1xhm n MET 101 Cb 0.52 -1.36 -0.10 0.00 -0.71 0.00 0.00 33.22 31.57 1xhm n MET 101 CO 0.00 0.00 0.00 -0.08 1.51 0.00 0.00 175.97 177.40 1xhm s THR 102 N -2.35 0.17 -0.09 2.03 -1.32 -0.95 -4.42 115.64 108.71 1xhm s THR 102 Ca -0.17 -1.40 -0.11 0.00 -1.21 0.00 0.00 61.69 58.79 1xhm s THR 102 Cb 0.05 -1.15 0.03 0.00 -1.51 0.00 0.00 72.50 69.92 1xhm s THR 102 CO 0.48 -0.77 0.30 0.00 -2.21 0.00 0.00 174.62 172.41 1xhm s ALA 104 N -0.21 0.97 -0.11 0.00 0.00 0.10 -4.36 121.76 118.15 1xhm s ALA 104 Ca -0.03 -1.14 -0.00 0.00 0.00 0.00 0.00 51.96 50.78 1xhm s ALA 104 Cb -0.03 0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.13 1xhm s ALA 104 CO 0.01 -0.08 -0.10 -0.47 0.00 0.00 0.00 175.76 175.12 1xhm s TYR 105 N -2.53 2.87 0.27 0.00 6.14 -1.26 -0.06 117.35 122.78 1xhm s TYR 105 Ca 0.04 -0.31 -0.29 0.00 0.64 0.00 0.00 57.07 57.15 1xhm s TYR 105 Cb -0.02 -1.80 -0.09 0.00 0.42 0.00 0.00 41.96 40.47 1xhm s TYR 105 CO -0.01 0.04 0.99 0.00 0.64 0.00 0.00 175.55 177.21 1xhm s ALA 106 N -0.14 3.33 0.42 3.97 0.00 -0.22 -4.60 121.76 124.52 1xhm s ALA 106 Ca 0.01 0.69 0.17 0.00 0.00 0.00 0.00 51.96 52.82 1xhm s ALA 106 Cb -0.13 -3.24 1.06 0.00 0.00 0.00 0.00 23.12 20.80 1xhm s ALA 106 CO 0.03 0.08 1.87 -1.35 0.00 0.00 0.00 175.76 176.39 1xhm h PRO 107 N 3.85 0.41 0.00 0.00 0.11 -1.89 0.21 132.00 134.69 1xhm h PRO 107 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1xhm h PRO 107 Cb 1.20 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1xhm h PRO 107 CO 0.67 0.27 0.00 -1.13 -0.21 0.00 0.00 178.00 177.60 1xhm n SER 108 N -4.51 0.33 -0.02 -2.05 3.41 -1.26 -4.48 113.62 105.05 1xhm n SER 108 Ca 0.18 0.56 -0.00 0.00 -0.26 0.00 0.00 58.87 59.35 1xhm n SER 108 Cb 0.64 -0.64 -0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1xhm n SER 108 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xhm n GLY 109 N 0.57 0.37 0.11 5.00 0.00 0.72 -4.88 105.19 107.07 1xhm n GLY 109 Ca 0.04 -0.03 0.05 0.00 0.00 0.00 0.00 46.02 46.08 1xhm n GLY 109 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1xhm h ASN 110 N 0.00 0.00 -4.46 1.61 2.35 -1.90 -3.44 115.58 109.73 1xhm h ASN 110 Ca -0.00 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.42 1xhm h ASN 110 Cb 0.30 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.52 1xhm h ASN 110 CO 0.01 0.35 -0.63 -0.31 -1.65 0.00 0.00 177.43 175.19 1xhm s TYR 111 N -3.10 1.43 0.04 1.19 1.51 -1.26 -1.72 117.35 115.45 1xhm s TYR 111 Ca -0.01 -1.11 -0.12 0.00 -1.01 0.00 0.00 57.07 54.82 1xhm s TYR 111 Cb 0.09 -0.83 0.01 0.00 -0.11 0.00 0.00 41.96 41.12 1xhm s TYR 111 CO 0.80 -0.28 0.25 0.14 -1.11 0.00 0.00 175.55 175.35 1xhm s VAL 112 N -3.70 0.10 0.14 0.71 -7.23 -0.90 -1.05 120.40 108.46 1xhm s VAL 112 Ca 0.33 -0.79 0.01 0.00 -1.81 0.00 0.00 61.98 59.72 1xhm s VAL 112 Cb 0.07 -0.93 -0.04 0.00 0.56 0.00 0.00 36.38 36.04 1xhm s VAL 112 CO 0.10 -0.43 -0.02 0.00 -0.31 0.00 0.00 175.10 174.44 1xhm s ALA 113 N -2.58 1.15 0.11 1.32 0.00 0.92 -0.35 121.76 122.33 1xhm s ALA 113 Ca -0.05 -1.48 -0.22 0.00 0.00 0.00 0.00 51.96 50.20 1xhm s ALA 113 Cb -0.01 0.44 0.06 0.00 0.00 0.00 0.00 23.12 23.61 1xhm s ALA 113 CO -0.04 -0.31 0.55 0.00 0.00 0.00 0.00 175.76 175.97 1xhm s GLY 115 N -2.47 -0.25 0.00 0.00 0.00 -0.46 0.26 107.32 104.40 1xhm s GLY 115 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 44.72 44.71 1xhm s GLY 115 CO -0.09 0.00 0.00 0.61 0.00 0.00 0.00 173.10 173.63 1xhm n GLY 116 N -0.43 1.79 0.00 0.20 0.00 -1.24 0.16 105.19 105.67 1xhm n GLY 116 Ca -0.07 -0.14 0.06 0.00 0.00 0.00 0.00 46.02 45.86 1xhm n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xhm n LEU 117 N 0.00 0.00 -0.33 0.99 7.99 -0.98 -0.85 117.00 123.82 1xhm n LEU 117 Ca 0.00 0.00 0.14 0.00 -0.01 0.00 0.00 56.01 56.14 1xhm n LEU 117 Cb 0.00 0.00 0.65 0.00 -0.11 0.00 0.00 43.42 43.96 1xhm n LEU 117 CO 0.00 0.00 0.94 -0.90 -1.51 0.00 0.00 177.39 175.92 1xhm n ASP 118 N -0.99 1.04 -1.85 -1.43 5.75 -1.26 -4.85 116.55 112.95 1xhm n ASP 118 Ca 0.09 -1.36 -0.14 0.00 -0.01 0.00 0.00 54.79 53.37 1xhm n ASP 118 Cb 0.04 -0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.09 1xhm n ASP 118 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1xhm n ASN 119 N -0.18 -3.84 -3.96 -1.12 4.13 -0.12 -4.95 115.26 105.23 1xhm n ASN 119 Ca 0.20 0.26 -0.18 0.00 1.68 0.00 0.00 54.58 56.55 1xhm n ASN 119 Cb 0.28 -3.42 -0.15 0.00 -1.54 0.00 0.00 39.78 34.94 1xhm n ASN 119 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1xhm s ILE 120 N -2.38 0.52 -0.29 2.41 1.01 -1.26 -4.12 121.20 117.09 1xhm s ILE 120 Ca 0.00 -0.23 -0.18 0.00 0.00 0.00 0.00 60.65 60.23 1xhm s ILE 120 Cb 0.00 -0.47 -0.02 0.00 0.01 0.00 0.00 42.46 41.98 1xhm s ILE 120 CO 0.00 0.17 0.53 0.00 0.00 0.00 0.00 174.94 175.64 1xhm s SER 122 N 1.61 5.57 -0.17 0.00 0.01 0.14 -0.66 113.70 120.21 1xhm s SER 122 Ca 0.21 0.01 -0.07 0.00 1.31 0.00 0.00 55.95 57.42 1xhm s SER 122 Cb -0.15 -1.98 -0.04 0.00 0.21 0.00 0.00 66.02 64.06 1xhm s SER 122 CO 0.10 0.10 0.06 -0.63 0.41 0.00 0.00 173.24 173.29 1xhm s ILE 123 N 0.81 4.77 0.12 1.44 1.09 0.13 -1.39 121.20 128.16 1xhm s ILE 123 Ca 0.04 -0.05 0.10 0.00 -1.10 0.00 0.00 60.65 59.65 1xhm s ILE 123 Cb -0.13 -3.13 -0.04 0.00 -1.06 0.00 0.00 42.46 38.10 1xhm s ILE 123 CO 0.02 0.49 -0.23 -0.31 -0.10 0.00 0.00 174.94 174.81 1xhm s TYR 124 N 0.11 2.41 -0.22 3.97 1.51 0.53 -1.48 117.35 124.19 1xhm s TYR 124 Ca 0.05 -0.33 -0.07 0.00 -1.01 0.00 0.00 57.07 55.71 1xhm s TYR 124 Cb -0.12 -1.30 -0.03 0.00 -0.11 0.00 0.00 41.96 40.40 1xhm s TYR 124 CO 0.01 0.35 0.05 1.21 -1.11 0.00 0.00 175.55 176.06 1xhm s ASN 125 N -2.05 5.20 0.00 2.29 3.84 -1.16 -2.13 114.94 120.93 1xhm s ASN 125 Ca 0.16 -0.13 0.13 0.00 0.21 0.00 0.00 52.86 53.23 1xhm s ASN 125 Cb -0.10 -1.91 0.04 0.00 -0.55 0.00 0.00 41.25 38.72 1xhm s ASN 125 CO 0.08 0.04 0.80 0.00 -2.79 0.00 0.00 177.10 175.23 1xhm n LEU 126 N 4.39 1.67 -0.79 3.21 -0.00 -0.70 -3.72 117.00 121.06 1xhm n LEU 126 Ca -0.16 -0.86 0.05 0.00 -0.00 0.00 0.00 56.01 55.04 1xhm n LEU 126 Cb 0.52 0.00 0.21 0.00 -0.00 0.00 0.00 43.42 44.15 1xhm n LEU 126 CO 0.32 0.32 0.66 0.29 -0.00 0.00 0.00 177.39 178.98 1xhm n LYS 127 N 0.17 2.19 -1.64 1.47 4.01 -1.19 -4.93 118.16 118.24 1xhm n LYS 127 Ca 0.06 -2.92 -0.41 0.00 -0.51 0.00 0.00 58.31 54.54 1xhm n LYS 127 Cb 0.29 -1.75 0.01 0.00 -0.51 0.00 0.00 35.03 33.07 1xhm n LYS 127 CO 0.00 0.00 0.00 2.41 -1.11 0.00 0.00 177.40 178.70 1xhm n THR 128 N -0.92 2.59 1.61 -0.18 -1.04 -1.26 -4.82 114.28 110.26 1xhm n THR 128 Ca 0.24 -0.50 0.01 0.00 -2.04 0.00 0.00 64.05 61.76 1xhm n THR 128 Cb 0.87 -1.28 0.08 0.00 -1.82 0.00 0.00 70.33 68.18 1xhm n THR 128 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1xhm n ARG 129 N 0.02 0.81 -0.07 -2.82 0.63 -1.26 -2.20 116.66 111.76 1xhm n ARG 129 Ca 0.09 0.00 -0.07 0.00 -0.92 0.00 0.00 57.85 56.95 1xhm n ARG 129 Cb 0.40 -1.05 -0.12 0.00 0.45 0.00 0.00 32.46 32.14 1xhm n ARG 129 CO 0.00 0.00 0.00 -1.91 -2.51 0.00 0.00 177.63 173.21 1xhm n GLU 130 N -0.55 1.57 -0.44 -0.14 2.13 -1.26 -5.01 120.64 116.95 1xhm n GLU 130 Ca 0.02 -0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.83 1xhm n GLU 130 Cb 0.01 -1.38 0.00 0.00 0.27 0.00 0.00 31.44 30.34 1xhm n GLU 130 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1xhm n GLY 131 N 2.08 0.77 2.84 8.31 0.00 -0.93 -5.05 105.19 113.21 1xhm n GLY 131 Ca -0.23 -0.06 -0.23 0.00 0.00 0.00 0.00 46.02 45.49 1xhm n GLY 131 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xhm s ASN 132 N -2.06 1.64 0.13 1.61 0.01 -1.26 -5.03 114.94 109.98 1xhm s ASN 132 Ca 0.00 -0.16 -0.31 0.00 -0.71 0.00 0.00 52.86 51.68 1xhm s ASN 132 Cb 0.00 -0.56 -0.09 0.00 0.41 0.00 0.00 41.25 41.01 1xhm s ASN 132 CO 0.00 -0.14 1.54 -0.69 -1.51 0.00 0.00 177.10 176.30 1xhm s VAL 133 N 1.66 2.90 -0.03 1.60 1.01 -1.26 -4.82 120.40 121.47 1xhm s VAL 133 Ca 0.01 0.58 -0.04 0.00 0.00 0.00 0.00 61.98 62.54 1xhm s VAL 133 Cb -0.13 -3.37 0.01 0.00 0.00 0.00 0.00 36.38 32.88 1xhm s VAL 133 CO -0.05 0.03 0.10 -0.13 0.00 0.00 0.00 175.10 175.05 1xhm s ARG 134 N 1.53 0.19 -0.53 2.72 0.52 -1.24 -4.96 118.95 117.18 1xhm s ARG 134 Ca 0.69 -0.00 -0.27 0.00 -0.52 0.00 0.00 55.73 55.63 1xhm s ARG 134 Cb -0.41 0.08 -0.09 0.00 0.52 0.00 0.00 34.95 35.05 1xhm s ARG 134 CO 0.31 -0.03 2.43 0.28 0.02 0.00 0.00 175.30 178.31 1xhm n VAL 135 N 2.67 -0.02 0.31 3.52 0.31 -1.26 -3.00 118.33 120.85 1xhm n VAL 135 Ca -0.15 -0.64 0.14 0.00 -0.01 0.00 0.00 64.34 63.69 1xhm n VAL 135 Cb 0.58 -2.41 0.46 0.00 -0.91 0.00 0.00 33.84 31.56 1xhm n VAL 135 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 1xhm h SER 136 N 17.81 0.00 -3.20 4.52 4.64 -1.59 -3.46 113.55 132.26 1xhm h SER 136 Ca -0.23 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.23 1xhm h SER 136 Cb 1.28 0.00 -0.27 0.00 -0.31 0.00 0.00 62.40 63.09 1xhm h SER 136 CO 1.16 0.00 0.70 -0.60 -0.87 0.00 0.00 176.83 177.22 1xhm s ARG 137 N -3.42 0.32 -0.12 4.77 6.06 -1.17 -5.02 118.95 120.38 1xhm s ARG 137 Ca 0.04 0.21 0.02 0.00 -2.50 0.00 0.00 55.73 53.50 1xhm s ARG 137 Cb 0.08 0.16 0.01 0.00 0.06 0.00 0.00 34.95 35.26 1xhm s ARG 137 CO 0.57 -0.07 -0.17 -1.21 -2.50 0.00 0.00 175.30 171.92 1xhm s GLU 138 N -0.50 2.38 -1.07 5.12 2.02 -1.26 -0.70 118.70 124.70 1xhm s GLU 138 Ca 0.04 -0.62 -0.07 0.00 0.02 0.00 0.00 54.97 54.34 1xhm s GLU 138 Cb -0.03 -2.01 0.27 0.00 0.10 0.00 0.00 34.13 32.47 1xhm s GLU 138 CO -0.07 -0.06 1.11 1.28 0.02 0.00 0.00 175.26 177.54 1xhm n LEU 139 N 4.20 5.39 -4.78 1.80 4.77 0.17 -4.97 117.00 123.58 1xhm n LEU 139 Ca -0.19 -5.09 -0.32 0.00 -0.03 0.00 0.00 56.01 50.38 1xhm n LEU 139 Cb 0.51 -1.36 0.07 0.00 -2.33 0.00 0.00 43.42 40.31 1xhm n LEU 139 CO 0.24 1.46 0.71 0.00 -1.33 0.00 0.00 177.39 178.47 1xhm s ALA 140 N -1.57 2.41 0.00 -1.18 0.00 -1.26 -3.41 121.76 116.75 1xhm s ALA 140 Ca 0.31 0.34 0.00 0.00 0.00 0.00 0.00 51.96 52.60 1xhm s ALA 140 Cb -0.07 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.78 1xhm s ALA 140 CO -0.06 -1.47 0.00 0.41 0.00 0.00 0.00 175.76 174.64 1xhm n GLY 141 N -1.09 2.36 3.76 0.00 0.00 -1.26 -5.02 105.19 103.94 1xhm n GLY 141 Ca 0.09 -0.26 -0.41 0.00 0.00 0.00 0.00 46.02 45.45 1xhm n GLY 141 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xhm s HIS 142 N 0.00 3.12 -1.88 1.61 3.76 -1.26 -4.92 115.29 115.73 1xhm s HIS 142 Ca 0.00 1.33 0.17 0.00 -0.15 0.00 0.00 55.06 56.42 1xhm s HIS 142 Cb 0.00 -3.66 0.52 0.00 1.11 0.00 0.00 32.58 30.56 1xhm s HIS 142 CO 0.00 -1.90 1.43 0.25 -0.85 0.00 0.00 174.74 173.68 1xhm n THR 143 N 1.44 0.88 -4.18 1.30 -2.24 -1.26 -4.87 114.28 105.35 1xhm n THR 143 Ca 0.02 -0.80 -0.13 0.00 -2.27 0.00 0.00 64.05 60.87 1xhm n THR 143 Cb 0.42 0.34 -0.08 0.00 -2.10 0.00 0.00 70.33 68.90 1xhm n THR 143 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1xhm s GLY 144 N -0.97 1.50 0.74 3.38 0.00 -1.26 -4.72 107.32 105.99 1xhm s GLY 144 Ca 0.39 -1.64 -0.15 0.00 0.00 0.00 0.00 44.72 43.32 1xhm s GLY 144 CO 0.25 -1.26 1.22 -2.52 0.00 0.00 0.00 173.10 170.79 1xhm s TYR 145 N -3.87 1.98 -0.26 1.90 -0.85 -1.26 -4.34 117.35 110.64 1xhm s TYR 145 Ca 0.36 1.60 -0.17 0.00 -0.52 0.00 0.00 57.07 58.35 1xhm s TYR 145 Cb 0.04 -3.51 -0.03 0.00 0.38 0.00 0.00 41.96 38.84 1xhm s TYR 145 CO 0.16 -2.73 0.47 -1.17 -1.52 0.00 0.00 175.55 170.76 1xhm s LEU 146 N -5.20 4.05 -0.10 -3.49 2.96 -0.03 0.31 118.68 117.18 1xhm s LEU 146 Ca 0.75 0.46 0.19 0.00 -0.22 0.00 0.00 54.13 55.31 1xhm s LEU 146 Cb -0.30 -2.60 -0.27 0.00 0.50 0.00 0.00 46.19 43.52 1xhm s LEU 146 CO 0.46 -0.25 0.27 -1.54 -1.32 0.00 0.00 176.35 173.96 1xhm n SER 147 N 5.46 0.38 -3.56 3.68 3.41 -0.77 -3.73 113.62 118.49 1xhm n SER 147 Ca -0.05 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.42 1xhm n SER 147 Cb 0.50 1.47 -0.06 0.00 -0.26 0.00 0.00 64.21 65.87 1xhm n SER 147 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xhm s ARG 150 N -0.96 0.31 -0.01 0.00 1.81 0.56 -4.53 118.95 116.12 1xhm s ARG 150 Ca -0.10 0.53 -0.30 0.00 -1.72 0.00 0.00 55.73 54.14 1xhm s ARG 150 Cb -0.04 0.03 -0.04 0.00 -0.45 0.00 0.00 34.95 34.45 1xhm s ARG 150 CO 0.04 -0.11 1.13 -0.06 -0.68 0.00 0.00 175.30 175.61 1xhm s PHE 151 N 0.80 3.42 -0.02 -0.53 0.08 -1.26 -1.20 117.98 119.26 1xhm s PHE 151 Ca -0.05 1.40 -0.17 0.00 0.12 0.00 0.00 56.93 58.22 1xhm s PHE 151 Cb -0.06 -3.32 -0.33 0.00 -0.57 0.00 0.00 43.02 38.73 1xhm s PHE 151 CO -0.05 -0.87 0.88 -0.07 -0.10 0.00 0.00 175.22 175.00 1xhm h LEU 152 N 7.36 0.64 0.00 -0.37 -0.00 -1.44 -3.45 115.31 118.06 1xhm h LEU 152 Ca -0.38 -0.93 0.00 0.00 -0.00 0.00 0.00 57.88 56.57 1xhm h LEU 152 Cb 1.19 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 41.64 1xhm h LEU 152 CO 0.82 1.60 0.00 -0.90 -0.00 0.00 0.00 178.44 179.97 1xhm n ASP 153 N -3.87 0.00 0.00 -0.43 5.75 -1.13 -4.90 116.55 111.96 1xhm n ASP 153 Ca -0.18 -0.17 0.13 0.00 -0.01 0.00 0.00 54.79 54.57 1xhm n ASP 153 Cb 0.98 0.00 0.67 0.00 -1.03 0.00 0.00 41.12 41.74 1xhm n ASP 153 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1xhm n ASP 154 N -0.13 0.00 -0.03 -1.12 8.00 -1.26 -3.78 116.55 118.23 1xhm n ASP 154 Ca 0.00 -0.08 -0.02 0.00 0.71 0.00 0.00 54.79 55.40 1xhm n ASP 154 Cb 0.00 -0.29 -0.07 0.00 -0.02 0.00 0.00 41.12 40.74 1xhm n ASP 154 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1xhm n ASN 155 N -1.29 2.95 -4.27 -2.24 3.02 -1.26 -4.86 115.26 107.31 1xhm n ASN 155 Ca 0.12 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.43 1xhm n ASN 155 Cb 0.21 0.86 -0.13 0.00 -0.61 0.00 0.00 39.78 40.11 1xhm n ASN 155 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1xhm s GLN 156 N -2.29 1.28 -0.02 3.52 -0.21 -1.25 -0.20 119.66 120.49 1xhm s GLN 156 Ca -0.04 -1.04 -0.06 0.00 0.02 0.00 0.00 55.36 54.24 1xhm s GLN 156 Cb 0.03 -1.46 0.00 0.00 1.00 0.00 0.00 33.01 32.58 1xhm s GLN 156 CO 0.35 0.36 0.13 -1.50 -2.12 0.00 0.00 175.29 172.51 1xhm s ILE 157 N -0.95 0.06 -0.05 1.08 2.07 -0.96 -1.01 121.20 121.44 1xhm s ILE 157 Ca 0.07 -0.46 0.05 0.00 -1.41 0.00 0.00 60.65 58.89 1xhm s ILE 157 Cb -0.09 -0.35 -0.02 0.00 0.13 0.00 0.00 42.46 42.12 1xhm s ILE 157 CO 0.03 -0.25 -0.18 0.54 -1.91 0.00 0.00 174.94 173.16 1xhm s VAL 158 N -0.88 2.74 0.02 4.00 0.11 -0.34 0.03 120.40 126.07 1xhm s VAL 158 Ca -0.10 -0.84 0.02 0.00 -2.93 0.00 0.00 61.98 58.14 1xhm s VAL 158 Cb -0.05 -2.05 -0.01 0.00 -1.53 0.00 0.00 36.38 32.73 1xhm s VAL 158 CO 0.01 0.58 -0.07 0.42 -3.33 0.00 0.00 175.10 172.71 1xhm s THR 159 N -0.61 0.53 0.00 5.04 -4.23 -0.07 -0.32 115.64 115.99 1xhm s THR 159 Ca 0.09 -0.60 0.02 0.00 -1.18 0.00 0.00 61.69 60.02 1xhm s THR 159 Cb -0.11 -0.51 -0.04 0.00 1.34 0.00 0.00 72.50 73.18 1xhm s THR 159 CO 0.01 -0.06 -0.03 -0.94 -0.54 0.00 0.00 174.62 173.05 1xhm s SER 160 N -0.73 4.91 0.17 3.99 1.04 0.63 -1.06 113.70 122.65 1xhm s SER 160 Ca -0.02 -0.07 0.01 0.00 0.48 0.00 0.00 55.95 56.35 1xhm s SER 160 Cb -0.05 -1.22 -0.05 0.00 0.10 0.00 0.00 66.02 64.80 1xhm s SER 160 CO 0.00 0.28 0.01 -0.55 0.98 0.00 0.00 173.24 173.96 1xhm s SER 161 N -1.52 1.10 0.00 7.02 0.15 -0.69 -1.84 113.70 117.91 1xhm s SER 161 Ca 0.19 -1.17 0.13 0.00 0.70 0.00 0.00 55.95 55.79 1xhm s SER 161 Cb -0.11 0.14 0.54 0.00 -1.71 0.00 0.00 66.02 64.87 1xhm s SER 161 CO 0.09 -0.59 1.40 0.61 1.20 0.00 0.00 173.24 175.96 1xhm n GLY 162 N -0.22 -0.93 0.00 9.45 0.00 0.15 -1.59 105.19 112.05 1xhm n GLY 162 Ca -0.07 -0.04 0.06 0.00 0.00 0.00 0.00 46.02 45.97 1xhm n GLY 162 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1xhm n ASP 163 N -1.50 0.00 -0.62 1.61 5.68 -1.26 -4.55 116.55 115.92 1xhm n ASP 163 Ca 0.03 -1.60 -0.08 0.00 -0.50 0.00 0.00 54.79 52.64 1xhm n ASP 163 Cb 0.15 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.09 1xhm n ASP 163 CO 0.00 0.00 0.00 0.41 -1.33 0.00 0.00 177.20 176.28 1xhm n THR 164 N -0.68 0.00 -4.22 2.12 -1.04 -0.62 -4.96 114.28 104.87 1xhm n THR 164 Ca 0.08 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.97 1xhm n THR 164 Cb 0.04 -1.07 -0.10 0.00 -1.82 0.00 0.00 70.33 67.38 1xhm n THR 164 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1xhm s THR 165 N -2.29 0.69 0.28 12.58 -4.23 -1.25 -4.37 115.64 117.05 1xhm s THR 165 Ca 0.00 -1.97 0.11 0.00 -1.18 0.00 0.00 61.69 58.64 1xhm s THR 165 Cb 0.00 -2.01 -0.05 0.00 1.34 0.00 0.00 72.50 71.78 1xhm s THR 165 CO 0.00 -0.57 -0.10 0.00 -0.54 0.00 0.00 174.62 173.41 1xhm s ALA 167 N -2.43 -0.74 -0.08 0.00 0.00 -0.22 -0.29 121.76 118.00 1xhm s ALA 167 Ca 0.31 0.21 0.00 0.00 0.00 0.00 0.00 51.96 52.48 1xhm s ALA 167 Cb -0.05 0.16 -0.03 0.00 0.00 0.00 0.00 23.12 23.19 1xhm s ALA 167 CO 0.17 -0.31 -0.05 -1.17 0.00 0.00 0.00 175.76 174.40 1xhm s LEU 168 N -1.57 3.26 0.00 0.00 2.96 -0.17 -0.89 118.68 122.27 1xhm s LEU 168 Ca -0.11 0.01 0.06 0.00 -0.22 0.00 0.00 54.13 53.86 1xhm s LEU 168 Cb -0.04 -1.72 -0.02 0.00 0.50 0.00 0.00 46.19 44.92 1xhm s LEU 168 CO 0.02 0.36 -0.17 0.26 -1.32 0.00 0.00 176.35 175.49 1xhm s TRP 169 N -0.76 1.53 -0.62 5.38 0.52 0.10 -2.02 118.94 123.08 1xhm s TRP 169 Ca 0.12 -0.31 -0.19 0.00 0.02 0.00 0.00 56.10 55.73 1xhm s TRP 169 Cb -0.11 -0.96 0.10 0.00 -1.15 0.00 0.00 33.47 31.35 1xhm s TRP 169 CO 0.02 0.00 0.75 0.34 0.02 0.00 0.00 176.95 178.08 1xhm s ASP 170 N -0.63 6.21 0.28 2.95 -1.08 -0.84 -2.25 116.67 121.32 1xhm s ASP 170 Ca 0.06 -1.44 0.02 0.00 -0.52 0.00 0.00 52.55 50.67 1xhm s ASP 170 Cb -0.07 -2.32 0.67 0.00 -1.46 0.00 0.00 42.92 39.74 1xhm s ASP 170 CO 0.00 -1.14 1.70 0.40 0.52 0.00 0.00 175.17 176.65 1xhm h ILE 171 N 5.90 0.50 0.46 4.11 2.04 -0.88 0.32 117.51 129.96 1xhm h ILE 171 Ca -0.27 -0.14 -0.02 0.00 1.00 0.00 0.00 64.86 65.44 1xhm h ILE 171 Cb 1.08 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.23 1xhm h ILE 171 CO 1.10 0.07 -0.26 -0.33 0.00 0.00 0.00 178.15 178.73 1xhm h GLU 172 N 0.40 -0.66 0.00 2.37 4.39 -1.89 -3.17 114.58 116.02 1xhm h GLU 172 Ca 0.53 0.04 -0.00 0.00 0.34 0.00 0.00 59.36 60.27 1xhm h GLU 172 Cb 0.97 0.15 -0.00 0.00 -0.10 0.00 0.00 28.75 29.77 1xhm h GLU 172 CO -0.51 -0.44 -0.27 1.79 -1.16 0.00 0.00 179.01 178.42 1xhm h THR 173 N -0.68 0.03 0.00 1.13 1.35 -1.88 -3.47 112.91 109.39 1xhm h THR 173 Ca -0.06 -1.05 0.00 0.00 -0.55 0.00 0.00 66.41 64.76 1xhm h THR 173 Cb 0.55 1.89 0.00 0.00 -1.73 0.00 0.00 68.15 68.86 1xhm h THR 173 CO 0.07 0.02 0.00 0.61 -0.25 0.00 0.00 175.52 175.97 1xhm n GLY 174 N 1.13 1.64 3.75 5.82 0.00 0.11 -5.01 105.19 112.61 1xhm n GLY 174 Ca 0.03 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.73 1xhm n GLY 174 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xhm s GLN 175 N -0.14 2.12 -0.73 1.61 -0.21 -1.23 -4.82 119.66 116.26 1xhm s GLN 175 Ca 0.00 1.35 -0.06 0.00 0.02 0.00 0.00 55.36 56.67 1xhm s GLN 175 Cb 0.00 -1.87 0.19 0.00 1.00 0.00 0.00 33.01 32.33 1xhm s GLN 175 CO 0.00 -1.77 0.59 -1.14 -2.12 0.00 0.00 175.29 170.85 1xhm s GLN 176 N -4.58 3.01 0.57 2.91 0.74 -1.26 -1.98 119.66 119.07 1xhm s GLN 176 Ca 0.65 -2.61 0.26 0.00 0.05 0.00 0.00 55.36 53.71 1xhm s GLN 176 Cb -0.20 -3.99 1.56 0.00 1.10 0.00 0.00 33.01 31.48 1xhm s GLN 176 CO 0.52 -1.22 2.12 1.79 -0.55 0.00 0.00 175.29 177.95 1xhm h THR 177 N 4.95 0.64 -2.07 -0.34 1.35 -1.76 -3.44 112.91 112.23 1xhm h THR 177 Ca 0.05 0.00 -0.05 0.00 -0.55 0.00 0.00 66.41 65.85 1xhm h THR 177 Cb 0.96 0.89 -0.20 0.00 -1.73 0.00 0.00 68.15 68.07 1xhm h THR 177 CO 0.74 0.00 0.12 -0.89 -0.25 0.00 0.00 175.52 175.25 1xhm s THR 178 N -4.79 0.00 -0.12 6.82 2.01 -1.23 -4.98 115.64 113.36 1xhm s THR 178 Ca -0.05 -0.01 0.03 0.00 0.31 0.00 0.00 61.69 61.97 1xhm s THR 178 Cb 0.16 -0.97 0.01 0.00 0.01 0.00 0.00 72.50 71.71 1xhm s THR 178 CO 0.60 -0.01 -0.21 -0.89 -0.69 0.00 0.00 174.62 173.42 1xhm s THR 179 N -0.30 1.92 -0.40 -0.82 2.01 -1.26 -1.00 115.64 115.79 1xhm s THR 179 Ca -0.05 -0.91 -0.11 0.00 0.31 0.00 0.00 61.69 60.92 1xhm s THR 179 Cb -0.03 -1.69 0.04 0.00 0.01 0.00 0.00 72.50 70.84 1xhm s THR 179 CO 0.05 0.53 0.25 -0.36 -0.69 0.00 0.00 174.62 174.39 1xhm s PHE 180 N 0.66 3.27 0.28 4.92 0.40 0.61 -4.96 117.98 123.16 1xhm s PHE 180 Ca -0.12 -1.06 0.11 0.00 -0.60 0.00 0.00 56.93 55.25 1xhm s PHE 180 Cb -0.16 -2.66 -0.05 0.00 0.51 0.00 0.00 43.02 40.66 1xhm s PHE 180 CO 0.02 -0.71 -0.09 0.95 0.70 0.00 0.00 175.22 176.09 1xhm s THR 181 N 1.54 2.86 0.00 0.64 -4.23 -1.26 -1.82 115.64 113.37 1xhm s THR 181 Ca 0.03 -2.16 0.00 0.00 -1.18 0.00 0.00 61.69 58.38 1xhm s THR 181 Cb -0.21 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.05 1xhm s THR 181 CO 0.06 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.39 1xhm n GLY 182 N -0.77 3.16 3.73 3.99 0.00 -1.26 -4.83 105.19 109.20 1xhm n GLY 182 Ca -0.05 -0.43 -0.35 0.00 0.00 0.00 0.00 46.02 45.19 1xhm n GLY 182 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xhm s HIS 183 N 0.00 2.08 -0.13 1.61 3.76 -1.26 -4.95 115.29 116.40 1xhm s HIS 183 Ca 0.00 1.57 0.16 0.00 -0.15 0.00 0.00 55.06 56.64 1xhm s HIS 183 Cb 0.00 -3.53 0.28 0.00 1.11 0.00 0.00 32.58 30.44 1xhm s HIS 183 CO 0.00 -2.66 1.15 0.25 -0.85 0.00 0.00 174.74 172.63 1xhm n THR 184 N -2.43 1.74 -3.64 1.30 -2.24 -1.26 -4.94 114.28 102.80 1xhm n THR 184 Ca 0.14 -2.18 -0.13 0.00 -2.27 0.00 0.00 64.05 59.61 1xhm n THR 184 Cb 0.50 -0.15 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 1xhm n THR 184 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1xhm s GLY 185 N -2.75 -0.30 -0.07 3.38 0.00 -1.26 -4.74 107.32 101.57 1xhm s GLY 185 Ca 0.30 0.30 -0.38 0.00 0.00 0.00 0.00 44.72 44.94 1xhm s GLY 185 CO 0.01 0.03 1.50 1.22 0.00 0.00 0.00 173.10 175.86 1xhm n ASP 186 N 0.36 1.87 -4.69 1.64 8.00 -1.26 -4.12 116.55 118.35 1xhm n ASP 186 Ca -0.18 1.10 -0.42 0.00 0.71 0.00 0.00 54.79 56.00 1xhm n ASP 186 Cb 0.61 -1.16 -0.03 0.00 -0.02 0.00 0.00 41.12 40.52 1xhm n ASP 186 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1xhm s VAL 187 N 1.72 4.65 -0.17 2.53 -7.23 -1.14 -0.94 120.40 119.83 1xhm s VAL 187 Ca 0.91 1.92 0.15 0.00 -1.81 0.00 0.00 61.98 63.14 1xhm s VAL 187 Cb -1.02 -4.23 -0.24 0.00 0.56 0.00 0.00 36.38 31.45 1xhm s VAL 187 CO 0.55 0.04 0.19 0.23 -0.31 0.00 0.00 175.10 175.81 1xhm n MET 188 N 4.74 0.68 -4.09 4.82 0.00 0.31 -4.23 117.12 119.33 1xhm n MET 188 Ca 0.09 0.08 -0.10 0.00 0.00 0.00 0.00 57.70 57.77 1xhm n MET 188 Cb 0.49 -1.59 -0.09 0.00 0.00 0.00 0.00 33.22 32.03 1xhm n MET 188 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 1xhm s SER 189 N -5.76 0.23 -0.08 7.83 0.15 -1.15 -4.41 113.70 110.52 1xhm s SER 189 Ca -0.11 -1.11 -0.11 0.00 0.70 0.00 0.00 55.95 55.32 1xhm s SER 189 Cb 0.07 0.34 0.02 0.00 -1.71 0.00 0.00 66.02 64.74 1xhm s SER 189 CO 0.81 -0.78 0.28 -0.76 1.20 0.00 0.00 173.24 173.99 1xhm s LEU 190 N -3.03 0.94 -0.13 3.45 1.43 -1.26 -2.32 118.68 117.75 1xhm s LEU 190 Ca 0.22 0.39 -0.06 0.00 -1.03 0.00 0.00 54.13 53.65 1xhm s LEU 190 Cb 0.06 1.04 0.06 0.00 0.03 0.00 0.00 46.19 47.38 1xhm s LEU 190 CO 0.01 -0.21 0.29 -0.55 0.23 0.00 0.00 176.35 176.12 1xhm s SER 191 N -0.37 -0.01 0.24 2.29 0.15 -0.80 -4.88 113.70 110.33 1xhm s SER 191 Ca -0.05 0.65 -0.27 0.00 0.70 0.00 0.00 55.95 56.99 1xhm s SER 191 Cb -0.03 0.69 -0.09 0.00 -1.71 0.00 0.00 66.02 64.88 1xhm s SER 191 CO 0.01 -0.21 0.88 -0.76 1.20 0.00 0.00 173.24 174.36 1xhm s LEU 192 N 1.96 4.51 0.47 3.45 1.43 -1.26 -1.18 118.68 128.06 1xhm s LEU 192 Ca -0.04 1.78 -0.23 0.00 -1.03 0.00 0.00 54.13 54.62 1xhm s LEU 192 Cb -0.11 -3.64 -0.07 0.00 0.03 0.00 0.00 46.19 42.40 1xhm s LEU 192 CO -0.09 0.09 1.21 0.00 0.23 0.00 0.00 176.35 177.79 1xhm s ALA 193 N -1.33 2.97 0.17 4.21 0.00 -0.01 -4.76 121.76 123.00 1xhm s ALA 193 Ca 0.42 1.03 0.17 0.00 0.00 0.00 0.00 51.96 53.58 1xhm s ALA 193 Cb -0.22 -3.42 0.94 0.00 0.00 0.00 0.00 23.12 20.42 1xhm s ALA 193 CO 0.27 -0.79 1.46 -1.00 0.00 0.00 0.00 175.76 175.70 1xhm h PRO 194 N 2.00 0.00 -0.26 0.00 0.13 -1.89 0.28 132.00 132.25 1xhm h PRO 194 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1xhm h PRO 194 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1xhm h PRO 194 CO 0.60 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.97 1xhm n ASP 195 N -2.27 3.07 0.00 1.44 5.75 -1.26 -4.96 116.55 118.32 1xhm n ASP 195 Ca -0.01 -1.95 0.00 0.00 -0.01 0.00 0.00 54.79 52.82 1xhm n ASP 195 Cb 0.33 -0.16 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 1xhm n ASP 195 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 1xhm n THR 196 N 1.28 0.00 0.47 2.12 5.66 0.97 -4.77 114.28 120.01 1xhm n THR 196 Ca 0.18 0.00 0.12 0.00 -3.05 0.00 0.00 64.05 61.29 1xhm n THR 196 Cb 0.57 -0.58 0.08 0.00 -1.55 0.00 0.00 70.33 68.85 1xhm n THR 196 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1xhm n ARG 197 N -1.31 0.36 -4.22 1.09 1.74 -1.26 -4.88 116.66 108.17 1xhm n ARG 197 Ca 0.00 0.06 -0.13 0.00 -0.77 0.00 0.00 57.85 57.01 1xhm n ARG 197 Cb 0.12 -1.68 -0.10 0.00 -1.02 0.00 0.00 32.46 29.78 1xhm n ARG 197 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1xhm s LEU 198 N -4.34 1.40 -0.23 0.55 1.43 -1.26 -1.74 118.68 114.49 1xhm s LEU 198 Ca 0.04 -1.35 -0.26 0.00 -1.03 0.00 0.00 54.13 51.53 1xhm s LEU 198 Cb 0.13 0.26 0.07 0.00 0.03 0.00 0.00 46.19 46.68 1xhm s LEU 198 CO 0.76 -0.78 0.73 0.72 0.23 0.00 0.00 176.35 178.00 1xhm s PHE 199 N -4.02 -0.76 0.02 0.29 -0.12 -0.93 -0.83 117.98 111.64 1xhm s PHE 199 Ca 0.36 1.76 -0.01 0.00 -0.05 0.00 0.00 56.93 59.00 1xhm s PHE 199 Cb 0.07 0.30 -0.04 0.00 -0.63 0.00 0.00 43.02 42.72 1xhm s PHE 199 CO 0.11 -0.41 0.16 0.08 -0.05 0.00 0.00 175.22 175.10 1xhm s VAL 200 N 0.10 5.16 0.21 -2.49 1.01 -0.33 -0.78 120.40 123.29 1xhm s VAL 200 Ca -0.02 -0.36 0.06 0.00 0.00 0.00 0.00 61.98 61.66 1xhm s VAL 200 Cb -0.04 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.85 1xhm s VAL 200 CO 0.02 0.25 -0.08 -0.94 0.00 0.00 0.00 175.10 174.35 1xhm s SER 201 N -2.13 2.25 -0.01 3.32 1.04 -0.18 -1.90 113.70 116.09 1xhm s SER 201 Ca 0.29 -1.10 0.02 0.00 0.48 0.00 0.00 55.95 55.64 1xhm s SER 201 Cb -0.13 -0.08 -0.00 0.00 0.10 0.00 0.00 66.02 65.91 1xhm s SER 201 CO 0.21 -0.33 -0.08 -0.83 0.98 0.00 0.00 173.24 173.19 1xhm s GLY 202 N -3.31 0.41 0.24 7.32 0.00 -0.98 -2.17 107.32 108.83 1xhm s GLY 202 Ca 0.24 -0.31 0.01 0.00 0.00 0.00 0.00 44.72 44.66 1xhm s GLY 202 CO 0.07 -0.19 0.14 0.00 0.00 0.00 0.00 173.10 173.12 1xhm s ALA 203 N -0.04 1.44 -1.10 3.20 0.00 -1.13 0.11 121.76 124.24 1xhm s ALA 203 Ca 0.01 -1.78 0.14 0.00 0.00 0.00 0.00 51.96 50.33 1xhm s ALA 203 Cb -0.05 1.31 0.63 0.00 0.00 0.00 0.00 23.12 25.02 1xhm s ALA 203 CO -0.00 -0.57 1.44 0.00 0.00 0.00 0.00 175.76 176.63 1xhm n ASP 205 N -1.45 0.00 -0.25 0.00 5.68 -1.26 -4.19 116.55 115.08 1xhm n ASP 205 Ca 0.04 -1.85 -0.03 0.00 -0.50 0.00 0.00 54.79 52.45 1xhm n ASP 205 Cb 0.15 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.12 1xhm n ASP 205 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xhm n ALA 206 N -0.54 -0.05 -2.38 2.12 0.00 -0.97 -4.99 120.51 113.70 1xhm n ALA 206 Ca 0.02 0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.32 1xhm n ALA 206 Cb 0.01 -1.05 -0.10 0.00 0.00 0.00 0.00 19.45 18.30 1xhm n ALA 206 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1xhm s SER 207 N -2.22 2.69 0.10 0.00 1.04 -1.26 -3.62 113.70 110.43 1xhm s SER 207 Ca 0.00 -0.99 0.08 0.00 0.48 0.00 0.00 55.95 55.51 1xhm s SER 207 Cb 0.00 -0.16 -0.04 0.00 0.10 0.00 0.00 66.02 65.92 1xhm s SER 207 CO 0.00 -0.13 -0.13 0.00 0.98 0.00 0.00 173.24 173.96 1xhm s ALA 208 N -2.76 2.84 -0.01 5.32 0.00 -0.82 -2.86 121.76 123.47 1xhm s ALA 208 Ca 0.22 -1.28 0.03 0.00 0.00 0.00 0.00 51.96 50.94 1xhm s ALA 208 Cb -0.02 -0.80 -0.01 0.00 0.00 0.00 0.00 23.12 22.29 1xhm s ALA 208 CO 0.08 0.62 -0.11 0.15 0.00 0.00 0.00 175.76 176.49 1xhm s LYS 209 N -2.12 0.95 -0.13 0.00 1.02 -0.92 -0.07 119.74 118.47 1xhm s LYS 209 Ca 0.20 -0.40 -0.10 0.00 0.02 0.00 0.00 55.97 55.69 1xhm s LYS 209 Cb -0.11 -0.91 -0.05 0.00 -0.52 0.00 0.00 37.83 36.24 1xhm s LYS 209 CO 0.12 0.23 0.19 -1.17 -0.92 0.00 0.00 175.35 173.80 1xhm s LEU 210 N -0.22 4.34 0.06 3.17 2.96 -0.04 -1.01 118.68 127.95 1xhm s LEU 210 Ca 0.03 0.49 0.05 0.00 -0.22 0.00 0.00 54.13 54.48 1xhm s LEU 210 Cb -0.05 -2.18 -0.03 0.00 0.50 0.00 0.00 46.19 44.43 1xhm s LEU 210 CO -0.00 0.31 -0.14 0.26 -1.32 0.00 0.00 176.35 175.45 1xhm s TRP 211 N -0.54 1.22 -0.46 5.38 0.52 0.04 -2.09 118.94 123.02 1xhm s TRP 211 Ca 0.15 -0.41 -0.18 0.00 0.02 0.00 0.00 56.10 55.68 1xhm s TRP 211 Cb -0.13 -0.71 0.04 0.00 -1.15 0.00 0.00 33.47 31.53 1xhm s TRP 211 CO 0.04 0.05 0.53 0.34 0.02 0.00 0.00 176.95 177.93 1xhm s ASP 212 N -1.44 6.23 0.46 2.95 -1.08 -0.80 -2.19 116.67 120.79 1xhm s ASP 212 Ca -0.00 -0.73 0.18 0.00 -0.52 0.00 0.00 52.55 51.47 1xhm s ASP 212 Cb -0.09 -2.26 1.14 0.00 -1.46 0.00 0.00 42.92 40.25 1xhm s ASP 212 CO 0.02 -0.72 1.96 0.58 0.52 0.00 0.00 175.17 177.52 1xhm h VAL 213 N 5.80 0.81 0.47 1.11 2.07 -1.67 0.00 116.25 124.85 1xhm h VAL 213 Ca -0.27 -0.10 -0.02 0.00 0.82 0.00 0.00 66.70 67.13 1xhm h VAL 213 Cb 1.10 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.36 1xhm h VAL 213 CO 0.87 0.05 -0.23 0.03 0.02 0.00 0.00 177.57 178.32 1xhm h ARG 214 N 0.30 -0.61 -0.11 1.57 3.08 -1.92 -3.34 114.38 113.34 1xhm h ARG 214 Ca 0.31 0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.40 1xhm h ARG 214 Cb 0.80 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.99 1xhm h ARG 214 CO -0.07 -0.35 0.00 -0.85 -1.07 0.00 0.00 179.97 177.63 1xhm n GLU 215 N -5.21 1.77 -1.76 0.04 0.28 -1.16 -4.94 120.64 109.66 1xhm n GLU 215 Ca -0.09 -1.14 -0.19 0.00 -0.16 0.00 0.00 57.16 55.59 1xhm n GLU 215 Cb 0.28 -1.44 -0.06 0.00 1.43 0.00 0.00 31.44 31.65 1xhm n GLU 215 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1xhm n GLY 216 N 1.18 1.20 3.90 -1.84 0.00 -0.02 -4.96 105.19 104.65 1xhm n GLY 216 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1xhm n GLY 216 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xhm s MET 217 N -3.94 3.60 -0.92 1.61 1.00 -1.24 -4.76 119.30 114.66 1xhm s MET 217 Ca 0.00 -0.14 -0.16 0.00 0.00 0.00 0.00 55.69 55.39 1xhm s MET 217 Cb 0.00 -2.84 0.18 0.00 0.00 0.00 0.00 34.83 32.17 1xhm s MET 217 CO 0.00 0.44 1.00 0.00 0.00 0.00 0.00 175.02 176.46 1xhm h ARG 219 N 8.14 0.61 -3.87 0.00 2.47 -1.78 -3.45 114.38 116.50 1xhm h ARG 219 Ca 0.15 -0.04 -0.15 0.00 -1.26 0.00 0.00 59.98 58.68 1xhm h ARG 219 Cb 1.01 -0.14 -0.20 0.00 -1.65 0.00 0.00 29.97 29.00 1xhm h ARG 219 CO 0.96 0.40 -0.62 -0.65 0.56 0.00 0.00 179.97 180.63 1xhm s GLN 220 N -6.12 0.43 -0.05 0.04 -0.21 -1.20 -5.01 119.66 107.54 1xhm s GLN 220 Ca -0.13 -0.65 0.05 0.00 0.02 0.00 0.00 55.36 54.65 1xhm s GLN 220 Cb 0.14 0.16 -0.00 0.00 1.00 0.00 0.00 33.01 34.31 1xhm s GLN 220 CO 0.75 -0.09 -0.19 0.99 -2.12 0.00 0.00 175.29 174.63 1xhm s THR 221 N -1.90 1.57 -0.28 -0.19 2.01 -1.26 -0.86 115.64 114.73 1xhm s THR 221 Ca -0.11 -0.79 0.02 0.00 0.31 0.00 0.00 61.69 61.11 1xhm s THR 221 Cb -0.06 -1.35 0.06 0.00 0.01 0.00 0.00 72.50 71.16 1xhm s THR 221 CO -0.02 0.45 -0.06 -0.36 -0.69 0.00 0.00 174.62 173.94 1xhm s PHE 222 N 0.03 3.31 0.70 4.92 0.40 0.90 -4.99 117.98 123.25 1xhm s PHE 222 Ca -0.05 -2.25 -0.05 0.00 -0.60 0.00 0.00 56.93 53.98 1xhm s PHE 222 Cb -0.12 -2.09 0.07 0.00 0.51 0.00 0.00 43.02 41.39 1xhm s PHE 222 CO 0.03 -0.87 0.99 0.99 0.70 0.00 0.00 175.22 177.07 1xhm s THR 223 N 1.13 2.30 0.00 0.64 2.01 -1.26 -1.94 115.64 118.52 1xhm s THR 223 Ca -0.06 -0.35 0.00 0.00 0.31 0.00 0.00 61.69 61.59 1xhm s THR 223 Cb -0.20 -2.95 0.00 0.00 0.01 0.00 0.00 72.50 69.36 1xhm s THR 223 CO -0.04 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.50 1xhm n GLY 224 N -2.87 1.44 3.59 4.40 0.00 -1.26 -4.83 105.19 105.65 1xhm n GLY 224 Ca 0.09 -0.13 -0.35 0.00 0.00 0.00 0.00 46.02 45.63 1xhm n GLY 224 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1xhm n HIS 225 N 0.00 0.33 0.02 1.61 8.25 -1.24 -4.94 115.22 119.24 1xhm n HIS 225 Ca 0.00 0.37 0.09 0.00 -0.26 0.00 0.00 57.72 57.92 1xhm n HIS 225 Cb 0.00 -2.02 0.19 0.00 1.12 0.00 0.00 29.99 29.28 1xhm n HIS 225 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1xhm n GLU 226 N -2.03 2.40 -2.41 -0.41 1.02 -1.26 -4.86 120.64 113.09 1xhm n GLU 226 Ca 0.12 -2.12 -0.02 0.00 -0.02 0.00 0.00 57.16 55.12 1xhm n GLU 226 Cb 0.50 -1.39 0.01 0.00 -0.02 0.00 0.00 31.44 30.54 1xhm n GLU 226 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1xhm n SER 227 N 1.05 -0.75 -4.58 1.62 3.41 -1.26 -4.95 113.62 108.16 1xhm n SER 227 Ca 0.16 -1.41 -0.57 0.00 -0.26 0.00 0.00 58.87 56.79 1xhm n SER 227 Cb 0.50 1.22 -0.07 0.00 -0.26 0.00 0.00 64.21 65.60 1xhm n SER 227 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1xhm n ASP 228 N -0.92 1.02 -4.55 4.04 9.92 -1.26 -4.04 116.55 120.77 1xhm n ASP 228 Ca -0.01 1.14 -0.40 0.00 -0.53 0.00 0.00 54.79 54.99 1xhm n ASP 228 Cb 0.24 -1.05 -0.10 0.00 -0.64 0.00 0.00 41.12 39.57 1xhm n ASP 228 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1xhm s ILE 229 N 0.80 5.27 -0.10 0.53 1.01 -0.92 -0.61 121.20 127.19 1xhm s ILE 229 Ca 0.90 -0.08 0.21 0.00 0.00 0.00 0.00 60.65 61.68 1xhm s ILE 229 Cb -1.14 -3.69 -0.26 0.00 0.01 0.00 0.00 42.46 37.38 1xhm s ILE 229 CO 0.56 0.04 0.53 0.59 0.00 0.00 0.00 174.94 176.65 1xhm n ASN 230 N 5.14 0.20 -4.03 3.58 3.02 0.11 -3.73 115.26 119.54 1xhm n ASN 230 Ca -0.12 0.08 -0.22 0.00 -0.03 0.00 0.00 54.58 54.29 1xhm n ASN 230 Cb 0.50 1.44 -0.16 0.00 -0.61 0.00 0.00 39.78 40.96 1xhm n ASN 230 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xhm s ALA 231 N -3.27 1.02 0.00 5.41 0.00 -0.74 -4.11 121.76 120.07 1xhm s ALA 231 Ca -0.07 -0.41 0.04 0.00 0.00 0.00 0.00 51.96 51.52 1xhm s ALA 231 Cb 0.12 -0.37 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 1xhm s ALA 231 CO 0.87 0.17 -0.13 0.42 0.00 0.00 0.00 175.76 177.09 1xhm s ILE 232 N 0.18 1.03 -0.30 0.00 1.09 -1.26 -0.57 121.20 121.38 1xhm s ILE 232 Ca -0.04 -0.68 -0.12 0.00 -1.10 0.00 0.00 60.65 58.72 1xhm s ILE 232 Cb -0.09 -0.88 0.12 0.00 -1.06 0.00 0.00 42.46 40.54 1xhm s ILE 232 CO 0.01 0.20 0.70 0.00 -0.10 0.00 0.00 174.94 175.74 1xhm s PHE 234 N 2.57 2.32 0.28 0.00 0.08 -1.26 0.51 117.98 122.48 1xhm s PHE 234 Ca -0.07 1.57 -0.19 0.00 0.12 0.00 0.00 56.93 58.37 1xhm s PHE 234 Cb -0.10 -3.36 -0.09 0.00 -0.57 0.00 0.00 43.02 38.90 1xhm s PHE 234 CO -0.19 -2.19 0.76 0.12 -0.10 0.00 0.00 175.22 173.62 1xhm s PHE 235 N -2.03 3.53 0.19 0.36 5.36 0.25 -4.75 117.98 120.89 1xhm s PHE 235 Ca 0.72 1.38 0.10 0.00 -0.96 0.00 0.00 56.93 58.16 1xhm s PHE 235 Cb -0.26 -2.63 0.53 0.00 -0.34 0.00 0.00 43.02 40.32 1xhm s PHE 235 CO 0.41 0.21 1.16 -1.35 -1.46 0.00 0.00 175.22 174.19 1xhm h PRO 236 N 2.89 0.00 -0.31 10.12 0.11 -1.87 -0.34 132.00 142.61 1xhm h PRO 236 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1xhm h PRO 236 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1xhm h PRO 236 CO 0.65 0.00 0.00 0.27 -0.21 0.00 0.00 178.00 178.71 1xhm n ASN 237 N -2.03 2.94 -1.00 -2.05 0.23 -1.26 -4.92 115.26 107.16 1xhm n ASN 237 Ca -0.01 -1.87 -0.13 0.00 -0.53 0.00 0.00 54.58 52.05 1xhm n ASN 237 Cb 0.49 -0.20 -0.06 0.00 -2.08 0.00 0.00 39.78 37.93 1xhm n ASN 237 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1xhm n GLY 238 N 0.94 1.34 0.02 4.83 0.00 -0.14 -4.83 105.19 107.36 1xhm n GLY 238 Ca 0.14 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1xhm n GLY 238 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1xhm n ASN 239 N -0.63 1.54 -3.91 1.61 5.03 -1.26 -4.94 115.26 112.70 1xhm n ASN 239 Ca -0.13 -1.51 -0.08 0.00 0.87 0.00 0.00 54.58 53.73 1xhm n ASN 239 Cb 0.50 -0.01 -0.03 0.00 -1.02 0.00 0.00 39.78 39.22 1xhm n ASN 239 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1xhm s ALA 240 N -0.52 -0.84 0.04 5.41 0.00 -1.26 -1.62 121.76 122.97 1xhm s ALA 240 Ca 0.01 -0.52 -0.27 0.00 0.00 0.00 0.00 51.96 51.18 1xhm s ALA 240 Cb 0.00 0.93 0.09 0.00 0.00 0.00 0.00 23.12 24.15 1xhm s ALA 240 CO 0.01 -0.96 0.79 -0.59 0.00 0.00 0.00 175.76 175.00 1xhm s PHE 241 N -3.96 -0.43 0.34 0.00 -0.12 -0.89 0.87 117.98 113.80 1xhm s PHE 241 Ca 0.15 0.33 0.08 0.00 -0.05 0.00 0.00 56.93 57.44 1xhm s PHE 241 Cb -0.04 0.53 -0.03 0.00 -0.63 0.00 0.00 43.02 42.85 1xhm s PHE 241 CO 0.07 -0.64 0.21 0.00 -0.05 0.00 0.00 175.22 174.82 1xhm s ALA 242 N -3.10 3.66 0.18 1.99 0.00 0.18 -1.37 121.76 123.30 1xhm s ALA 242 Ca 0.02 -1.75 0.01 0.00 0.00 0.00 0.00 51.96 50.24 1xhm s ALA 242 Cb -0.01 -0.94 -0.04 0.00 0.00 0.00 0.00 23.12 22.13 1xhm s ALA 242 CO -0.09 0.02 0.04 0.95 0.00 0.00 0.00 175.76 176.68 1xhm s THR 243 N -2.37 0.46 -0.26 0.00 -4.23 -0.00 -1.76 115.64 107.48 1xhm s THR 243 Ca 0.39 -1.97 -0.02 0.00 -1.18 0.00 0.00 61.69 58.92 1xhm s THR 243 Cb -0.04 -2.21 0.13 0.00 1.34 0.00 0.00 72.50 71.72 1xhm s THR 243 CO 0.24 -0.37 0.32 -0.83 -0.54 0.00 0.00 174.62 173.45 1xhm s GLY 244 N -3.16 -0.25 0.42 3.99 0.00 0.27 -2.86 107.32 105.72 1xhm s GLY 244 Ca 0.27 0.24 0.07 0.00 0.00 0.00 0.00 44.72 45.31 1xhm s GLY 244 CO 0.05 2.60 0.32 -0.45 0.00 0.00 0.00 173.10 175.62 1xhm s SER 245 N 2.43 4.84 0.00 1.64 0.15 -1.13 0.04 113.70 121.67 1xhm s SER 245 Ca 0.10 -0.86 0.19 0.00 0.70 0.00 0.00 55.95 56.08 1xhm s SER 245 Cb -0.15 -0.52 1.14 0.00 -1.71 0.00 0.00 66.02 64.79 1xhm s SER 245 CO -0.23 -0.63 1.64 0.47 1.20 0.00 0.00 173.24 175.69 1xhm n ASP 246 N -1.46 0.00 -0.18 5.45 8.00 0.22 -2.21 116.55 126.37 1xhm n ASP 246 Ca 0.02 -1.13 0.04 0.00 0.71 0.00 0.00 54.79 54.43 1xhm n ASP 246 Cb 0.63 0.00 0.17 0.00 -0.02 0.00 0.00 41.12 41.90 1xhm n ASP 246 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1xhm n ASP 247 N -0.85 0.54 -1.43 -2.24 5.75 -1.26 -4.53 116.55 112.53 1xhm n ASP 247 Ca 0.14 -1.86 -0.15 0.00 -0.01 0.00 0.00 54.79 52.91 1xhm n ASP 247 Cb 0.07 -0.06 -0.04 0.00 -1.03 0.00 0.00 41.12 40.05 1xhm n ASP 247 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1xhm n ALA 248 N -0.27 -0.33 -2.32 2.12 0.00 -1.12 -5.00 120.51 113.60 1xhm n ALA 248 Ca 0.07 0.20 -0.11 0.00 0.00 0.00 0.00 53.44 53.59 1xhm n ALA 248 Cb 0.10 -1.70 -0.10 0.00 0.00 0.00 0.00 19.45 17.75 1xhm n ALA 248 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1xhm s THR 249 N -2.66 0.68 0.14 0.00 -4.23 -1.26 -4.72 115.64 103.59 1xhm s THR 249 Ca 0.00 -1.76 0.09 0.00 -1.18 0.00 0.00 61.69 58.84 1xhm s THR 249 Cb 0.00 -1.46 -0.04 0.00 1.34 0.00 0.00 72.50 72.34 1xhm s THR 249 CO 0.00 -0.76 -0.15 0.00 -0.54 0.00 0.00 174.62 173.16 1xhm s ARG 251 N -2.39 0.11 -0.20 0.00 0.52 -1.14 -0.03 118.95 115.82 1xhm s ARG 251 Ca 0.21 0.17 -0.06 0.00 -0.52 0.00 0.00 55.73 55.52 1xhm s ARG 251 Cb -0.10 0.02 -0.03 0.00 0.52 0.00 0.00 34.95 35.36 1xhm s ARG 251 CO 0.12 -0.04 0.04 -1.17 0.02 0.00 0.00 175.30 174.27 1xhm s LEU 252 N 0.23 3.54 0.07 2.53 0.20 -0.68 -0.82 118.68 123.74 1xhm s LEU 252 Ca -0.01 -0.07 0.07 0.00 0.69 0.00 0.00 54.13 54.80 1xhm s LEU 252 Cb -0.02 -1.90 -0.04 0.00 -0.43 0.00 0.00 46.19 43.79 1xhm s LEU 252 CO -0.01 0.10 -0.14 -0.36 -0.29 0.00 0.00 176.35 175.65 1xhm s PHE 253 N 0.81 2.65 -0.19 5.38 0.08 -0.47 -0.44 117.98 125.80 1xhm s PHE 253 Ca 0.02 -0.20 -0.04 0.00 0.12 0.00 0.00 56.93 56.83 1xhm s PHE 253 Cb -0.14 -1.45 -0.02 0.00 -0.57 0.00 0.00 43.02 40.84 1xhm s PHE 253 CO 0.02 0.35 -0.02 0.34 -0.10 0.00 0.00 175.22 175.81 1xhm s ASP 254 N -1.82 4.70 0.03 1.36 -1.08 -0.59 -2.08 116.67 117.19 1xhm s ASP 254 Ca 0.18 -0.22 -0.15 0.00 -0.52 0.00 0.00 52.55 51.84 1xhm s ASP 254 Cb -0.11 -1.79 -0.07 0.00 -1.46 0.00 0.00 42.92 39.49 1xhm s ASP 254 CO 0.09 0.08 1.23 -0.07 0.52 0.00 0.00 175.17 177.02 1xhm h LEU 255 N 7.37 -0.56 -1.98 -1.34 3.38 -1.62 -2.04 115.31 118.52 1xhm h LEU 255 Ca -0.35 0.04 0.21 0.00 0.09 0.00 0.00 57.88 57.86 1xhm h LEU 255 Cb 1.18 0.18 -0.03 0.00 0.09 0.00 0.00 40.66 42.08 1xhm h LEU 255 CO 0.61 -0.29 0.55 0.03 0.09 0.00 0.00 178.44 179.43 1xhm h ARG 256 N -0.45 0.00 -0.21 1.13 3.08 -1.96 0.33 114.38 116.29 1xhm h ARG 256 Ca -0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1xhm h ARG 256 Cb 0.38 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1xhm h ARG 256 CO -0.00 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.90 1xhm n ALA 257 N -2.61 2.47 -4.29 0.04 0.00 -1.18 -4.97 120.51 109.97 1xhm n ALA 257 Ca 0.14 -0.75 -0.31 0.00 0.00 0.00 0.00 53.44 52.52 1xhm n ALA 257 Cb 0.81 -0.94 -0.09 0.00 0.00 0.00 0.00 19.45 19.23 1xhm n ALA 257 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1xhm n ASP 258 N 1.03 0.70 -3.63 0.00 2.03 0.11 -4.90 116.55 111.89 1xhm n ASP 258 Ca 0.17 -1.25 0.01 0.00 0.52 0.00 0.00 54.79 54.25 1xhm n ASP 258 Cb 0.51 -1.76 -0.00 0.00 -0.72 0.00 0.00 41.12 39.14 1xhm n ASP 258 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1xhm s GLN 259 N -7.29 0.44 0.32 -0.67 -2.07 -1.16 -4.91 119.66 104.33 1xhm s GLN 259 Ca 0.03 -0.25 -0.28 0.00 -1.82 0.00 0.00 55.36 53.04 1xhm s GLN 259 Cb -0.02 0.15 -0.10 0.00 -1.09 0.00 0.00 33.01 31.95 1xhm s GLN 259 CO 0.99 -0.20 1.18 -2.00 -1.32 0.00 0.00 175.29 173.94 1xhm s GLU 260 N -2.43 4.42 -0.00 9.60 2.12 -1.26 -1.55 118.70 129.59 1xhm s GLU 260 Ca 0.15 1.95 0.05 0.00 0.36 0.00 0.00 54.97 57.48 1xhm s GLU 260 Cb 0.04 -3.03 -0.07 0.00 0.26 0.00 0.00 34.13 31.33 1xhm s GLU 260 CO -0.03 -0.04 0.15 1.28 -0.54 0.00 0.00 175.26 176.07 1xhm n LEU 261 N 0.80 0.08 -3.58 2.70 4.77 0.41 -4.90 117.00 117.29 1xhm n LEU 261 Ca 0.00 -0.18 -0.11 0.00 -0.03 0.00 0.00 56.01 55.70 1xhm n LEU 261 Cb 0.44 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.48 1xhm n LEU 261 CO 0.55 0.02 0.75 -0.32 -1.33 0.00 0.00 177.39 177.06 1xhm s MET 262 N -2.03 0.61 -0.16 3.23 0.00 -1.16 -4.31 119.30 115.48 1xhm s MET 262 Ca -0.01 0.22 0.00 0.00 0.00 0.00 0.00 55.69 55.91 1xhm s MET 262 Cb 0.03 0.29 0.00 0.00 0.00 0.00 0.00 34.83 35.15 1xhm s MET 262 CO 0.21 -0.17 -0.16 0.99 0.00 0.00 0.00 175.02 175.88 1xhm s THR 263 N -0.90 2.54 -0.94 10.11 2.01 -1.26 -1.69 115.64 125.50 1xhm s THR 263 Ca -0.02 -0.80 -0.12 0.00 0.31 0.00 0.00 61.69 61.06 1xhm s THR 263 Cb -0.01 -2.07 0.24 0.00 0.01 0.00 0.00 72.50 70.67 1xhm s THR 263 CO 0.01 0.52 0.91 -0.31 -0.69 0.00 0.00 174.62 175.05 1xhm s TYR 264 N 0.97 3.97 0.34 4.92 2.02 0.96 -4.94 117.35 125.59 1xhm s TYR 264 Ca -0.03 -2.30 0.05 0.00 -0.37 0.00 0.00 57.07 54.43 1xhm s TYR 264 Cb -0.15 -3.82 -0.02 0.00 -0.40 0.00 0.00 41.96 37.58 1xhm s TYR 264 CO -0.03 -0.97 0.35 -1.13 -1.57 0.00 0.00 175.55 172.20 1xhm n SER 265 N 3.43 -0.92 -3.63 2.29 3.41 -1.26 -2.73 113.62 114.21 1xhm n SER 265 Ca 0.18 -3.15 -0.11 0.00 -0.26 0.00 0.00 58.87 55.53 1xhm n SER 265 Cb 0.44 1.97 -0.07 0.00 -0.26 0.00 0.00 64.21 66.29 1xhm n SER 265 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1xhm s HIS 266 N -3.22 -0.75 -0.44 7.33 2.46 -1.26 -5.01 115.29 114.39 1xhm s HIS 266 Ca 0.37 1.75 0.14 0.00 0.47 0.00 0.00 55.06 57.79 1xhm s HIS 266 Cb 0.01 0.36 0.75 0.00 -0.13 0.00 0.00 32.58 33.57 1xhm s HIS 266 CO 0.27 -0.37 1.41 -0.25 -2.47 0.00 0.00 174.74 173.33 1xhm n ASP 267 N 2.91 0.36 -0.04 9.88 9.92 -1.26 -0.33 116.55 137.98 1xhm n ASP 267 Ca -0.15 0.65 0.12 0.00 -0.53 0.00 0.00 54.79 54.89 1xhm n ASP 267 Cb 0.56 -0.69 0.26 0.00 -0.64 0.00 0.00 41.12 40.61 1xhm n ASP 267 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 1xhm n ASN 268 N -1.98 0.61 -4.14 -2.24 5.15 -1.26 -4.75 115.26 106.65 1xhm n ASN 268 Ca -0.01 -0.39 -0.33 0.00 -0.60 0.00 0.00 54.58 53.25 1xhm n ASN 268 Cb 0.05 0.25 -0.15 0.00 -0.53 0.00 0.00 39.78 39.40 1xhm n ASN 268 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1xhm s ILE 269 N -2.91 2.49 -0.14 -1.44 1.01 0.55 -4.96 121.20 115.80 1xhm s ILE 269 Ca 0.13 -1.27 0.01 0.00 0.00 0.00 0.00 60.65 59.52 1xhm s ILE 269 Cb 0.18 -2.32 0.01 0.00 0.01 0.00 0.00 42.46 40.34 1xhm s ILE 269 CO 0.67 0.14 0.60 -0.38 0.00 0.00 0.00 174.94 175.98 1xhm n ILE 270 N 4.57 0.13 -2.27 2.92 5.41 -1.26 -4.58 119.36 124.28 1xhm n ILE 270 Ca -0.16 -0.56 -0.32 0.00 1.00 0.00 0.00 62.75 62.71 1xhm n ILE 270 Cb 0.45 0.96 -0.02 0.00 -0.71 0.00 0.00 39.64 40.32 1xhm n ILE 270 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xhm s GLY 272 N -3.23 1.63 -0.17 0.00 0.00 -1.26 -3.94 107.32 100.35 1xhm s GLY 272 Ca 0.59 -0.35 -0.12 0.00 0.00 0.00 0.00 44.72 44.83 1xhm s GLY 272 CO 0.36 -0.01 0.24 -0.42 0.00 0.00 0.00 173.10 173.27 1xhm s ILE 273 N -3.28 5.34 -0.10 0.90 1.09 -0.94 -2.00 121.20 122.21 1xhm s ILE 273 Ca 0.57 0.43 -0.02 0.00 -1.10 0.00 0.00 60.65 60.54 1xhm s ILE 273 Cb -0.11 -3.58 -0.26 0.00 -1.06 0.00 0.00 42.46 37.46 1xhm s ILE 273 CO 0.51 0.41 0.45 0.35 -0.10 0.00 0.00 174.94 176.57 1xhm n THR 274 N 3.49 1.75 -3.46 2.92 -2.24 0.29 -4.55 114.28 112.47 1xhm n THR 274 Ca -0.13 -0.69 -0.13 0.00 -2.27 0.00 0.00 64.05 60.82 1xhm n THR 274 Cb 0.52 -1.56 -0.03 0.00 -2.10 0.00 0.00 70.33 67.16 1xhm n THR 274 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1xhm s SER 275 N -6.81 -0.55 0.02 3.42 1.04 -1.22 -4.49 113.70 105.11 1xhm s SER 275 Ca -0.18 0.19 -0.05 0.00 0.48 0.00 0.00 55.95 56.40 1xhm s SER 275 Cb 0.07 0.54 -0.01 0.00 0.10 0.00 0.00 66.02 66.72 1xhm s SER 275 CO 0.79 -0.80 0.09 0.68 0.98 0.00 0.00 173.24 174.97 1xhm s VAL 276 N -2.91 0.11 -0.02 5.02 -7.23 -1.26 -0.30 120.40 113.80 1xhm s VAL 276 Ca -0.01 -0.88 -0.28 0.00 -1.81 0.00 0.00 61.98 58.99 1xhm s VAL 276 Cb -0.01 -0.57 0.06 0.00 0.56 0.00 0.00 36.38 36.43 1xhm s VAL 276 CO -0.06 -0.49 0.62 -0.94 -0.31 0.00 0.00 175.10 173.92 1xhm s SER 277 N -1.67 -0.58 0.13 4.85 1.04 -0.28 -4.70 113.70 112.49 1xhm s SER 277 Ca -0.12 0.54 0.01 0.00 0.48 0.00 0.00 55.95 56.86 1xhm s SER 277 Cb -0.06 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.54 1xhm s SER 277 CO -0.01 -0.63 0.28 -0.36 0.98 0.00 0.00 173.24 173.50 1xhm s PHE 278 N -1.54 3.50 1.01 5.02 0.08 -1.26 -0.54 117.98 124.25 1xhm s PHE 278 Ca -0.10 0.21 -0.14 0.00 0.12 0.00 0.00 56.93 57.02 1xhm s PHE 278 Cb -0.01 -1.73 0.19 0.00 -0.57 0.00 0.00 43.02 40.90 1xhm s PHE 278 CO 0.06 0.52 1.13 -1.54 -0.10 0.00 0.00 175.22 175.29 1xhm s SER 279 N -2.96 2.59 0.24 1.36 1.04 0.21 -4.74 113.70 111.43 1xhm s SER 279 Ca 0.35 0.92 -0.05 0.00 0.48 0.00 0.00 55.95 57.65 1xhm s SER 279 Cb -0.12 -1.43 0.35 0.00 0.10 0.00 0.00 66.02 64.93 1xhm s SER 279 CO 0.28 -3.12 1.83 0.50 0.98 0.00 0.00 173.24 173.71 1xhm h LYS 280 N -1.89 0.86 -0.01 4.02 3.64 -1.89 -0.22 116.57 121.07 1xhm h LYS 280 Ca -0.51 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.82 1xhm h LYS 280 Cb 1.32 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.95 1xhm h LYS 280 CO 0.53 0.57 -0.03 -1.13 -2.27 0.00 0.00 179.45 177.12 1xhm n SER 281 N -4.68 0.92 0.00 4.20 3.41 -1.26 -4.81 113.62 111.40 1xhm n SER 281 Ca 0.13 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.52 1xhm n SER 281 Cb 0.22 -0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 1xhm n SER 281 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xhm n GLY 282 N 1.15 0.51 0.26 5.00 0.00 -0.10 -4.86 105.19 107.14 1xhm n GLY 282 Ca 0.20 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.13 1xhm n GLY 282 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1xhm h ARG 283 N 1.41 0.75 -5.78 1.61 9.65 -1.90 -3.44 114.38 116.68 1xhm h ARG 283 Ca 0.00 -0.32 -0.67 0.00 -1.10 0.00 0.00 59.98 57.89 1xhm h ARG 283 Cb 0.13 -0.02 -0.09 0.00 -1.39 0.00 0.00 29.97 28.60 1xhm h ARG 283 CO 0.00 0.93 -0.52 -0.51 2.80 0.00 0.00 179.97 182.67 1xhm s LEU 284 N -8.82 4.15 -0.22 3.80 1.43 -1.26 -0.55 118.68 117.20 1xhm s LEU 284 Ca -0.09 0.34 0.01 0.00 -1.03 0.00 0.00 54.13 53.36 1xhm s LEU 284 Cb 0.13 -2.11 0.05 0.00 0.03 0.00 0.00 46.19 44.29 1xhm s LEU 284 CO 0.84 0.37 -0.09 -0.22 0.23 0.00 0.00 176.35 177.48 1xhm s LEU 285 N -1.21 2.62 0.12 1.79 2.96 0.34 -0.62 118.68 124.68 1xhm s LEU 285 Ca 0.17 -1.10 -0.07 0.00 -0.22 0.00 0.00 54.13 52.91 1xhm s LEU 285 Cb -0.12 -1.27 -0.06 0.00 0.50 0.00 0.00 46.19 45.24 1xhm s LEU 285 CO 0.07 -0.19 0.40 -0.76 -1.32 0.00 0.00 176.35 174.55 1xhm s LEU 286 N 1.34 4.29 -0.16 -0.68 1.02 0.30 0.24 118.68 125.04 1xhm s LEU 286 Ca -0.05 0.70 -0.11 0.00 0.02 0.00 0.00 54.13 54.70 1xhm s LEU 286 Cb -0.18 -3.19 0.05 0.00 0.02 0.00 0.00 46.19 42.89 1xhm s LEU 286 CO -0.07 0.10 0.40 0.00 0.02 0.00 0.00 176.35 176.80 1xhm s ALA 287 N -1.55 -1.00 -0.06 4.21 0.00 -0.40 -1.13 121.76 121.82 1xhm s ALA 287 Ca 0.38 1.32 -0.11 0.00 0.00 0.00 0.00 51.96 53.55 1xhm s ALA 287 Cb -0.13 -0.79 -0.05 0.00 0.00 0.00 0.00 23.12 22.15 1xhm s ALA 287 CO 0.21 -0.23 0.29 0.20 0.00 0.00 0.00 175.76 176.23 1xhm s GLY 288 N 0.83 2.33 0.51 0.00 0.00 0.59 -1.03 107.32 110.54 1xhm s GLY 288 Ca -0.05 -0.41 0.03 0.00 0.00 0.00 0.00 44.72 44.29 1xhm s GLY 288 CO -0.06 -0.06 0.12 -0.19 0.00 0.00 0.00 173.10 172.91 1xhm s TYR 289 N -0.96 1.89 0.18 1.90 1.51 -1.19 0.11 117.35 120.78 1xhm s TYR 289 Ca 0.20 -0.88 0.35 0.00 -1.01 0.00 0.00 57.07 55.72 1xhm s TYR 289 Cb -0.14 -1.72 1.54 0.00 -0.11 0.00 0.00 41.96 41.52 1xhm s TYR 289 CO 0.09 0.06 2.04 -0.44 -1.11 0.00 0.00 175.55 176.19 1xhm h ASP 290 N 1.23 0.00 -2.15 2.29 3.32 -1.69 -3.24 116.42 116.17 1xhm h ASP 290 Ca -0.42 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.51 1xhm h ASP 290 Cb 1.30 0.00 0.06 0.00 0.22 0.00 0.00 39.33 40.91 1xhm h ASP 290 CO 0.70 0.00 0.05 -0.67 -1.72 0.00 0.00 179.24 177.60 1xhm n ASP 291 N -3.06 -1.11 -0.15 6.45 2.03 -1.26 -4.26 116.55 115.20 1xhm n ASP 291 Ca 0.00 -0.78 0.14 0.00 0.52 0.00 0.00 54.79 54.67 1xhm n ASP 291 Cb 0.26 -0.31 0.54 0.00 -0.72 0.00 0.00 41.12 40.89 1xhm n ASP 291 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 1xhm n PHE 292 N -3.12 0.00 -4.34 -0.67 3.72 -1.26 -3.66 117.46 108.13 1xhm n PHE 292 Ca 0.05 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.20 1xhm n PHE 292 Cb 0.18 -0.17 -0.09 0.00 -0.94 0.00 0.00 39.48 38.46 1xhm n PHE 292 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 1xhm s ASN 293 N -2.50 4.17 0.07 4.37 0.01 -1.26 -4.22 114.94 115.57 1xhm s ASN 293 Ca 0.27 -1.08 0.09 0.00 -0.71 0.00 0.00 52.86 51.43 1xhm s ASN 293 Cb 0.20 -0.49 -0.03 0.00 0.41 0.00 0.00 41.25 41.34 1xhm s ASN 293 CO 0.49 -0.34 -0.25 0.00 -1.51 0.00 0.00 177.10 175.49 1xhm s ASN 295 N -1.45 5.31 -0.31 0.00 0.01 -0.20 -1.73 114.94 116.57 1xhm s ASN 295 Ca 0.11 0.01 -0.04 0.00 -0.71 0.00 0.00 52.86 52.22 1xhm s ASN 295 Cb -0.10 -1.41 0.04 0.00 0.41 0.00 0.00 41.25 40.19 1xhm s ASN 295 CO 0.03 0.25 0.04 -0.69 -1.51 0.00 0.00 177.10 175.22 1xhm s VAL 296 N -1.19 3.43 0.14 1.60 1.01 0.90 -1.28 120.40 125.01 1xhm s VAL 296 Ca 0.23 -1.12 0.04 0.00 0.00 0.00 0.00 61.98 61.12 1xhm s VAL 296 Cb -0.12 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.33 1xhm s VAL 296 CO 0.14 -0.06 0.17 0.26 0.00 0.00 0.00 175.10 175.61 1xhm s TRP 297 N 1.36 3.26 -0.52 5.22 0.52 0.14 -0.77 118.94 128.16 1xhm s TRP 297 Ca -0.02 0.04 -0.23 0.00 0.02 0.00 0.00 56.10 55.92 1xhm s TRP 297 Cb -0.19 -1.58 0.04 0.00 -1.15 0.00 0.00 33.47 30.59 1xhm s TRP 297 CO 0.00 0.52 0.82 0.34 0.02 0.00 0.00 176.95 178.66 1xhm s ASP 298 N -3.02 6.32 0.30 2.95 -1.08 0.66 -0.50 116.67 122.30 1xhm s ASP 298 Ca 0.32 -0.45 0.04 0.00 -0.52 0.00 0.00 52.55 51.94 1xhm s ASP 298 Cb -0.11 -2.39 0.66 0.00 -1.46 0.00 0.00 42.92 39.63 1xhm s ASP 298 CO 0.25 -1.07 1.83 0.00 0.52 0.00 0.00 175.17 176.70 1xhm h ALA 299 N 9.15 1.63 0.10 3.66 0.00 -1.10 0.14 119.26 132.85 1xhm h ALA 299 Ca -0.26 0.04 -0.35 0.00 0.00 0.00 0.00 54.91 54.33 1xhm h ALA 299 Cb 1.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.69 1xhm h ALA 299 CO 1.03 0.09 -1.94 1.28 0.00 0.00 0.00 179.25 179.70 1xhm n LEU 300 N -4.64 2.31 -0.00 0.00 4.77 -1.26 -4.19 117.00 113.98 1xhm n LEU 300 Ca 0.20 0.25 0.13 0.00 -0.03 0.00 0.00 56.01 56.56 1xhm n LEU 300 Cb 0.44 -0.88 0.35 0.00 -2.33 0.00 0.00 43.42 41.00 1xhm n LEU 300 CO 0.26 0.77 0.59 0.29 -1.33 0.00 0.00 177.39 177.97 1xhm n LYS 301 N -3.40 0.02 -2.37 3.23 5.02 -1.20 -4.53 118.16 114.92 1xhm n LYS 301 Ca -0.29 -0.01 -0.21 0.00 -2.02 0.00 0.00 58.31 55.78 1xhm n LYS 301 Cb 1.05 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.55 1xhm n LYS 301 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1xhm n ALA 302 N -1.48 -0.61 -2.50 7.82 0.00 0.50 -4.99 120.51 119.24 1xhm n ALA 302 Ca 0.06 0.18 -0.33 0.00 0.00 0.00 0.00 53.44 53.35 1xhm n ALA 302 Cb 0.34 -2.18 -0.13 0.00 0.00 0.00 0.00 19.45 17.48 1xhm n ALA 302 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1xhm s ASP 303 N -2.08 4.17 -0.24 0.00 1.01 -1.23 -4.85 116.67 113.46 1xhm s ASP 303 Ca 0.00 -0.17 -0.29 0.00 0.71 0.00 0.00 52.55 52.80 1xhm s ASP 303 Cb 0.00 -0.91 -0.02 0.00 1.01 0.00 0.00 42.92 43.01 1xhm s ASP 303 CO 0.00 0.34 1.46 -0.60 0.21 0.00 0.00 175.17 176.58 1xhm s ARG 304 N -0.82 3.91 0.05 8.23 3.52 -1.26 -0.25 118.95 132.33 1xhm s ARG 304 Ca 0.12 1.52 0.22 0.00 -0.13 0.00 0.00 55.73 57.47 1xhm s ARG 304 Cb -0.11 -3.94 -0.07 0.00 -1.56 0.00 0.00 34.95 29.27 1xhm s ARG 304 CO 0.01 -1.14 0.89 0.00 -0.81 0.00 0.00 175.30 174.25 1xhm n ALA 305 N 7.87 3.19 -3.85 6.12 0.00 0.05 -4.92 120.51 128.98 1xhm n ALA 305 Ca 0.17 -0.41 -0.02 0.00 0.00 0.00 0.00 53.44 53.17 1xhm n ALA 305 Cb 0.46 -0.93 0.01 0.00 0.00 0.00 0.00 19.45 18.99 1xhm n ALA 305 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1xhm s GLY 306 N -3.95 -0.03 0.03 0.00 0.00 -0.84 -1.21 107.32 101.32 1xhm s GLY 306 Ca 0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 44.72 44.62 1xhm s GLY 306 CO 0.83 2.17 -0.03 0.14 0.00 0.00 0.00 173.10 176.21 1xhm s VAL 307 N -2.38 0.16 -0.37 1.40 1.01 -1.26 -0.07 120.40 118.89 1xhm s VAL 307 Ca 0.20 -1.17 0.02 0.00 0.00 0.00 0.00 61.98 61.03 1xhm s VAL 307 Cb -0.01 -0.63 0.10 0.00 0.00 0.00 0.00 36.38 35.84 1xhm s VAL 307 CO 0.03 -0.64 0.11 -0.76 0.00 0.00 0.00 175.10 173.84 1xhm s LEU 308 N -1.88 4.89 -0.32 3.92 1.43 -0.71 -4.60 118.68 121.41 1xhm s LEU 308 Ca -0.09 -2.17 -0.02 0.00 -1.03 0.00 0.00 54.13 50.82 1xhm s LEU 308 Cb -0.05 -1.69 0.06 0.00 0.03 0.00 0.00 46.19 44.54 1xhm s LEU 308 CO -0.04 -0.42 0.03 0.00 0.23 0.00 0.00 176.35 176.16 1xhm s ALA 309 N 0.90 2.87 0.00 4.21 0.00 -1.26 -2.85 121.76 125.63 1xhm s ALA 309 Ca 0.11 -1.88 0.00 0.00 0.00 0.00 0.00 51.96 50.18 1xhm s ALA 309 Cb -0.20 -2.01 0.00 0.00 0.00 0.00 0.00 23.12 20.90 1xhm s ALA 309 CO -0.07 -1.35 0.00 0.41 0.00 0.00 0.00 175.76 174.75 1xhm n GLY 310 N 4.62 0.25 3.74 0.00 0.00 -1.26 -5.05 105.19 107.49 1xhm n GLY 310 Ca -0.11 -0.14 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 1xhm n GLY 310 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xhm s HIS 311 N -0.98 2.26 -0.73 1.61 3.76 -1.26 -4.94 115.29 115.01 1xhm s HIS 311 Ca 0.00 1.47 0.23 0.00 -0.15 0.00 0.00 55.06 56.61 1xhm s HIS 311 Cb 0.00 -3.64 0.06 0.00 1.11 0.00 0.00 32.58 30.11 1xhm s HIS 311 CO 0.00 -2.64 1.05 -0.25 -0.85 0.00 0.00 174.74 172.05 1xhm n ASP 312 N -1.53 0.65 -3.52 1.40 8.00 -1.26 -4.84 116.55 115.44 1xhm n ASP 312 Ca 0.13 -0.35 -0.21 0.00 0.71 0.00 0.00 54.79 55.07 1xhm n ASP 312 Cb 0.48 0.78 -0.08 0.00 -0.02 0.00 0.00 41.12 42.28 1xhm n ASP 312 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 1xhm s ASN 313 N -3.62 1.99 0.47 -2.24 3.84 -1.26 -4.94 114.94 109.17 1xhm s ASN 313 Ca 0.05 -1.75 -0.21 0.00 0.21 0.00 0.00 52.86 51.16 1xhm s ASN 313 Cb 0.15 0.57 -0.12 0.00 -0.55 0.00 0.00 41.25 41.30 1xhm s ASN 313 CO 0.80 -1.04 0.48 -1.14 -2.79 0.00 0.00 177.10 173.41 1xhm n ARG 314 N -0.71 0.51 -3.52 0.43 0.63 -1.25 -4.46 116.66 108.30 1xhm n ARG 314 Ca 0.04 0.19 -0.39 0.00 -0.92 0.00 0.00 57.85 56.77 1xhm n ARG 314 Cb 0.63 -1.53 -0.10 0.00 0.45 0.00 0.00 32.46 31.91 1xhm n ARG 314 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 1xhm s VAL 315 N -1.60 5.26 -0.14 5.15 1.01 -1.23 -0.70 120.40 128.16 1xhm s VAL 315 Ca 0.64 0.04 0.06 0.00 0.00 0.00 0.00 61.98 62.73 1xhm s VAL 315 Cb -0.54 -3.66 -0.23 0.00 0.00 0.00 0.00 36.38 31.94 1xhm s VAL 315 CO 0.58 0.09 0.27 -1.54 0.00 0.00 0.00 175.10 174.50 1xhm n SER 316 N 5.16 1.25 -3.97 3.32 3.41 0.93 -4.23 113.62 119.49 1xhm n SER 316 Ca -0.12 0.16 -0.09 0.00 -0.26 0.00 0.00 58.87 58.55 1xhm n SER 316 Cb 0.51 -0.12 -0.10 0.00 -0.26 0.00 0.00 64.21 64.24 1xhm n SER 316 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xhm s LEU 318 N -2.00 -0.56 0.22 0.00 2.34 -1.26 0.10 118.68 117.53 1xhm s LEU 318 Ca -0.07 0.49 -0.22 0.00 0.06 0.00 0.00 54.13 54.39 1xhm s LEU 318 Cb -0.03 2.49 0.04 0.00 -0.56 0.00 0.00 46.19 48.14 1xhm s LEU 318 CO -0.04 -0.70 0.65 -0.83 -1.06 0.00 0.00 176.35 174.37 1xhm s GLY 319 N -1.63 -0.31 -0.02 -3.48 0.00 -0.38 -4.77 107.32 96.73 1xhm s GLY 319 Ca -0.08 0.03 0.08 0.00 0.00 0.00 0.00 44.72 44.75 1xhm s GLY 319 CO 0.03 -0.00 -0.25 0.14 0.00 0.00 0.00 173.10 173.03 1xhm s VAL 320 N -3.85 2.19 0.97 1.40 1.01 -1.26 -1.18 120.40 119.68 1xhm s VAL 320 Ca 0.07 -1.08 -0.11 0.00 0.00 0.00 0.00 61.98 60.85 1xhm s VAL 320 Cb -0.03 -1.78 0.17 0.00 0.00 0.00 0.00 36.38 34.74 1xhm s VAL 320 CO -0.02 0.56 1.10 0.42 0.00 0.00 0.00 175.10 177.16 1xhm s THR 321 N -0.64 2.27 0.25 3.92 -4.23 -0.88 -4.86 115.64 111.47 1xhm s THR 321 Ca 0.10 0.09 -0.05 0.00 -1.18 0.00 0.00 61.69 60.65 1xhm s THR 321 Cb -0.10 -2.25 0.23 0.00 1.34 0.00 0.00 72.50 71.72 1xhm s THR 321 CO -0.01 -0.12 1.89 0.44 -0.54 0.00 0.00 174.62 176.29 1xhm h ASP 322 N -1.97 1.08 0.30 3.99 5.19 -1.84 -0.13 116.42 123.04 1xhm h ASP 322 Ca -0.50 -0.07 0.00 0.00 -0.62 0.00 0.00 57.03 55.84 1xhm h ASP 322 Cb 1.29 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 40.52 1xhm h ASP 322 CO 0.47 0.84 -0.00 -0.90 -3.12 0.00 0.00 179.24 176.53 1xhm n ASP 323 N -4.35 0.03 0.00 6.45 5.68 -1.26 -4.87 116.55 118.22 1xhm n ASP 323 Ca 0.10 -0.55 0.00 0.00 -0.50 0.00 0.00 54.79 53.83 1xhm n ASP 323 Cb 0.07 -0.15 0.00 0.00 -1.14 0.00 0.00 41.12 39.91 1xhm n ASP 323 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xhm n GLY 324 N 1.16 0.40 0.36 6.12 0.00 -0.06 -4.87 105.19 108.29 1xhm n GLY 324 Ca 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.20 1xhm n GLY 324 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1xhm h MET 325 N 1.14 1.10 -4.83 1.61 2.86 -1.90 -3.45 114.93 111.47 1xhm h MET 325 Ca 0.00 -0.07 -0.35 0.00 -2.06 0.00 0.00 59.70 57.21 1xhm h MET 325 Cb 0.16 -0.24 -0.14 0.00 0.06 0.00 0.00 31.60 31.43 1xhm h MET 325 CO 0.00 0.74 -0.59 0.00 1.06 0.00 0.00 176.91 178.12 1xhm s ALA 326 N -5.91 1.71 0.01 6.32 0.00 -1.26 -4.77 121.76 117.86 1xhm s ALA 326 Ca -0.12 -1.80 0.04 0.00 0.00 0.00 0.00 51.96 50.08 1xhm s ALA 326 Cb 0.18 1.17 -0.01 0.00 0.00 0.00 0.00 23.12 24.45 1xhm s ALA 326 CO 0.80 -0.51 -0.11 0.08 0.00 0.00 0.00 175.76 176.01 1xhm s VAL 327 N -3.77 0.88 0.05 0.00 1.01 -0.45 -2.06 120.40 116.04 1xhm s VAL 327 Ca 0.37 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.78 1xhm s VAL 327 Cb 0.06 -0.76 -0.02 0.00 0.00 0.00 0.00 36.38 35.66 1xhm s VAL 327 CO 0.15 0.14 -0.16 0.00 0.00 0.00 0.00 175.10 175.23 1xhm s ALA 328 N -0.47 1.34 -0.02 5.51 0.00 -0.33 0.95 121.76 128.75 1xhm s ALA 328 Ca 0.02 -0.91 0.01 0.00 0.00 0.00 0.00 51.96 51.08 1xhm s ALA 328 Cb -0.05 -0.22 0.01 0.00 0.00 0.00 0.00 23.12 22.86 1xhm s ALA 328 CO 0.00 0.27 -0.03 0.95 0.00 0.00 0.00 175.76 176.95 1xhm s THR 329 N -0.88 0.29 -0.18 0.00 -4.23 -0.77 -1.25 115.64 108.61 1xhm s THR 329 Ca 0.03 -0.07 -0.07 0.00 -1.18 0.00 0.00 61.69 60.40 1xhm s THR 329 Cb -0.08 -0.30 -0.04 0.00 1.34 0.00 0.00 72.50 73.41 1xhm s THR 329 CO 0.02 0.13 0.06 -0.83 -0.54 0.00 0.00 174.62 173.45 1xhm s GLY 330 N 0.45 1.89 0.43 3.99 0.00 0.12 -2.07 107.32 112.12 1xhm s GLY 330 Ca -0.05 -0.77 0.06 0.00 0.00 0.00 0.00 44.72 43.96 1xhm s GLY 330 CO -0.01 0.08 0.11 -0.45 0.00 0.00 0.00 173.10 172.83 1xhm s SER 331 N 0.45 4.19 0.00 1.64 0.15 -0.63 -0.05 113.70 119.45 1xhm s SER 331 Ca 0.03 -1.27 0.28 0.00 0.70 0.00 0.00 55.95 55.69 1xhm s SER 331 Cb -0.13 -0.28 1.07 0.00 -1.71 0.00 0.00 66.02 64.98 1xhm s SER 331 CO 0.01 -0.58 1.78 0.79 1.20 0.00 0.00 173.24 176.44 1xhm n TRP 332 N -1.17 0.00 1.67 3.44 7.02 0.12 -1.57 117.44 126.96 1xhm n TRP 332 Ca -0.05 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.44 1xhm n TRP 332 Cb 0.66 -0.30 0.03 0.00 -2.42 0.00 0.00 31.31 29.28 1xhm n TRP 332 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 1xhm n ASP 333 N -1.26 0.48 0.00 -0.99 5.68 -1.26 -4.08 116.55 115.12 1xhm n ASP 333 Ca 0.10 -2.01 0.00 0.00 -0.50 0.00 0.00 54.79 52.38 1xhm n ASP 333 Cb 0.31 -0.10 0.00 0.00 -1.14 0.00 0.00 41.12 40.18 1xhm n ASP 333 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1xhm n SER 334 N -0.27 -2.89 -4.66 -1.12 3.41 -1.18 -4.95 113.62 101.95 1xhm n SER 334 Ca 0.02 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.40 1xhm n SER 334 Cb 0.09 -1.51 -0.07 0.00 -0.26 0.00 0.00 64.21 62.45 1xhm n SER 334 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1xhm s PHE 335 N -1.96 2.68 -0.10 7.33 0.08 -1.26 -4.25 117.98 120.50 1xhm s PHE 335 Ca 0.00 -0.28 0.01 0.00 0.12 0.00 0.00 56.93 56.78 1xhm s PHE 335 Cb 0.00 -1.33 0.02 0.00 -0.57 0.00 0.00 43.02 41.13 1xhm s PHE 335 CO 0.00 0.54 -0.12 -0.51 -0.10 0.00 0.00 175.22 175.03 1xhm s LEU 336 N -3.72 1.55 -0.10 -0.37 1.43 -1.15 -1.61 118.68 114.72 1xhm s LEU 336 Ca 0.33 -0.36 0.01 0.00 -1.03 0.00 0.00 54.13 53.08 1xhm s LEU 336 Cb -0.05 -0.95 -0.02 0.00 0.03 0.00 0.00 46.19 45.20 1xhm s LEU 336 CO 0.20 -0.02 -0.14 -0.54 0.23 0.00 0.00 176.35 176.09 1xhm s LYS 337 N 1.13 3.03 -0.31 1.70 1.02 -0.88 -0.16 119.74 125.27 1xhm s LYS 337 Ca -0.05 -0.69 -0.12 0.00 0.02 0.00 0.00 55.97 55.13 1xhm s LYS 337 Cb -0.14 -2.53 -0.03 0.00 -0.52 0.00 0.00 37.83 34.61 1xhm s LYS 337 CO -0.03 0.38 0.23 0.42 -0.92 0.00 0.00 175.35 175.44 1xhm s ILE 338 N -0.09 5.29 0.30 2.17 -1.09 -0.35 -1.86 121.20 125.58 1xhm s ILE 338 Ca -0.02 -0.02 0.08 0.00 -2.23 0.00 0.00 60.65 58.45 1xhm s ILE 338 Cb -0.14 -3.65 -0.03 0.00 -1.58 0.00 0.00 42.46 37.06 1xhm s ILE 338 CO 0.04 0.09 0.23 0.26 -1.23 0.00 0.00 174.94 174.33 1xhm s TRP 339 N 1.77 2.94 0.00 3.97 0.52 0.27 -0.13 118.94 128.27 1xhm s TRP 339 Ca 0.07 -0.24 0.00 0.00 0.02 0.00 0.00 56.10 55.95 1xhm s TRP 339 Cb -0.17 -1.62 0.00 0.00 -1.15 0.00 0.00 33.47 30.53 1xhm s TRP 339 CO 0.11 0.33 0.00 0.27 0.02 0.00 0.00 176.95 177.68