#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dhu h THR 7 N 0.00 0.00 -0.30 1.69 1.35 -1.93 -2.42 112.91 111.30 3dhu h THR 7 Ca 0.00 -0.28 0.09 0.00 -0.55 0.00 0.00 66.41 65.67 3dhu h THR 7 Cb 0.00 1.06 -0.01 0.00 -1.73 0.00 0.00 68.15 67.46 3dhu h THR 7 CO 0.00 0.00 0.27 1.56 -0.25 0.00 0.00 175.52 177.10 3dhu h GLN 8 N 0.00 0.00 0.00 4.72 4.20 -1.97 -0.73 115.11 121.33 3dhu h GLN 8 Ca 0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 3dhu h GLN 8 Cb 0.38 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 3dhu h GLN 8 CO 0.00 0.00 -0.02 -0.07 -0.67 0.00 0.00 178.83 178.07 3dhu h LEU 9 N 0.00 0.00 0.00 1.46 3.38 -1.84 -1.75 115.31 116.56 3dhu h LEU 9 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 3dhu h LEU 9 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 3dhu h LEU 9 CO -0.00 0.02 0.00 0.54 0.09 0.00 0.00 178.44 179.09 3dhu n ARG 10 N -3.16 0.10 -0.35 1.13 1.74 -0.28 -1.68 116.66 114.15 3dhu n ARG 10 Ca -0.01 0.16 0.11 0.00 -0.77 0.00 0.00 57.85 57.34 3dhu n ARG 10 Cb 0.22 -1.50 0.30 0.00 -1.02 0.00 0.00 32.46 30.46 3dhu n ARG 10 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3dhu n ASN 11 N -1.42 3.82 -4.83 0.55 5.03 -0.66 -4.73 115.26 113.02 3dhu n ASN 11 Ca 0.06 -2.01 -0.30 0.00 0.87 0.00 0.00 54.58 53.21 3dhu n ASN 11 Cb 0.19 -0.45 -0.04 0.00 -1.02 0.00 0.00 39.78 38.45 3dhu n ASN 11 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 3dhu s GLU 12 N -1.01 2.23 -0.06 3.52 2.02 -0.68 -4.14 118.70 120.58 3dhu s GLU 12 Ca 0.45 -2.22 -0.06 0.00 0.02 0.00 0.00 54.97 53.16 3dhu s GLU 12 Cb 0.24 -1.80 0.02 0.00 0.10 0.00 0.00 34.13 32.68 3dhu s GLU 12 CO 0.31 -0.49 0.18 1.41 0.02 0.00 0.00 175.26 176.68 3dhu s MET 13 N -4.08 0.23 -0.09 1.61 -2.45 -1.26 -4.12 119.30 109.15 3dhu s MET 13 Ca 0.19 0.20 -0.02 0.00 -1.25 0.00 0.00 55.69 54.81 3dhu s MET 13 Cb -0.00 0.11 -0.03 0.00 1.25 0.00 0.00 34.83 36.15 3dhu s MET 13 CO 0.12 -0.03 0.01 0.42 1.05 0.00 0.00 175.02 176.58 3dhu s ILE 14 N -0.02 4.37 -0.10 10.11 1.01 -0.20 -1.77 121.20 134.60 3dhu s ILE 14 Ca -0.01 -0.22 0.04 0.00 0.00 0.00 0.00 60.65 60.45 3dhu s ILE 14 Cb -0.02 -2.84 -0.00 0.00 0.01 0.00 0.00 42.46 39.61 3dhu s ILE 14 CO 0.00 0.61 -0.23 -0.47 0.00 0.00 0.00 174.94 174.85 3dhu s TYR 15 N -0.88 2.58 -0.16 3.97 5.04 -0.54 -0.77 117.35 126.59 3dhu s TYR 15 Ca 0.13 -1.03 -0.02 0.00 -2.44 0.00 0.00 57.07 53.71 3dhu s TYR 15 Cb -0.11 -1.72 -0.02 0.00 0.35 0.00 0.00 41.96 40.45 3dhu s TYR 15 CO 0.02 -0.41 -0.08 0.45 -1.34 0.00 0.00 175.55 174.20 3dhu s SER 16 N 0.35 4.37 -0.10 4.32 0.15 -0.34 -1.33 113.70 121.13 3dhu s SER 16 Ca -0.18 -0.26 0.04 0.00 0.70 0.00 0.00 55.95 56.25 3dhu s SER 16 Cb -0.18 -1.70 -0.00 0.00 -1.71 0.00 0.00 66.02 62.43 3dhu s SER 16 CO 0.08 0.13 -0.23 -0.69 1.20 0.00 0.00 173.24 173.73 3dhu s VAL 17 N 0.57 2.14 -0.75 4.45 1.01 -0.17 -0.52 120.40 127.12 3dhu s VAL 17 Ca -0.05 -1.00 -0.10 0.00 0.00 0.00 0.00 61.98 60.83 3dhu s VAL 17 Cb -0.15 -1.81 0.20 0.00 0.00 0.00 0.00 36.38 34.62 3dhu s VAL 17 CO 0.03 0.56 0.65 0.12 0.00 0.00 0.00 175.10 176.46 3dhu s PHE 18 N 0.25 3.63 0.19 5.22 2.19 -1.26 -1.31 117.98 126.90 3dhu s PHE 18 Ca -0.16 -2.23 -0.15 0.00 0.33 0.00 0.00 56.93 54.72 3dhu s PHE 18 Cb -0.17 -3.61 0.17 0.00 -1.31 0.00 0.00 43.02 38.11 3dhu s PHE 18 CO 0.08 -0.94 1.64 0.28 1.83 0.00 0.00 175.22 178.11 3dhu h VAL 19 N 4.97 0.45 -0.97 3.12 2.07 -1.92 -0.45 116.25 123.53 3dhu h VAL 19 Ca 0.06 0.00 0.31 0.00 0.82 0.00 0.00 66.70 67.89 3dhu h VAL 19 Cb 1.01 0.45 -0.17 0.00 -1.52 0.00 0.00 31.29 31.07 3dhu h VAL 19 CO 0.74 0.00 0.32 -0.09 0.02 0.00 0.00 177.57 178.56 3dhu h ARG 20 N -0.01 0.10 -0.00 1.57 2.43 -1.91 -2.74 114.38 113.82 3dhu h ARG 20 Ca 0.25 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.42 3dhu h ARG 20 Cb 0.40 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 3dhu h ARG 20 CO -0.55 0.07 -0.52 0.09 -1.51 0.00 0.00 179.97 177.54 3dhu n ASN 21 N -5.29 0.79 -0.24 -3.80 3.02 -0.32 -4.15 115.26 105.27 3dhu n ASN 21 Ca 0.28 -0.90 -0.05 0.00 -0.03 0.00 0.00 54.58 53.89 3dhu n ASN 21 Cb 0.93 0.88 0.11 0.00 -0.61 0.00 0.00 39.78 41.09 3dhu n ASN 21 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 3dhu h TYR 22 N 0.35 1.11 -3.09 3.10 3.20 -0.84 -1.31 116.97 119.48 3dhu h TYR 22 Ca 0.00 -0.08 -0.43 0.00 3.14 0.00 0.00 58.73 61.36 3dhu h TYR 22 Cb 0.33 -0.33 -0.14 0.00 1.54 0.00 0.00 36.73 38.13 3dhu h TYR 22 CO 0.00 0.85 -0.63 -1.54 -1.64 0.00 0.00 178.16 175.19 3dhu s SER 23 N -6.42 2.09 0.15 -2.11 1.04 -1.26 -4.66 113.70 102.53 3dhu s SER 23 Ca -0.12 -1.30 -0.18 0.00 0.48 0.00 0.00 55.95 54.84 3dhu s SER 23 Cb 0.16 -0.03 0.04 0.00 0.10 0.00 0.00 66.02 66.28 3dhu s SER 23 CO 0.83 -0.55 1.71 -0.33 0.98 0.00 0.00 173.24 175.87 3dhu h GLU 24 N 2.29 0.07 -0.09 4.02 4.39 -1.91 -2.73 114.58 120.63 3dhu h GLU 24 Ca -0.39 -0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.18 3dhu h GLU 24 Cb 1.24 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 29.86 3dhu h GLU 24 CO 0.67 0.05 -0.50 0.00 -1.16 0.00 0.00 179.01 178.07 3dhu h ALA 25 N 1.27 0.99 -2.69 3.43 0.00 -1.96 -3.48 119.26 116.81 3dhu h ALA 25 Ca 0.14 -0.47 -0.27 0.00 0.00 0.00 0.00 54.91 54.31 3dhu h ALA 25 Cb 0.20 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 17.92 3dhu h ALA 25 CO -0.25 0.65 -0.39 0.41 0.00 0.00 0.00 179.25 179.68 3dhu n GLY 26 N 0.02 -0.15 3.74 0.00 0.00 -1.03 -5.02 105.19 102.74 3dhu n GLY 26 Ca -0.02 -0.22 -0.32 0.00 0.00 0.00 0.00 46.02 45.46 3dhu n GLY 26 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dhu s ASN 27 N -2.64 4.00 0.24 1.61 2.20 -1.26 -3.89 114.94 115.20 3dhu s ASN 27 Ca 0.12 -1.65 -0.06 0.00 -0.94 0.00 0.00 52.86 50.33 3dhu s ASN 27 Cb -0.05 0.51 0.31 0.00 -2.00 0.00 0.00 41.25 40.01 3dhu s ASN 27 CO 0.15 -0.85 1.86 -0.26 -2.94 0.00 0.00 177.10 175.06 3dhu h PHE 28 N 1.40 1.01 -0.94 1.54 0.04 -1.61 -2.89 116.94 115.49 3dhu h PHE 28 Ca -0.43 0.03 0.08 0.00 2.80 0.00 0.00 57.97 60.44 3dhu h PHE 28 Cb 1.31 -0.33 -0.06 0.00 2.20 0.00 0.00 35.95 39.07 3dhu h PHE 28 CO 1.51 0.53 0.61 0.00 -0.60 0.00 0.00 178.31 180.36 3dhu h ALA 29 N 1.39 1.51 -0.27 2.45 0.00 -1.87 0.33 119.26 122.80 3dhu h ALA 29 Ca 0.37 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3dhu h ALA 29 Cb 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 3dhu h ALA 29 CO -0.16 0.33 0.18 0.78 0.00 0.00 0.00 179.25 180.38 3dhu h GLY 30 N 1.03 0.37 0.00 0.00 0.00 -1.91 0.42 103.07 102.98 3dhu h GLY 30 Ca 0.41 -0.14 -0.05 0.00 0.00 0.00 0.00 47.33 47.56 3dhu h GLY 30 CO -0.17 0.13 -0.25 -2.08 0.00 0.00 0.00 176.54 174.17 3dhu h VAL 31 N 0.35 1.54 -1.00 4.60 2.07 -0.62 -3.36 116.25 119.84 3dhu h VAL 31 Ca 0.10 -2.26 0.19 0.00 0.82 0.00 0.00 66.70 65.56 3dhu h VAL 31 Cb -0.03 3.01 -0.10 0.00 -1.52 0.00 0.00 31.29 32.65 3dhu h VAL 31 CO -0.02 0.52 0.61 0.74 0.02 0.00 0.00 177.57 179.45 3dhu h THR 32 N -1.00 0.70 0.00 2.57 2.02 -0.33 0.38 112.91 117.24 3dhu h THR 32 Ca -0.07 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.87 3dhu h THR 32 Cb 1.02 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.35 3dhu h THR 32 CO -0.04 0.13 0.00 0.00 0.37 0.00 0.00 175.52 175.98 3dhu h ALA 33 N 1.64 1.00 0.00 6.16 0.00 -1.06 -2.95 119.26 124.05 3dhu h ALA 33 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 3dhu h ALA 33 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 3dhu h ALA 33 CO -0.36 0.00 -0.01 -3.47 0.00 0.00 0.00 179.25 175.41 3dhu n ASP 34 N -2.96 2.15 0.24 0.00 2.03 0.09 -4.72 116.55 113.38 3dhu n ASP 34 Ca -0.01 -2.62 0.09 0.00 0.52 0.00 0.00 54.79 52.77 3dhu n ASP 34 Cb 0.17 -0.25 0.61 0.00 -0.72 0.00 0.00 41.12 40.93 3dhu n ASP 34 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 3dhu h LEU 35 N 0.00 0.00 -0.87 -2.67 3.38 -1.30 -2.63 115.31 111.23 3dhu h LEU 35 Ca 0.00 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.93 3dhu h LEU 35 Cb 0.81 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.53 3dhu h LEU 35 CO 0.00 0.18 0.34 -0.61 0.09 0.00 0.00 178.44 178.43 3dhu h GLN 36 N 0.00 1.16 -0.12 1.13 5.75 -1.85 0.55 115.11 121.74 3dhu h GLN 36 Ca -0.00 -0.19 -0.02 0.00 -0.15 0.00 0.00 58.65 58.29 3dhu h GLN 36 Cb 0.40 -0.20 -0.00 0.00 1.07 0.00 0.00 27.48 28.75 3dhu h GLN 36 CO 0.02 0.93 0.01 -0.09 -2.65 0.00 0.00 178.83 177.05 3dhu h ARG 37 N 1.14 0.21 -0.34 1.69 2.43 -1.85 0.93 114.38 118.59 3dhu h ARG 37 Ca 0.27 -0.06 0.05 0.00 -0.81 0.00 0.00 59.98 59.43 3dhu h ARG 37 Cb 0.18 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.66 3dhu h ARG 37 CO -0.03 0.42 0.06 0.82 -1.51 0.00 0.00 179.97 179.73 3dhu h ILE 38 N -0.04 0.81 -0.17 1.20 2.04 -1.36 0.34 117.51 120.35 3dhu h ILE 38 Ca 0.04 -0.06 0.04 0.00 1.00 0.00 0.00 64.86 65.88 3dhu h ILE 38 Cb 0.32 0.63 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 3dhu h ILE 38 CO 0.00 0.03 -0.08 0.50 0.00 0.00 0.00 178.15 178.60 3dhu h LYS 39 N 0.17 -0.06 0.00 2.37 1.63 -0.82 -2.96 116.57 116.90 3dhu h LYS 39 Ca 0.16 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.94 3dhu h LYS 39 Cb 0.19 0.01 -0.00 0.00 -0.60 0.00 0.00 32.23 31.83 3dhu h LYS 39 CO -0.23 -0.04 -0.15 -0.44 -3.45 0.00 0.00 179.45 175.14 3dhu h ASP 40 N -0.07 0.00 -0.01 4.20 3.32 -0.23 -0.60 116.42 123.04 3dhu h ASP 40 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 3dhu h ASP 40 Cb 0.20 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.75 3dhu h ASP 40 CO -0.21 0.15 0.01 0.25 -1.72 0.00 0.00 179.24 177.72 3dhu h LEU 41 N 0.00 0.00 0.00 1.55 5.85 -0.79 -3.47 115.31 118.46 3dhu h LEU 41 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3dhu h LEU 41 Cb 0.36 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.39 3dhu h LEU 41 CO 0.02 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.73 3dhu n GLY 42 N -1.46 1.45 3.70 3.75 0.00 -0.23 -3.85 105.19 108.55 3dhu n GLY 42 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 3dhu n GLY 42 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dhu s THR 43 N -2.00 2.52 -0.19 2.61 2.01 -1.15 -4.60 115.64 114.85 3dhu s THR 43 Ca 0.00 0.14 -0.02 0.00 0.31 0.00 0.00 61.69 62.12 3dhu s THR 43 Cb 0.00 -3.09 -0.22 0.00 0.01 0.00 0.00 72.50 69.20 3dhu s THR 43 CO 0.00 0.00 0.08 0.47 -0.69 0.00 0.00 174.62 174.48 3dhu n ASP 44 N 5.19 2.04 -3.97 3.53 8.00 -0.73 -4.79 116.55 125.82 3dhu n ASP 44 Ca 0.17 0.04 -0.28 0.00 0.71 0.00 0.00 54.79 55.43 3dhu n ASP 44 Cb 0.38 -0.63 -0.17 0.00 -0.02 0.00 0.00 41.12 40.68 3dhu n ASP 44 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3dhu s ILE 45 N -2.54 1.31 -0.48 0.53 1.01 -1.06 -1.64 121.20 118.32 3dhu s ILE 45 Ca -0.28 -0.47 -0.18 0.00 0.00 0.00 0.00 60.65 59.72 3dhu s ILE 45 Cb 0.08 -1.26 0.05 0.00 0.01 0.00 0.00 42.46 41.33 3dhu s ILE 45 CO 0.69 0.41 0.56 -0.22 0.00 0.00 0.00 174.94 176.38 3dhu s LEU 46 N 1.57 5.02 -0.28 2.97 2.96 0.13 -1.47 118.68 129.58 3dhu s LEU 46 Ca 0.05 -0.90 -0.13 0.00 -0.22 0.00 0.00 54.13 52.93 3dhu s LEU 46 Cb -0.13 -2.42 -0.04 0.00 0.50 0.00 0.00 46.19 44.11 3dhu s LEU 46 CO -0.09 -0.79 0.30 0.86 -1.32 0.00 0.00 176.35 175.31 3dhu s TRP 47 N 2.41 3.23 -0.09 5.38 -0.00 -0.44 -0.09 118.94 129.34 3dhu s TRP 47 Ca 0.13 0.25 -0.13 0.00 -0.00 0.00 0.00 56.10 56.36 3dhu s TRP 47 Cb -0.19 -2.51 -0.05 0.00 -0.00 0.00 0.00 33.47 30.72 3dhu s TRP 47 CO 0.12 -0.22 0.31 -0.51 -0.00 0.00 0.00 176.95 176.64 3dhu s LEU 48 N 1.94 4.37 1.13 5.86 1.43 0.33 -1.00 118.68 132.75 3dhu s LEU 48 Ca 0.12 0.69 -0.13 0.00 -1.03 0.00 0.00 54.13 53.78 3dhu s LEU 48 Cb -0.16 -2.40 0.25 0.00 0.03 0.00 0.00 46.19 43.92 3dhu s LEU 48 CO 0.11 0.26 0.98 0.18 0.23 0.00 0.00 176.35 178.10 3dhu n LEU 49 N 2.52 -0.65 -4.68 1.79 4.77 -0.43 -2.68 117.00 117.65 3dhu n LEU 49 Ca -0.14 -0.05 -0.42 0.00 -0.03 0.00 0.00 56.01 55.37 3dhu n LEU 49 Cb 0.53 -1.28 0.01 0.00 -2.33 0.00 0.00 43.42 40.34 3dhu n LEU 49 CO 0.37 -3.10 0.83 -2.65 -1.33 0.00 0.00 177.39 171.51 3dhu n PRO 50 N -4.67 1.86 -0.07 3.23 -0.02 -1.26 -4.63 135.00 129.44 3dhu n PRO 50 Ca 0.04 0.66 0.05 0.00 -2.02 0.00 0.00 63.50 62.23 3dhu n PRO 50 Cb 0.54 -2.29 0.08 0.00 -0.02 0.00 0.00 33.50 31.81 3dhu n PRO 50 CO 0.00 0.00 0.00 0.44 1.98 0.00 0.00 175.50 177.92 3dhu n ILE 51 N -0.10 1.39 -3.67 4.25 -5.35 -1.26 -4.90 119.36 109.72 3dhu n ILE 51 Ca 0.07 -1.49 -0.20 0.00 -0.27 0.00 0.00 62.75 60.85 3dhu n ILE 51 Cb 0.38 0.20 -0.01 0.00 -1.74 0.00 0.00 39.64 38.47 3dhu n ILE 51 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 3dhu s ASN 52 N -1.70 6.13 0.41 7.28 0.02 -1.26 0.22 114.94 126.03 3dhu s ASN 52 Ca 0.16 -0.04 -0.26 0.00 -1.02 0.00 0.00 52.86 51.70 3dhu s ASN 52 Cb 0.13 -1.54 -0.10 0.00 0.02 0.00 0.00 41.25 39.75 3dhu s ASN 52 CO 0.03 -0.28 1.27 -2.65 0.02 0.00 0.00 177.10 175.50 3dhu n PRO 53 N -1.56 1.96 -4.21 -0.60 -0.02 -1.26 -4.17 135.00 125.14 3dhu n PRO 53 Ca -0.04 0.69 -0.35 0.00 -2.02 0.00 0.00 63.50 61.78 3dhu n PRO 53 Cb 0.58 -2.37 -0.09 0.00 -0.02 0.00 0.00 33.50 31.60 3dhu n PRO 53 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3dhu s ILE 54 N -1.18 4.64 0.33 4.25 1.01 -1.26 -0.13 121.20 128.86 3dhu s ILE 54 Ca 0.60 -0.12 -0.26 0.00 0.00 0.00 0.00 60.65 60.87 3dhu s ILE 54 Cb -0.52 -2.99 -0.14 0.00 0.01 0.00 0.00 42.46 38.83 3dhu s ILE 54 CO 0.59 0.59 0.85 0.61 0.00 0.00 0.00 174.94 177.58 3dhu n GLY 55 N 2.30 -0.69 0.13 6.18 0.00 0.18 -4.69 105.19 108.61 3dhu n GLY 55 Ca -0.19 0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.86 3dhu n GLY 55 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dhu n GLU 56 N 0.64 0.67 -2.25 1.61 1.02 -1.26 -4.57 120.64 116.49 3dhu n GLU 56 Ca 0.11 0.27 -0.41 0.00 -0.02 0.00 0.00 57.16 57.10 3dhu n GLU 56 Cb 0.34 -1.61 -0.03 0.00 -0.02 0.00 0.00 31.44 30.12 3dhu n GLU 56 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3dhu s VAL 57 N -2.51 3.27 -1.44 2.62 1.01 -1.26 -2.93 120.40 119.15 3dhu s VAL 57 Ca -0.31 1.06 0.00 0.00 0.00 0.00 0.00 61.98 62.73 3dhu s VAL 57 Cb 0.09 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.79 3dhu s VAL 57 CO 0.64 0.17 0.00 0.59 0.00 0.00 0.00 175.10 176.49 3dhu n ASN 58 N 2.50 -4.31 -4.67 3.32 3.02 -1.26 -4.54 115.26 109.32 3dhu n ASN 58 Ca 0.05 0.24 -0.42 0.00 -0.03 0.00 0.00 54.58 54.42 3dhu n ASN 58 Cb 0.43 -3.77 -0.00 0.00 -0.61 0.00 0.00 39.78 35.83 3dhu n ASN 58 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 3dhu n ARG 59 N -2.47 1.84 -3.63 3.52 0.63 -1.15 -3.83 116.66 111.57 3dhu n ARG 59 Ca -0.17 0.65 -0.37 0.00 -0.92 0.00 0.00 57.85 57.04 3dhu n ARG 59 Cb 0.57 -2.20 -0.09 0.00 0.45 0.00 0.00 32.46 31.18 3dhu n ARG 59 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 3dhu s LYS 60 N -1.89 4.07 2.77 -0.14 1.02 -1.26 -4.98 119.74 119.33 3dhu s LYS 60 Ca 0.58 -0.23 0.00 0.00 0.02 0.00 0.00 55.97 56.34 3dhu s LYS 60 Cb -0.58 -3.55 0.00 0.00 -0.52 0.00 0.00 37.83 33.18 3dhu s LYS 60 CO 0.60 0.04 0.00 0.41 -0.92 0.00 0.00 175.35 175.48 3dhu n GLY 61 N 4.30 0.06 0.10 -3.33 0.00 -1.26 -2.84 105.19 102.22 3dhu n GLY 61 Ca -0.14 -0.99 -0.19 0.00 0.00 0.00 0.00 46.02 44.70 3dhu n GLY 61 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3dhu h THR 62 N 0.00 1.31 0.00 2.61 1.35 -1.90 -3.37 112.91 112.91 3dhu h THR 62 Ca 0.00 -2.33 0.00 0.00 -0.55 0.00 0.00 66.41 63.53 3dhu h THR 62 Cb 0.00 2.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.27 3dhu h THR 62 CO 0.00 0.55 -1.44 0.18 -0.25 0.00 0.00 175.52 174.57 3dhu n LEU 63 N -4.34 0.44 0.00 3.87 4.77 -0.46 -5.04 117.00 116.24 3dhu n LEU 63 Ca -0.21 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.75 3dhu n LEU 63 Cb 0.68 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.73 3dhu n LEU 63 CO 0.32 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 3dhu n GLY 64 N 1.31 -1.65 3.73 -0.72 0.00 -0.76 -4.90 105.19 102.21 3dhu n GLY 64 Ca -0.01 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.06 3dhu n GLY 64 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dhu s SER 65 N -3.57 7.45 0.34 1.61 0.15 -1.24 -4.38 113.70 114.06 3dhu s SER 65 Ca 0.00 1.73 0.23 0.00 0.70 0.00 0.00 55.95 58.61 3dhu s SER 65 Cb 0.00 -2.56 1.23 0.00 -1.71 0.00 0.00 66.02 62.98 3dhu s SER 65 CO 0.00 -0.03 1.69 -0.65 1.20 0.00 0.00 173.24 175.46 3dhu h PRO 66 N 5.46 0.00 -0.00 5.44 0.11 -1.91 -0.28 132.00 140.82 3dhu h PRO 66 Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3dhu h PRO 66 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3dhu h PRO 66 CO 0.71 0.00 -0.11 0.66 -0.21 0.00 0.00 178.00 179.05 3dhu n TYR 67 N -2.30 0.00 -3.33 0.65 4.01 -1.26 -4.45 117.16 110.48 3dhu n TYR 67 Ca -0.02 0.00 -0.46 0.00 -0.16 0.00 0.00 57.90 57.26 3dhu n TYR 67 Cb 0.04 -0.35 -0.01 0.00 -0.31 0.00 0.00 39.34 38.71 3dhu n TYR 67 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3dhu s ALA 68 N -2.81 4.34 -0.21 -0.72 0.00 -0.12 -4.85 121.76 117.38 3dhu s ALA 68 Ca 0.19 -3.53 -0.17 0.00 0.00 0.00 0.00 51.96 48.45 3dhu s ALA 68 Cb 0.19 -3.54 -0.03 0.00 0.00 0.00 0.00 23.12 19.73 3dhu s ALA 68 CO 0.53 -2.26 0.46 0.42 0.00 0.00 0.00 175.76 174.92 3dhu s ILE 69 N -0.38 5.14 0.02 0.00 1.01 -1.26 -0.64 121.20 125.08 3dhu s ILE 69 Ca 0.23 0.82 0.10 0.00 0.00 0.00 0.00 60.65 61.81 3dhu s ILE 69 Cb -0.10 -3.79 -0.15 0.00 0.01 0.00 0.00 42.46 38.43 3dhu s ILE 69 CO -0.09 0.19 1.18 0.50 0.00 0.00 0.00 174.94 176.73 3dhu h LYS 70 N 7.56 0.00 -1.83 2.79 3.64 -0.80 -2.32 116.57 125.61 3dhu h LYS 70 Ca -0.34 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 58.96 3dhu h LYS 70 Cb 1.16 0.00 -0.27 0.00 -0.41 0.00 0.00 32.23 32.71 3dhu h LYS 70 CO 0.72 0.76 -0.40 0.34 -2.27 0.00 0.00 179.45 178.60 3dhu s ASP 71 N -6.49 -0.25 0.57 4.20 2.15 -1.24 -0.68 116.67 114.93 3dhu s ASP 71 Ca 0.00 0.56 0.35 0.00 0.43 0.00 0.00 52.55 53.90 3dhu s ASP 71 Cb 0.09 1.43 1.70 0.00 -0.30 0.00 0.00 42.92 45.84 3dhu s ASP 71 CO 0.80 -0.28 2.12 1.88 -0.17 0.00 0.00 175.17 179.53 3dhu h TYR 72 N 8.14 0.00 -0.03 -5.34 0.05 -1.92 -2.97 116.97 114.90 3dhu h TYR 72 Ca -0.19 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.59 3dhu h TYR 72 Cb 1.15 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.89 3dhu h TYR 72 CO 0.15 0.04 -0.08 0.54 -1.05 0.00 0.00 178.16 177.76 3dhu n ARG 73 N -3.25 1.99 -3.14 4.88 1.74 -1.26 -4.99 116.66 112.63 3dhu n ARG 73 Ca -0.01 -1.69 -0.19 0.00 -0.77 0.00 0.00 57.85 55.19 3dhu n ARG 73 Cb 0.22 -1.43 0.02 0.00 -1.02 0.00 0.00 32.46 30.25 3dhu n ARG 73 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 3dhu s GLY 74 N -1.96 1.94 -0.12 -0.13 0.00 -1.12 -5.12 107.32 100.80 3dhu s GLY 74 Ca 0.25 -1.81 -0.02 0.00 0.00 0.00 0.00 44.72 43.13 3dhu s GLY 74 CO 0.33 -1.60 -0.04 -0.42 0.00 0.00 0.00 173.10 171.37 3dhu s ILE 75 N -2.47 3.91 -0.07 0.90 -1.09 -1.26 -4.31 121.20 116.80 3dhu s ILE 75 Ca 0.55 -0.37 -0.29 0.00 -2.23 0.00 0.00 60.65 58.30 3dhu s ILE 75 Cb -0.07 -2.67 -0.06 0.00 -1.58 0.00 0.00 42.46 38.07 3dhu s ILE 75 CO 0.33 0.54 1.89 0.21 -1.23 0.00 0.00 174.94 176.69 3dhu s ASN 76 N -0.19 6.30 0.61 3.58 3.84 0.13 -4.25 114.94 124.96 3dhu s ASN 76 Ca 0.03 2.27 0.32 0.00 0.21 0.00 0.00 52.86 55.70 3dhu s ASN 76 Cb -0.13 -2.53 1.89 0.00 -0.55 0.00 0.00 41.25 39.93 3dhu s ASN 76 CO 0.02 -1.23 2.21 -0.65 -2.79 0.00 0.00 177.10 174.67 3dhu h PRO 77 N 11.21 0.00 -0.99 0.43 0.11 -1.90 0.23 132.00 141.09 3dhu h PRO 77 Ca -0.43 0.00 0.24 0.00 0.11 0.00 0.00 66.00 65.92 3dhu h PRO 77 Cb 1.21 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.24 3dhu h PRO 77 CO 0.96 0.00 0.65 0.93 -0.21 0.00 0.00 178.00 180.32 3dhu h GLU 78 N 0.00 0.39 0.00 1.05 5.08 -1.94 -1.10 114.58 118.07 3dhu h GLU 78 Ca 0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dhu h GLU 78 Cb 0.20 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3dhu h GLU 78 CO -0.00 0.26 -0.79 0.66 -1.00 0.00 0.00 179.01 178.14 3dhu n TYR 79 N -4.57 0.09 0.00 4.33 4.01 0.06 -4.33 117.16 116.75 3dhu n TYR 79 Ca 0.23 0.03 0.00 0.00 -0.16 0.00 0.00 57.90 57.99 3dhu n TYR 79 Cb 0.80 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 39.58 3dhu n TYR 79 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dhu n GLY 80 N 1.46 0.32 3.54 2.72 0.00 -0.42 -1.57 105.19 111.23 3dhu n GLY 80 Ca 0.04 -1.56 -0.25 0.00 0.00 0.00 0.00 46.02 44.25 3dhu n GLY 80 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dhu s THR 81 N 0.00 1.06 0.18 2.61 -4.23 -1.26 -4.23 115.64 109.77 3dhu s THR 81 Ca 0.00 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.38 3dhu s THR 81 Cb 0.00 -2.57 0.08 0.00 1.34 0.00 0.00 72.50 71.35 3dhu s THR 81 CO 0.00 0.00 1.80 0.25 -0.54 0.00 0.00 174.62 176.13 3dhu h LEU 82 N 1.85 0.42 -1.17 4.79 6.46 -1.98 -1.35 115.31 124.34 3dhu h LEU 82 Ca -0.40 0.02 0.07 0.00 -0.12 0.00 0.00 57.88 57.45 3dhu h LEU 82 Cb 1.26 -0.06 -0.06 0.00 -0.73 0.00 0.00 40.66 41.07 3dhu h LEU 82 CO 0.67 0.29 0.58 0.00 -0.62 0.00 0.00 178.44 179.36 3dhu h ALA 83 N 1.26 1.54 -0.47 1.25 0.00 -1.98 0.72 119.26 121.57 3dhu h ALA 83 Ca 0.22 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 3dhu h ALA 83 Cb 0.09 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3dhu h ALA 83 CO -0.13 0.33 0.12 -0.44 0.00 0.00 0.00 179.25 179.12 3dhu h ASP 84 N 0.99 0.72 -0.06 0.00 3.32 -1.68 -0.68 116.42 119.02 3dhu h ASP 84 Ca 0.38 -0.23 0.02 0.00 0.02 0.00 0.00 57.03 57.22 3dhu h ASP 84 Cb 0.21 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.55 3dhu h ASP 84 CO -0.14 0.77 -0.05 0.15 -1.72 0.00 0.00 179.24 178.25 3dhu h PHE 85 N 0.64 -0.11 -0.69 4.55 3.57 -0.39 -2.28 116.94 122.23 3dhu h PHE 85 Ca 0.15 0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.72 3dhu h PHE 85 Cb 0.33 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.08 3dhu h PHE 85 CO 0.02 -0.08 0.45 -0.22 -2.23 0.00 0.00 178.31 176.26 3dhu h LYS 86 N -0.05 0.66 -0.55 1.11 3.64 -0.72 -1.01 116.57 119.65 3dhu h LYS 86 Ca 0.04 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 3dhu h LYS 86 Cb 0.12 -0.15 -0.02 0.00 -0.41 0.00 0.00 32.23 31.76 3dhu h LYS 86 CO -0.10 0.44 0.10 0.00 -2.27 0.00 0.00 179.45 177.62 3dhu h ALA 87 N 1.63 1.13 0.23 5.00 0.00 -0.74 -0.30 119.26 126.22 3dhu h ALA 87 Ca 0.30 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3dhu h ALA 87 Cb 0.29 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3dhu h ALA 87 CO -0.10 0.57 -0.11 1.25 0.00 0.00 0.00 179.25 180.87 3dhu h LEU 88 N 0.83 -0.26 -0.73 0.00 6.46 -0.66 -1.91 115.31 119.04 3dhu h LEU 88 Ca 0.17 -0.15 -0.06 0.00 -0.12 0.00 0.00 57.88 57.73 3dhu h LEU 88 Cb 0.36 0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.32 3dhu h LEU 88 CO 0.01 0.01 0.24 0.71 -0.62 0.00 0.00 178.44 178.78 3dhu h THR 89 N -0.53 1.26 -0.65 1.05 1.35 -1.26 0.36 112.91 114.48 3dhu h THR 89 Ca -0.03 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 64.95 3dhu h THR 89 Cb 0.40 0.46 -0.03 0.00 -1.73 0.00 0.00 68.15 67.24 3dhu h THR 89 CO 0.05 0.35 0.41 0.44 -0.25 0.00 0.00 175.52 176.52 3dhu h ASP 90 N 1.07 0.77 -0.21 5.36 3.32 -1.08 0.07 116.42 125.71 3dhu h ASP 90 Ca 0.24 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.20 3dhu h ASP 90 Cb 0.29 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 3dhu h ASP 90 CO -0.01 0.58 -0.04 -0.09 -1.72 0.00 0.00 179.24 177.96 3dhu h ARG 91 N 0.88 0.41 -0.57 3.56 9.65 -0.96 -0.23 114.38 127.13 3dhu h ARG 91 Ca 0.24 -0.15 0.09 0.00 -1.10 0.00 0.00 59.98 59.06 3dhu h ARG 91 Cb -0.06 -0.03 -0.07 0.00 -1.39 0.00 0.00 29.97 28.42 3dhu h ARG 91 CO -0.05 0.64 0.18 0.00 2.80 0.00 0.00 179.97 183.55 3dhu h ALA 92 N 0.75 0.71 -0.69 2.80 0.00 -0.70 -1.42 119.26 120.72 3dhu h ALA 92 Ca 0.06 0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 3dhu h ALA 92 Cb 0.49 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3dhu h ALA 92 CO 0.02 -0.24 0.12 0.45 0.00 0.00 0.00 179.25 179.61 3dhu h HIS 93 N 0.34 1.19 -0.84 0.00 3.86 -0.88 -0.20 115.15 118.62 3dhu h HIS 93 Ca 0.29 -0.16 0.07 0.00 -1.16 0.00 0.00 60.37 59.41 3dhu h HIS 93 Cb 0.37 -0.33 -0.06 0.00 1.06 0.00 0.00 27.41 28.46 3dhu h HIS 93 CO -0.19 0.99 0.55 0.93 0.86 0.00 0.00 177.93 181.07 3dhu h GLU 94 N 1.06 0.87 -0.01 2.45 5.08 -0.33 -1.03 114.58 122.67 3dhu h GLU 94 Ca 0.21 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3dhu h GLU 94 Cb 0.43 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3dhu h GLU 94 CO 0.01 0.58 -0.01 1.28 -1.00 0.00 0.00 179.01 179.86 3dhu n LEU 95 N -4.50 0.73 0.00 1.33 4.77 -0.60 -4.93 117.00 113.81 3dhu n LEU 95 Ca 0.13 -0.22 0.00 0.00 -0.03 0.00 0.00 56.01 55.89 3dhu n LEU 95 Cb 0.24 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3dhu n LEU 95 CO 0.33 0.12 0.00 0.61 -1.33 0.00 0.00 177.39 177.12 3dhu n GLY 96 N 1.11 0.60 3.94 -0.72 0.00 -0.39 -5.04 105.19 104.70 3dhu n GLY 96 Ca 0.21 -0.60 -0.26 0.00 0.00 0.00 0.00 46.02 45.36 3dhu n GLY 96 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3dhu s MET 97 N -1.15 3.41 0.10 1.61 -1.94 -0.17 -4.99 119.30 116.17 3dhu s MET 97 Ca 0.00 -0.61 -0.06 0.00 -1.71 0.00 0.00 55.69 53.31 3dhu s MET 97 Cb 0.00 -2.95 -0.05 0.00 2.01 0.00 0.00 34.83 33.83 3dhu s MET 97 CO 0.00 0.52 0.35 0.15 -0.01 0.00 0.00 175.02 176.03 3dhu s LYS 98 N -3.22 3.64 -0.15 2.03 1.02 -0.65 -3.93 119.74 118.46 3dhu s LYS 98 Ca 0.34 -0.03 -0.06 0.00 0.02 0.00 0.00 55.97 56.24 3dhu s LYS 98 Cb -0.11 -2.94 -0.04 0.00 -0.52 0.00 0.00 37.83 34.22 3dhu s LYS 98 CO 0.28 0.53 0.05 0.08 -0.92 0.00 0.00 175.35 175.37 3dhu s VAL 99 N -1.51 4.67 -0.08 3.17 1.01 -1.26 0.17 120.40 126.57 3dhu s VAL 99 Ca 0.36 -0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.30 3dhu s VAL 99 Cb -0.13 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 33.18 3dhu s VAL 99 CO 0.21 0.51 -0.23 -0.32 0.00 0.00 0.00 175.10 175.27 3dhu s MET 100 N -0.02 2.87 0.16 2.72 1.75 0.87 -0.43 119.30 127.21 3dhu s MET 100 Ca 0.05 -0.87 0.04 0.00 -1.25 0.00 0.00 55.69 53.67 3dhu s MET 100 Cb -0.12 -2.28 -0.04 0.00 2.84 0.00 0.00 34.83 35.23 3dhu s MET 100 CO 0.01 0.28 0.19 -0.51 -0.65 0.00 0.00 175.02 174.34 3dhu s LEU 101 N 0.11 3.98 -0.15 4.11 1.43 -0.76 -0.51 118.68 126.89 3dhu s LEU 101 Ca -0.11 -0.03 -0.22 0.00 -1.03 0.00 0.00 54.13 52.74 3dhu s LEU 101 Cb -0.16 -2.58 -0.03 0.00 0.03 0.00 0.00 46.19 43.45 3dhu s LEU 101 CO 0.06 0.06 0.67 -0.62 0.23 0.00 0.00 176.35 176.75 3dhu s ASP 102 N -3.14 6.81 -0.22 2.29 -1.08 -1.09 -0.37 116.67 119.87 3dhu s ASP 102 Ca 0.32 0.98 -0.06 0.00 -0.52 0.00 0.00 52.55 53.27 3dhu s ASP 102 Cb -0.10 -2.38 -0.03 0.00 -1.46 0.00 0.00 42.92 38.95 3dhu s ASP 102 CO 0.25 -0.23 0.04 -0.63 0.52 0.00 0.00 175.17 175.12 3dhu s ILE 103 N 1.54 4.28 -0.72 4.11 -1.09 0.27 -4.65 121.20 124.95 3dhu s ILE 103 Ca 0.32 -0.20 0.05 0.00 -2.23 0.00 0.00 60.65 58.59 3dhu s ILE 103 Cb -0.16 -2.96 0.17 0.00 -1.58 0.00 0.00 42.46 37.93 3dhu s ILE 103 CO 0.13 0.40 0.51 -0.69 -1.23 0.00 0.00 174.94 174.06 3dhu s VAL 104 N 1.10 2.97 -2.03 2.92 1.01 -1.26 0.29 120.40 125.41 3dhu s VAL 104 Ca 0.03 -4.28 0.17 0.00 0.00 0.00 0.00 61.98 57.91 3dhu s VAL 104 Cb -0.14 -2.95 0.21 0.00 0.00 0.00 0.00 36.38 33.51 3dhu s VAL 104 CO 0.03 -1.01 1.13 -1.22 0.00 0.00 0.00 175.10 174.02 3dhu n TYR 105 N 1.97 0.16 0.17 5.22 4.02 -1.26 -4.17 117.16 123.26 3dhu n TYR 105 Ca 0.20 -0.11 0.03 0.00 -0.01 0.00 0.00 57.90 58.01 3dhu n TYR 105 Cb 0.35 -0.00 0.27 0.00 -0.02 0.00 0.00 39.34 39.93 3dhu n TYR 105 CO 0.00 0.00 0.00 -0.97 -1.01 0.00 0.00 176.86 174.88 3dhu h ASN 106 N 3.38 0.00 -4.75 7.72 -1.24 -1.88 -3.45 115.58 115.35 3dhu h ASN 106 Ca 0.00 0.00 0.11 0.00 0.71 0.00 0.00 56.30 57.12 3dhu h ASN 106 Cb 0.76 0.00 -0.14 0.00 0.73 0.00 0.00 38.32 39.67 3dhu h ASN 106 CO 0.00 0.46 0.47 -1.38 -1.29 0.00 0.00 177.43 175.69 3dhu s HIS 107 N -3.57 -0.33 0.30 0.67 -3.43 -1.26 -1.42 115.29 106.25 3dhu s HIS 107 Ca -0.00 0.17 0.05 0.00 -0.80 0.00 0.00 55.06 54.48 3dhu s HIS 107 Cb 0.11 0.55 -0.06 0.00 -1.43 0.00 0.00 32.58 31.75 3dhu s HIS 107 CO 0.71 -0.60 0.01 0.95 -2.00 0.00 0.00 174.74 173.81 3dhu s THR 108 N -3.19 1.37 0.87 -5.38 -4.23 -0.67 -4.78 115.64 99.63 3dhu s THR 108 Ca 0.06 -2.04 -0.12 0.00 -1.18 0.00 0.00 61.69 58.41 3dhu s THR 108 Cb -0.01 -2.64 0.11 0.00 1.34 0.00 0.00 72.50 71.30 3dhu s THR 108 CO -0.08 -0.14 1.16 -1.54 -0.54 0.00 0.00 174.62 173.49 3dhu n SER 109 N -0.64 0.64 0.30 3.99 3.41 -0.87 0.21 113.62 120.66 3dhu n SER 109 Ca -0.04 0.50 0.19 0.00 -0.26 0.00 0.00 58.87 59.26 3dhu n SER 109 Cb 0.65 -1.49 0.91 0.00 -0.26 0.00 0.00 64.21 64.02 3dhu n SER 109 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 3dhu h PRO 110 N -1.40 0.00 -0.53 4.33 0.11 -1.80 -2.81 132.00 129.89 3dhu h PRO 110 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3dhu h PRO 110 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3dhu h PRO 110 CO 0.43 0.03 0.00 -0.40 -0.21 0.00 0.00 178.00 177.85 3dhu n ASP 111 N -3.20 4.81 -4.75 -2.05 5.75 -1.26 -4.76 116.55 111.09 3dhu n ASP 111 Ca -0.01 -2.69 -0.30 0.00 -0.01 0.00 0.00 54.79 51.77 3dhu n ASP 111 Cb 0.20 -0.59 0.12 0.00 -1.03 0.00 0.00 41.12 39.82 3dhu n ASP 111 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 3dhu s SER 112 N -1.08 3.97 0.14 -1.12 1.04 -1.06 -4.81 113.70 110.78 3dhu s SER 112 Ca 0.49 1.56 -0.23 0.00 0.48 0.00 0.00 55.95 58.25 3dhu s SER 112 Cb 0.35 -2.26 -0.01 0.00 0.10 0.00 0.00 66.02 64.20 3dhu s SER 112 CO 0.18 -2.33 1.64 0.58 0.98 0.00 0.00 173.24 174.29 3dhu h VAL 113 N -1.34 0.47 -0.97 5.02 2.07 -1.24 -1.12 116.25 119.13 3dhu h VAL 113 Ca -0.47 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.12 3dhu h VAL 113 Cb 1.26 0.47 -0.07 0.00 -1.52 0.00 0.00 31.29 31.43 3dhu h VAL 113 CO 0.54 0.00 0.63 -0.07 0.02 0.00 0.00 177.57 178.69 3dhu h LEU 114 N -0.27 0.98 -1.03 2.57 3.38 -1.93 0.67 115.31 119.70 3dhu h LEU 114 Ca 0.10 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 3dhu h LEU 114 Cb 0.42 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 3dhu h LEU 114 CO -0.30 0.62 -0.24 0.00 0.09 0.00 0.00 178.44 178.62 3dhu h ALA 115 N 1.48 1.00 0.07 1.53 0.00 -1.65 0.67 119.26 122.36 3dhu h ALA 115 Ca 0.42 -0.21 -0.33 0.00 0.00 0.00 0.00 54.91 54.78 3dhu h ALA 115 Cb 0.21 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3dhu h ALA 115 CO -0.17 0.30 -1.89 0.25 0.00 0.00 0.00 179.25 177.73 3dhu n THR 116 N -3.37 1.70 -0.06 0.00 -2.24 -0.49 -3.86 114.28 105.96 3dhu n THR 116 Ca 0.00 -0.72 -0.04 0.00 -2.27 0.00 0.00 64.05 61.02 3dhu n THR 116 Cb 0.45 -1.41 -0.15 0.00 -2.10 0.00 0.00 70.33 67.12 3dhu n THR 116 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dhu n GLU 117 N -3.28 0.67 -3.02 -0.78 1.02 0.18 -4.60 120.64 110.84 3dhu n GLU 117 Ca -0.26 0.02 -0.19 0.00 -0.02 0.00 0.00 57.16 56.71 3dhu n GLU 117 Cb 1.05 -1.59 -0.02 0.00 -0.02 0.00 0.00 31.44 30.86 3dhu n GLU 117 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 3dhu n HIS 118 N -2.70 1.30 0.32 -0.32 8.25 0.23 -4.92 115.22 117.38 3dhu n HIS 118 Ca -0.23 -3.66 0.21 0.00 -0.26 0.00 0.00 57.72 53.79 3dhu n HIS 118 Cb 0.99 -0.41 1.13 0.00 1.12 0.00 0.00 29.99 32.83 3dhu n HIS 118 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3dhu h PRO 119 N 2.97 0.00 0.00 -0.41 0.13 -1.66 -0.40 132.00 132.64 3dhu h PRO 119 Ca 0.09 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.15 3dhu h PRO 119 Cb 0.90 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.03 3dhu h PRO 119 CO 0.58 0.00 -0.29 1.05 -0.23 0.00 0.00 178.00 179.11 3dhu h GLU 120 N 0.00 0.00 0.00 0.86 9.09 -1.91 -2.76 114.58 119.86 3dhu h GLU 120 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3dhu h GLU 120 Cb 0.05 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.15 3dhu h GLU 120 CO 0.00 0.29 0.00 0.91 0.05 0.00 0.00 179.01 180.26 3dhu n TRP 121 N -3.54 0.00 -4.13 2.06 8.01 -0.16 -4.82 117.44 114.87 3dhu n TRP 121 Ca -0.00 0.00 -0.27 0.00 -1.31 0.00 0.00 57.50 55.92 3dhu n TRP 121 Cb 0.44 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.68 3dhu n TRP 121 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.69 176.62 3dhu s PHE 122 N -2.00 3.03 0.34 -5.99 0.08 -1.04 0.19 117.98 112.59 3dhu s PHE 122 Ca 0.27 -0.06 -0.28 0.00 0.12 0.00 0.00 56.93 56.98 3dhu s PHE 122 Cb 0.12 -1.46 -0.10 0.00 -0.57 0.00 0.00 43.02 41.01 3dhu s PHE 122 CO 0.21 0.52 1.28 0.71 -0.10 0.00 0.00 175.22 177.84 3dhu s TYR 123 N -1.72 3.05 -0.04 0.36 2.02 -0.98 -4.72 117.35 115.33 3dhu s TYR 123 Ca 0.29 1.45 0.01 0.00 -0.37 0.00 0.00 57.07 58.45 3dhu s TYR 123 Cb -0.10 -3.63 0.02 0.00 -0.40 0.00 0.00 41.96 37.85 3dhu s TYR 123 CO 0.21 -1.76 -0.05 -1.01 -1.57 0.00 0.00 175.55 171.38 3dhu s HIS 124 N -1.18 0.70 0.00 2.71 3.76 -1.26 -3.44 115.29 116.58 3dhu s HIS 124 Ca 0.50 -0.18 0.00 0.00 -0.15 0.00 0.00 55.06 55.24 3dhu s HIS 124 Cb -0.38 -0.60 0.00 0.00 1.11 0.00 0.00 32.58 32.71 3dhu s HIS 124 CO 0.50 -0.15 0.00 -0.40 -0.85 0.00 0.00 174.74 173.85 3dhu n ASP 125 N 3.81 0.00 -0.04 1.40 5.68 -0.56 -4.84 116.55 122.00 3dhu n ASP 125 Ca -0.23 0.00 -0.10 0.00 -0.50 0.00 0.00 54.79 53.95 3dhu n ASP 125 Cb 0.52 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.46 3dhu n ASP 125 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3dhu h ALA 126 N -1.85 0.24 0.00 2.12 0.00 -2.00 -1.52 119.26 116.25 3dhu h ALA 126 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3dhu h ALA 126 Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3dhu h ALA 126 CO 0.00 -0.22 0.00 -0.40 0.00 0.00 0.00 179.25 178.63 3dhu n ASP 127 N -4.90 0.00 -0.12 0.00 3.85 -1.26 -4.83 116.55 109.29 3dhu n ASP 127 Ca -0.04 -0.19 -0.02 0.00 -0.71 0.00 0.00 54.79 53.83 3dhu n ASP 127 Cb 0.08 -0.16 -0.01 0.00 -1.35 0.00 0.00 41.12 39.68 3dhu n ASP 127 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dhu n GLY 128 N 0.07 0.52 3.80 6.12 0.00 -0.57 -5.03 105.19 110.09 3dhu n GLY 128 Ca 0.10 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.32 3dhu n GLY 128 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dhu s GLN 129 N -1.27 3.63 0.79 1.61 -1.52 -1.26 -4.78 119.66 116.86 3dhu s GLN 129 Ca 0.00 1.35 -0.12 0.00 -1.95 0.00 0.00 55.36 54.64 3dhu s GLN 129 Cb 0.00 -2.07 0.07 0.00 -0.22 0.00 0.00 33.01 30.79 3dhu s GLN 129 CO 0.00 -0.57 1.12 -0.51 -0.25 0.00 0.00 175.29 175.08 3dhu s LEU 130 N -3.78 3.08 0.08 2.90 1.43 -1.26 -1.49 118.68 119.64 3dhu s LEU 130 Ca 0.67 2.01 -0.07 0.00 -1.03 0.00 0.00 54.13 55.71 3dhu s LEU 130 Cb -0.17 -4.55 -0.01 0.00 0.03 0.00 0.00 46.19 41.49 3dhu s LEU 130 CO 0.25 -2.27 0.15 0.28 0.23 0.00 0.00 176.35 174.98 3dhu s THR 131 N -2.63 0.16 -0.11 5.49 -1.32 -1.22 -4.77 115.64 111.23 3dhu s THR 131 Ca 0.65 -1.31 -0.00 0.00 -1.21 0.00 0.00 61.69 59.82 3dhu s THR 131 Cb -0.21 -1.39 0.02 0.00 -1.51 0.00 0.00 72.50 69.42 3dhu s THR 131 CO 0.53 -0.71 -0.07 0.54 -2.21 0.00 0.00 174.62 172.70 3dhu s ASN 132 N -2.88 2.11 0.49 8.08 4.22 -1.26 -0.62 114.94 125.09 3dhu s ASN 132 Ca 0.06 -0.28 0.17 0.00 -2.14 0.00 0.00 52.86 50.67 3dhu s ASN 132 Cb 0.05 -0.80 1.21 0.00 1.28 0.00 0.00 41.25 43.00 3dhu s ASN 132 CO -0.10 -0.12 2.07 0.07 -2.04 0.00 0.00 177.10 176.97 3dhu h LYS 133 N 8.16 0.14 -5.13 3.55 -0.00 -1.96 -3.40 116.57 117.93 3dhu h LYS 133 Ca -0.29 -0.01 -0.62 0.00 -0.00 0.00 0.00 60.65 59.73 3dhu h LYS 133 Cb 1.13 -0.03 -0.14 0.00 -0.00 0.00 0.00 32.23 33.19 3dhu h LYS 133 CO 0.39 0.09 -0.41 0.08 -0.00 0.00 0.00 179.45 179.60 3dhu s VAL 134 N -5.16 5.30 0.13 0.07 1.01 -1.26 -5.01 120.40 115.47 3dhu s VAL 134 Ca -0.06 0.33 -0.28 0.00 0.00 0.00 0.00 61.98 61.98 3dhu s VAL 134 Cb 0.18 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.93 3dhu s VAL 134 CO 0.71 0.29 1.60 1.23 0.00 0.00 0.00 175.10 178.93 3dhu h GLY 135 N 7.82 -0.59 0.56 4.51 0.00 -2.04 -2.77 103.07 110.55 3dhu h GLY 135 Ca -0.36 0.43 0.21 0.00 0.00 0.00 0.00 47.33 47.61 3dhu h GLY 135 CO 0.65 -0.24 0.52 -0.55 0.00 0.00 0.00 176.54 176.92 3dhu h ASP 136 N -0.49 0.01 0.00 0.19 5.19 -1.95 -3.28 116.42 116.08 3dhu h ASP 136 Ca 0.07 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.34 3dhu h ASP 136 Cb 0.59 -0.00 -0.05 0.00 0.18 0.00 0.00 39.33 40.05 3dhu h ASP 136 CO -0.31 0.00 -0.26 0.79 -3.12 0.00 0.00 179.24 176.35 3dhu n TRP 137 N -4.32 0.00 0.33 4.55 8.01 -1.05 -4.65 117.44 120.31 3dhu n TRP 137 Ca 0.14 -1.30 0.20 0.00 -1.31 0.00 0.00 57.50 55.24 3dhu n TRP 137 Cb 0.79 -1.29 1.09 0.00 -2.01 0.00 0.00 31.31 29.89 3dhu n TRP 137 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 3dhu h SER 138 N 2.75 0.00 0.24 -0.99 4.64 -1.81 -2.45 113.55 115.94 3dhu h SER 138 Ca 0.14 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 3dhu h SER 138 Cb 1.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 3dhu h SER 138 CO 0.19 0.00 -0.06 -0.90 -0.87 0.00 0.00 176.83 175.19 3dhu n ASP 139 N -3.08 0.47 -4.11 4.97 5.75 -1.25 -4.88 116.55 114.42 3dhu n ASP 139 Ca -0.03 -0.77 -0.08 0.00 -0.01 0.00 0.00 54.79 53.91 3dhu n ASP 139 Cb 0.16 -0.06 -0.10 0.00 -1.03 0.00 0.00 41.12 40.09 3dhu n ASP 139 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 3dhu s VAL 140 N -2.31 0.25 0.00 2.12 -7.23 -0.92 -4.19 120.40 108.12 3dhu s VAL 140 Ca 0.34 -1.84 0.03 0.00 -1.81 0.00 0.00 61.98 58.71 3dhu s VAL 140 Cb 0.21 -1.62 -0.01 0.00 0.56 0.00 0.00 36.38 35.51 3dhu s VAL 140 CO 0.43 -0.90 -0.10 -0.54 -0.31 0.00 0.00 175.10 173.67 3dhu s LYS 141 N -3.93 0.81 0.18 4.82 -0.14 0.13 -4.51 119.74 117.11 3dhu s LYS 141 Ca 0.10 -0.43 -0.30 0.00 -1.36 0.00 0.00 55.97 53.99 3dhu s LYS 141 Cb 0.08 -0.78 -0.08 0.00 -1.68 0.00 0.00 37.83 35.37 3dhu s LYS 141 CO -0.08 0.21 1.11 -0.51 -0.76 0.00 0.00 175.35 175.32 3dhu s ASP 142 N -0.41 7.25 0.32 2.83 1.01 0.21 -1.66 116.67 126.22 3dhu s ASP 142 Ca 0.03 2.10 -0.17 0.00 0.71 0.00 0.00 52.55 55.23 3dhu s ASP 142 Cb -0.05 -2.60 -0.09 0.00 1.01 0.00 0.00 42.92 41.19 3dhu s ASP 142 CO -0.00 -0.23 0.76 -0.76 0.21 0.00 0.00 175.17 175.15 3dhu s LEU 143 N -0.39 4.11 -0.42 1.23 1.43 -0.50 -2.32 118.68 121.81 3dhu s LEU 143 Ca 0.49 1.37 -0.08 0.00 -1.03 0.00 0.00 54.13 54.88 3dhu s LEU 143 Cb -0.30 -4.04 0.09 0.00 0.03 0.00 0.00 46.19 41.97 3dhu s LEU 143 CO 0.35 -0.18 0.26 -0.62 0.23 0.00 0.00 176.35 176.39 3dhu s ASP 144 N -2.13 5.58 0.00 2.29 2.15 0.13 -4.71 116.67 119.97 3dhu s ASP 144 Ca 0.53 -1.62 0.25 0.00 0.43 0.00 0.00 52.55 52.14 3dhu s ASP 144 Cb -0.11 -1.96 1.33 0.00 -0.30 0.00 0.00 42.92 41.87 3dhu s ASP 144 CO 0.18 -0.55 1.83 -1.22 -0.17 0.00 0.00 175.17 175.24 3dhu n TYR 145 N 4.87 0.00 -0.12 -5.34 4.01 -1.26 -1.61 117.16 117.71 3dhu n TYR 145 Ca -0.09 0.00 0.21 0.00 -0.16 0.00 0.00 57.90 57.86 3dhu n TYR 145 Cb 0.42 -0.19 0.62 0.00 -0.31 0.00 0.00 39.34 39.88 3dhu n TYR 145 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 3dhu h GLY 146 N 4.01 0.32 -7.24 2.72 0.00 -1.94 -3.37 103.07 97.57 3dhu h GLY 146 Ca 0.00 -0.08 -0.64 0.00 0.00 0.00 0.00 47.33 46.62 3dhu h GLY 146 CO 0.00 0.02 0.50 0.30 0.00 0.00 0.00 176.54 177.36 3dhu s HIS 147 N -5.17 2.70 0.09 5.60 3.76 -0.63 -4.92 115.29 116.72 3dhu s HIS 147 Ca -0.06 -0.58 0.30 0.00 -0.15 0.00 0.00 55.06 54.57 3dhu s HIS 147 Cb 0.21 -4.26 1.60 0.00 1.11 0.00 0.00 32.58 31.23 3dhu s HIS 147 CO 0.76 -1.61 1.92 1.25 -0.85 0.00 0.00 174.74 176.21 3dhu h HIS 148 N 9.53 0.00 -0.07 1.40 2.76 -1.87 -1.68 115.15 125.23 3dhu h HIS 148 Ca -0.29 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 57.72 3dhu h HIS 148 Cb 1.07 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.02 3dhu h HIS 148 CO 0.95 0.00 -0.66 0.93 -1.30 0.00 0.00 177.93 177.86 3dhu h GLU 149 N 0.00 0.27 -0.76 5.26 3.07 -1.94 -3.00 114.58 117.49 3dhu h GLU 149 Ca 0.00 -0.21 0.17 0.00 -0.50 0.00 0.00 59.36 58.83 3dhu h GLU 149 Cb 0.05 0.04 -0.12 0.00 -0.84 0.00 0.00 28.75 27.88 3dhu h GLU 149 CO 0.00 0.84 0.17 1.25 -1.40 0.00 0.00 179.01 179.86 3dhu h LEU 150 N 0.20 -0.03 -0.70 1.33 5.85 -1.66 -2.82 115.31 117.48 3dhu h LEU 150 Ca -0.01 0.16 0.13 0.00 0.84 0.00 0.00 57.88 58.99 3dhu h LEU 150 Cb 1.19 0.23 -0.13 0.00 0.37 0.00 0.00 40.66 42.32 3dhu h LEU 150 CO 0.10 -0.07 -0.29 -0.50 -0.34 0.00 0.00 178.44 177.34 3dhu h TRP 151 N 0.24 -0.78 -0.08 1.25 4.06 -1.65 -1.64 115.95 117.35 3dhu h TRP 151 Ca 0.44 0.08 -0.09 0.00 2.06 0.00 0.00 58.89 61.37 3dhu h TRP 151 Cb 0.78 0.45 -0.01 0.00 -1.00 0.00 0.00 29.16 29.37 3dhu h TRP 151 CO -0.28 -0.37 -0.37 0.37 -3.56 0.00 0.00 178.44 174.23 3dhu h GLN 152 N -0.09 0.16 0.15 0.49 5.75 -1.64 0.04 115.11 119.97 3dhu h GLN 152 Ca 0.29 -0.07 -0.01 0.00 -0.15 0.00 0.00 58.65 58.72 3dhu h GLN 152 Cb 0.56 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.10 3dhu h GLN 152 CO -0.76 0.51 -0.07 -0.92 -2.65 0.00 0.00 178.83 174.94 3dhu h TYR 153 N 0.14 -0.19 -0.80 3.99 3.20 -1.54 -0.29 116.97 121.48 3dhu h TYR 153 Ca 0.02 -0.00 0.18 0.00 3.14 0.00 0.00 58.73 62.06 3dhu h TYR 153 Cb 0.72 0.06 -0.12 0.00 1.54 0.00 0.00 36.73 38.93 3dhu h TYR 153 CO 0.01 0.10 0.25 1.96 -1.64 0.00 0.00 178.16 178.84 3dhu h GLN 154 N -0.48 0.31 0.12 1.82 1.08 -0.62 -1.44 115.11 115.90 3dhu h GLN 154 Ca -0.02 -0.02 -0.27 0.00 -1.45 0.00 0.00 58.65 56.89 3dhu h GLN 154 Cb 0.37 -0.07 0.01 0.00 -0.05 0.00 0.00 27.48 27.74 3dhu h GLN 154 CO 0.03 0.20 -1.22 0.82 -0.95 0.00 0.00 178.83 177.72 3dhu h ILE 155 N 0.32 1.47 -0.59 2.54 2.04 -0.94 -3.01 117.51 119.35 3dhu h ILE 155 Ca 0.47 -2.95 -0.02 0.00 1.00 0.00 0.00 64.86 63.36 3dhu h ILE 155 Cb 0.84 2.88 -0.03 0.00 -0.74 0.00 0.00 36.82 39.78 3dhu h ILE 155 CO -0.53 0.87 0.28 0.44 0.00 0.00 0.00 178.15 179.21 3dhu h ASP 156 N 0.10 0.74 -0.70 1.72 3.32 -0.76 -1.33 116.42 119.50 3dhu h ASP 156 Ca -0.14 -0.07 0.07 0.00 0.02 0.00 0.00 57.03 56.91 3dhu h ASP 156 Cb 1.93 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 41.23 3dhu h ASP 156 CO 0.20 0.63 0.38 0.74 -1.72 0.00 0.00 179.24 179.48 3dhu h THR 157 N 0.83 0.94 -0.35 0.35 2.02 -1.14 -2.01 112.91 113.54 3dhu h THR 157 Ca 0.20 -0.24 -0.03 0.00 0.77 0.00 0.00 66.41 67.12 3dhu h THR 157 Cb 0.09 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 66.67 3dhu h THR 157 CO -0.03 0.13 0.12 -0.07 0.37 0.00 0.00 175.52 176.03 3dhu h LEU 158 N 0.69 0.51 -1.29 2.58 4.07 -1.28 -1.73 115.31 118.85 3dhu h LEU 158 Ca 0.33 -0.20 -0.04 0.00 0.08 0.00 0.00 57.88 58.05 3dhu h LEU 158 Cb 0.25 -0.13 -0.02 0.00 1.08 0.00 0.00 40.66 41.84 3dhu h LEU 158 CO -0.21 0.57 0.03 -0.07 -1.08 0.00 0.00 178.44 177.68 3dhu h LEU 159 N 0.42 0.47 0.47 1.67 3.38 -1.04 0.27 115.31 120.94 3dhu h LEU 159 Ca 0.11 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3dhu h LEU 159 Cb 0.24 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3dhu h LEU 159 CO -0.00 0.52 -0.23 0.22 0.09 0.00 0.00 178.44 179.03 3dhu h TYR 160 N 0.49 -0.59 0.00 1.13 3.20 -1.05 -3.03 116.97 117.12 3dhu h TYR 160 Ca 0.11 -0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.88 3dhu h TYR 160 Cb 0.27 0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 3dhu h TYR 160 CO 0.01 -0.36 -0.40 -1.49 -1.64 0.00 0.00 178.16 174.28 3dhu h TRP 161 N -0.64 0.00 0.00 -3.82 4.06 -0.88 -2.61 115.95 112.06 3dhu h TRP 161 Ca -0.06 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.89 3dhu h TRP 161 Cb 0.49 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.65 3dhu h TRP 161 CO -0.04 0.40 0.00 0.43 -3.56 0.00 0.00 178.44 175.66 3dhu n SER 162 N -3.97 0.09 0.22 -3.49 7.64 0.89 -0.25 113.62 114.75 3dhu n SER 162 Ca -0.02 0.54 0.06 0.00 1.01 0.00 0.00 58.87 60.47 3dhu n SER 162 Cb 0.44 -0.55 0.49 0.00 -1.01 0.00 0.00 64.21 63.58 3dhu n SER 162 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 3dhu h GLN 163 N 0.00 0.00 0.00 1.43 4.20 -1.47 -3.35 115.11 115.93 3dhu h GLN 163 Ca 0.00 0.00 -0.16 0.00 0.06 0.00 0.00 58.65 58.55 3dhu h GLN 163 Cb 0.04 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 3dhu h GLN 163 CO 0.00 0.25 -1.61 1.19 -0.67 0.00 0.00 178.83 178.00 3dhu n PHE 164 N -3.98 0.00 -4.61 2.96 3.72 0.65 -5.09 117.46 111.11 3dhu n PHE 164 Ca -0.02 0.00 -0.31 0.00 -0.05 0.00 0.00 57.45 57.07 3dhu n PHE 164 Cb 0.33 -0.43 -0.08 0.00 -0.94 0.00 0.00 39.48 38.36 3dhu n PHE 164 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 3dhu s VAL 165 N -2.21 1.49 -0.09 -4.37 -7.23 -0.52 -4.89 120.40 102.58 3dhu s VAL 165 Ca -0.09 -1.94 0.01 0.00 -1.81 0.00 0.00 61.98 58.15 3dhu s VAL 165 Cb 0.03 -2.43 0.00 0.00 0.56 0.00 0.00 36.38 34.55 3dhu s VAL 165 CO 0.31 0.00 0.47 0.47 -0.31 0.00 0.00 175.10 176.04 3dhu n ASP 166 N -1.23 0.95 0.00 4.85 8.00 0.43 -4.62 116.55 124.93 3dhu n ASP 166 Ca -0.13 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.39 3dhu n ASP 166 Cb 0.67 0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.88 3dhu n ASP 166 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dhu n GLY 167 N 0.15 0.07 2.98 0.44 0.00 -1.12 -1.71 105.19 106.01 3dhu n GLY 167 Ca 0.00 -1.02 -0.18 0.00 0.00 0.00 0.00 46.02 44.82 3dhu n GLY 167 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dhu s TYR 168 N -2.00 0.72 -0.27 1.61 2.02 0.73 -1.82 117.35 118.34 3dhu s TYR 168 Ca 0.00 -0.15 -0.11 0.00 -0.37 0.00 0.00 57.07 56.44 3dhu s TYR 168 Cb 0.00 -0.50 -0.05 0.00 -0.40 0.00 0.00 41.96 41.01 3dhu s TYR 168 CO 0.00 -0.05 0.18 0.50 -1.57 0.00 0.00 175.55 174.61 3dhu s ARG 169 N 0.03 3.96 -0.40 -0.62 3.52 0.50 -0.90 118.95 125.04 3dhu s ARG 169 Ca -0.00 -0.32 -0.12 0.00 -0.13 0.00 0.00 55.73 55.16 3dhu s ARG 169 Cb -0.05 -3.61 0.04 0.00 -1.56 0.00 0.00 34.95 29.77 3dhu s ARG 169 CO -0.00 -0.12 0.26 0.00 -0.81 0.00 0.00 175.30 174.63 3dhu s ASP 171 N 1.81 6.34 -0.70 0.00 2.15 0.15 -1.12 116.67 125.28 3dhu s ASP 171 Ca 0.03 3.02 -0.06 0.00 0.43 0.00 0.00 52.55 55.97 3dhu s ASP 171 Cb -0.20 -2.65 0.01 0.00 -0.30 0.00 0.00 42.92 39.77 3dhu s ASP 171 CO 0.07 -0.91 0.11 1.33 -0.17 0.00 0.00 175.17 175.60 3dhu n VAL 172 N 1.26 -0.74 0.05 1.11 0.24 -1.25 -4.45 118.33 114.55 3dhu n VAL 172 Ca 0.04 -0.26 0.13 0.00 -2.04 0.00 0.00 64.34 62.21 3dhu n VAL 172 Cb 0.38 -0.68 0.60 0.00 -1.47 0.00 0.00 33.84 32.67 3dhu n VAL 172 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dhu h ALA 173 N 1.74 2.15 0.00 2.33 0.00 -1.44 -2.20 119.26 121.84 3dhu h ALA 173 Ca -0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 3dhu h ALA 173 Cb 0.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 3dhu h ALA 173 CO 0.32 -0.24 0.00 -2.30 0.00 0.00 0.00 179.25 177.03 3dhu n PRO 174 N -4.46 0.13 0.06 0.00 -0.02 -1.26 -2.08 135.00 127.36 3dhu n PRO 174 Ca 0.05 0.52 0.12 0.00 -2.02 0.00 0.00 63.50 62.18 3dhu n PRO 174 Cb 0.34 -1.84 0.28 0.00 -0.02 0.00 0.00 33.50 32.26 3dhu n PRO 174 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dhu n LEU 175 N -2.10 0.65 -4.64 2.45 4.32 -0.83 -0.49 117.00 116.37 3dhu n LEU 175 Ca 0.00 0.31 -0.35 0.00 -0.02 0.00 0.00 56.01 55.96 3dhu n LEU 175 Cb 0.10 -0.25 -0.10 0.00 -1.62 0.00 0.00 43.42 41.55 3dhu n LEU 175 CO 0.12 -0.06 -0.27 -0.69 -1.22 0.00 0.00 177.39 175.27 3dhu s VAL 176 N -3.12 4.60 0.30 4.08 1.01 -0.89 -4.67 120.40 121.72 3dhu s VAL 176 Ca 0.09 -0.11 -0.29 0.00 0.00 0.00 0.00 61.98 61.67 3dhu s VAL 176 Cb 0.14 -3.04 -0.13 0.00 0.00 0.00 0.00 36.38 33.35 3dhu s VAL 176 CO 0.67 0.50 1.19 -2.65 0.00 0.00 0.00 175.10 174.82 3dhu n PRO 177 N 3.19 1.77 -0.36 2.72 -0.02 -1.26 -4.87 135.00 136.18 3dhu n PRO 177 Ca -0.17 0.62 0.04 0.00 -2.02 0.00 0.00 63.50 61.97 3dhu n PRO 177 Cb 0.53 -2.13 0.20 0.00 -0.02 0.00 0.00 33.50 32.08 3dhu n PRO 177 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3dhu h LEU 178 N 2.59 1.00 -1.43 2.45 5.85 -1.94 -1.92 115.31 121.91 3dhu h LEU 178 Ca -0.43 0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.28 3dhu h LEU 178 Cb 1.31 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.12 3dhu h LEU 178 CO 0.64 0.62 0.12 -2.24 -0.34 0.00 0.00 178.44 177.24 3dhu h ASP 179 N 1.12 0.46 0.11 1.25 2.03 -2.00 -0.67 116.42 118.72 3dhu h ASP 179 Ca 0.44 -0.05 -0.01 0.00 -0.73 0.00 0.00 57.03 56.69 3dhu h ASP 179 Cb 0.24 -0.12 0.00 0.00 -0.83 0.00 0.00 39.33 38.63 3dhu h ASP 179 CO -0.19 0.44 -0.05 0.15 -1.03 0.00 0.00 179.24 178.55 3dhu h PHE 180 N 0.51 -0.14 -0.95 4.15 3.57 -1.72 -2.82 116.94 119.54 3dhu h PHE 180 Ca 0.12 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.72 3dhu h PHE 180 Cb 0.14 0.05 -0.07 0.00 2.79 0.00 0.00 35.95 38.85 3dhu h PHE 180 CO 0.01 0.07 0.61 -1.49 -2.23 0.00 0.00 178.31 175.27 3dhu h TRP 181 N -0.32 1.07 -0.63 0.41 -0.00 -1.11 0.01 115.95 115.38 3dhu h TRP 181 Ca -0.02 0.03 -0.06 0.00 -0.00 0.00 0.00 58.89 58.85 3dhu h TRP 181 Cb 0.27 -0.35 -0.03 0.00 -0.00 0.00 0.00 29.16 29.05 3dhu h TRP 181 CO -0.01 0.49 0.17 -0.07 -0.00 0.00 0.00 178.44 179.02 3dhu h LEU 182 N 0.99 0.91 -0.02 -4.49 3.38 -1.08 -0.06 115.31 114.94 3dhu h LEU 182 Ca 0.44 -0.17 -0.18 0.00 0.09 0.00 0.00 57.88 58.06 3dhu h LEU 182 Cb 0.37 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 40.89 3dhu h LEU 182 CO -0.20 0.87 -0.68 -0.08 0.09 0.00 0.00 178.44 178.44 3dhu h GLU 183 N 0.94 0.50 -0.03 1.13 4.57 -1.17 -0.96 114.58 119.55 3dhu h GLU 183 Ca 0.20 -0.51 0.03 0.00 -1.18 0.00 0.00 59.36 57.91 3dhu h GLU 183 Cb 0.31 0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 28.99 3dhu h GLU 183 CO -0.00 1.15 -0.23 0.00 -1.18 0.00 0.00 179.01 178.74 3dhu h ALA 184 N 0.37 -0.28 -0.63 2.92 0.00 -0.87 0.05 119.26 120.82 3dhu h ALA 184 Ca -0.08 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3dhu h ALA 184 Cb 1.37 0.42 -0.03 0.00 0.00 0.00 0.00 17.79 19.55 3dhu h ALA 184 CO 0.14 -0.72 0.29 -0.09 0.00 0.00 0.00 179.25 178.87 3dhu h ARG 185 N -0.34 0.91 -0.21 0.00 2.43 -1.03 -1.26 114.38 114.88 3dhu h ARG 185 Ca 0.07 -0.14 0.05 0.00 -0.81 0.00 0.00 59.98 59.15 3dhu h ARG 185 Cb 0.44 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 29.78 3dhu h ARG 185 CO -0.23 0.74 -0.11 -0.22 -1.51 0.00 0.00 179.97 178.63 3dhu h LYS 186 N 0.87 -0.09 -0.32 0.20 3.64 -0.63 -0.84 116.57 119.40 3dhu h LYS 186 Ca 0.21 0.01 -0.14 0.00 -1.27 0.00 0.00 60.65 59.46 3dhu h LYS 186 Cb 0.14 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 31.97 3dhu h LYS 186 CO -0.03 -0.06 -0.34 1.96 -2.27 0.00 0.00 179.45 178.71 3dhu h GLN 187 N -0.10 0.80 -0.08 1.90 4.20 -0.89 -2.43 115.11 118.51 3dhu h GLN 187 Ca 0.11 -0.43 -0.02 0.00 0.06 0.00 0.00 58.65 58.38 3dhu h GLN 187 Cb 0.27 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 3dhu h GLN 187 CO -0.27 1.06 -0.03 0.28 -0.67 0.00 0.00 178.83 179.21 3dhu h VAL 188 N 0.57 1.31 0.00 -0.54 2.07 -1.11 -3.08 116.25 115.46 3dhu h VAL 188 Ca 0.05 -0.98 0.00 0.00 0.82 0.00 0.00 66.70 66.59 3dhu h VAL 188 Cb 0.93 1.81 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 3dhu h VAL 188 CO 0.08 0.27 0.00 0.59 0.02 0.00 0.00 177.57 178.54 3dhu n ASN 189 N -4.79 0.47 -0.09 0.57 4.13 -0.33 -0.33 115.26 114.88 3dhu n ASN 189 Ca -0.07 0.59 -0.09 0.00 1.68 0.00 0.00 54.58 56.69 3dhu n ASN 189 Cb 0.24 -0.70 0.07 0.00 -1.54 0.00 0.00 39.78 37.85 3dhu n ASN 189 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3dhu h ALA 190 N 2.45 0.82 0.06 5.41 0.00 -1.34 -2.46 119.26 124.21 3dhu h ALA 190 Ca 0.00 -0.39 -0.35 0.00 0.00 0.00 0.00 54.91 54.17 3dhu h ALA 190 Cb 0.43 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 3dhu h ALA 190 CO 0.00 0.64 -2.05 0.36 0.00 0.00 0.00 179.25 178.21 3dhu n LYS 191 N -4.10 0.70 -3.73 0.00 2.85 -1.11 -4.69 118.16 108.09 3dhu n LYS 191 Ca -0.00 0.23 -0.28 0.00 -1.05 0.00 0.00 58.31 57.21 3dhu n LYS 191 Cb 0.45 -1.68 -0.11 0.00 -0.65 0.00 0.00 35.03 33.04 3dhu n LYS 191 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 3dhu n TYR 192 N -3.28 2.23 0.31 5.58 4.01 0.55 -5.00 117.16 121.56 3dhu n TYR 192 Ca -0.31 -4.05 0.20 0.00 -0.16 0.00 0.00 57.90 53.58 3dhu n TYR 192 Cb 1.05 -0.41 0.98 0.00 -0.31 0.00 0.00 39.34 40.65 3dhu n TYR 192 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3dhu h PRO 193 N 5.30 0.00 -0.00 -0.72 0.13 -1.66 -2.55 132.00 132.50 3dhu h PRO 193 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3dhu h PRO 193 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3dhu h PRO 193 CO 0.64 0.01 -0.08 0.39 -0.23 0.00 0.00 178.00 178.73 3dhu n GLU 194 N -3.13 0.80 -1.65 0.86 4.71 -1.26 -4.95 120.64 116.02 3dhu n GLU 194 Ca -0.02 -0.26 -0.47 0.00 -0.01 0.00 0.00 57.16 56.41 3dhu n GLU 194 Cb 0.17 -1.49 -0.04 0.00 -1.01 0.00 0.00 31.44 29.07 3dhu n GLU 194 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 3dhu n THR 195 N -0.88 0.29 -3.88 2.62 -1.04 -0.96 -4.98 114.28 105.45 3dhu n THR 195 Ca 0.16 -0.07 -0.35 0.00 -2.04 0.00 0.00 64.05 61.75 3dhu n THR 195 Cb 0.26 -1.33 -0.05 0.00 -1.82 0.00 0.00 70.33 67.39 3dhu n THR 195 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 3dhu s LEU 196 N 0.61 4.38 -0.15 -4.42 1.43 -0.69 -4.97 118.68 114.88 3dhu s LEU 196 Ca 0.77 0.40 -0.01 0.00 -1.03 0.00 0.00 54.13 54.26 3dhu s LEU 196 Cb -0.74 -2.46 0.04 0.00 0.03 0.00 0.00 46.19 43.07 3dhu s LEU 196 CO 0.43 0.31 -0.01 0.26 0.23 0.00 0.00 176.35 177.57 3dhu s TRP 197 N -1.23 1.20 -0.15 0.29 0.52 -1.26 -0.19 118.94 118.12 3dhu s TRP 197 Ca 0.24 -0.74 0.01 0.00 0.02 0.00 0.00 56.10 55.62 3dhu s TRP 197 Cb -0.12 -1.08 -0.00 0.00 -1.15 0.00 0.00 33.47 31.11 3dhu s TRP 197 CO 0.14 -0.53 -0.16 -1.17 0.02 0.00 0.00 176.95 175.25 3dhu s LEU 198 N 1.80 2.46 -0.15 2.99 2.96 -0.08 -1.12 118.68 127.55 3dhu s LEU 198 Ca 0.02 -0.46 -0.08 0.00 -0.22 0.00 0.00 54.13 53.39 3dhu s LEU 198 Cb -0.15 -1.55 -0.04 0.00 0.50 0.00 0.00 46.19 44.95 3dhu s LEU 198 CO -0.07 0.10 0.13 0.00 -1.32 0.00 0.00 176.35 175.19 3dhu s ALA 199 N 0.70 3.79 -1.05 5.97 0.00 -0.59 -0.71 121.76 129.88 3dhu s ALA 199 Ca -0.07 -0.66 -0.22 0.00 0.00 0.00 0.00 51.96 51.01 3dhu s ALA 199 Cb -0.16 -2.03 0.07 0.00 0.00 0.00 0.00 23.12 21.00 3dhu s ALA 199 CO 0.02 0.45 1.45 -2.00 0.00 0.00 0.00 175.76 175.67 3dhu s GLU 200 N -0.51 3.65 0.90 0.00 2.12 -0.28 -2.95 118.70 121.63 3dhu s GLU 200 Ca 0.12 -1.34 -0.12 0.00 0.36 0.00 0.00 54.97 53.99 3dhu s GLU 200 Cb -0.12 -5.32 0.13 0.00 0.26 0.00 0.00 34.13 29.08 3dhu s GLU 200 CO 0.02 -2.15 1.10 -1.54 -0.54 0.00 0.00 175.26 172.15 3dhu s SER 201 N 4.67 3.56 0.42 -1.70 1.04 -1.26 -3.00 113.70 117.43 3dhu s SER 201 Ca 0.45 1.29 0.08 0.00 0.48 0.00 0.00 55.95 58.25 3dhu s SER 201 Cb -0.00 -1.97 -0.02 0.00 0.10 0.00 0.00 66.02 64.13 3dhu s SER 201 CO -0.08 -2.56 0.39 0.00 0.98 0.00 0.00 173.24 171.97 3dhu s ALA 202 N -3.05 4.09 0.69 5.32 0.00 -1.26 -4.75 121.76 122.79 3dhu s ALA 202 Ca 0.63 -1.87 -0.10 0.00 0.00 0.00 0.00 51.96 50.62 3dhu s ALA 202 Cb -0.17 -1.02 0.02 0.00 0.00 0.00 0.00 23.12 21.95 3dhu s ALA 202 CO 0.56 -0.24 1.06 0.20 0.00 0.00 0.00 175.76 177.34 3dhu s GLY 203 N -4.14 1.62 0.35 0.00 0.00 -1.26 -4.23 107.32 99.66 3dhu s GLY 203 Ca 0.48 -0.46 0.07 0.00 0.00 0.00 0.00 44.72 44.81 3dhu s GLY 203 CO 0.28 -0.10 1.86 1.48 0.00 0.00 0.00 173.10 176.62 3dhu h SER 204 N -0.57 0.32 -0.31 1.64 4.64 -1.90 -2.48 113.55 114.89 3dhu h SER 204 Ca -0.45 -0.07 0.04 0.00 -0.47 0.00 0.00 61.79 60.84 3dhu h SER 204 Cb 1.26 -0.08 -0.04 0.00 -0.31 0.00 0.00 62.40 63.23 3dhu h SER 204 CO 0.63 0.49 0.06 1.23 -0.87 0.00 0.00 176.83 178.37 3dhu h GLY 205 N 0.85 0.35 1.21 -0.77 0.00 -1.97 -0.55 103.07 102.17 3dhu h GLY 205 Ca 0.06 -0.02 -0.24 0.00 0.00 0.00 0.00 47.33 47.13 3dhu h GLY 205 CO 0.03 -0.02 -0.89 -2.75 0.00 0.00 0.00 176.54 172.91 3dhu h PHE 206 N 0.17 1.05 -0.22 5.60 3.57 -1.91 -2.44 116.94 122.75 3dhu h PHE 206 Ca 0.14 -0.51 0.05 0.00 3.53 0.00 0.00 57.97 61.18 3dhu h PHE 206 Cb 0.16 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 38.71 3dhu h PHE 206 CO -0.18 1.34 -0.07 0.82 -2.23 0.00 0.00 178.31 177.99 3dhu h ILE 207 N 0.48 0.73 -0.57 1.41 2.04 -1.39 -0.83 117.51 119.38 3dhu h ILE 207 Ca -0.08 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 3dhu h ILE 207 Cb 1.53 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 38.31 3dhu h ILE 207 CO 0.18 0.00 0.34 -0.33 0.00 0.00 0.00 178.15 178.34 3dhu h GLU 208 N -0.03 0.78 -0.63 2.37 4.39 -1.02 0.07 114.58 120.51 3dhu h GLU 208 Ca 0.11 -0.07 -0.01 0.00 0.34 0.00 0.00 59.36 59.73 3dhu h GLU 208 Cb 0.20 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.66 3dhu h GLU 208 CO -0.24 0.56 0.36 0.93 -1.16 0.00 0.00 179.01 179.46 3dhu h GLU 209 N 0.77 0.86 -0.00 2.33 4.39 -1.25 0.11 114.58 121.79 3dhu h GLU 209 Ca 0.20 -0.09 -0.00 0.00 0.34 0.00 0.00 59.36 59.82 3dhu h GLU 209 Cb -0.01 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.46 3dhu h GLU 209 CO -0.04 0.64 0.00 -0.07 -1.16 0.00 0.00 179.01 178.38 3dhu h LEU 210 N 0.85 0.00 -0.85 1.33 3.38 -0.83 -3.01 115.31 116.19 3dhu h LEU 210 Ca 0.22 -0.25 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 3dhu h LEU 210 Cb 0.01 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.72 3dhu h LEU 210 CO -0.04 0.25 0.42 0.03 0.09 0.00 0.00 178.44 179.19 3dhu h ARG 211 N -0.24 1.22 0.00 1.13 3.08 -0.77 -0.83 114.38 117.97 3dhu h ARG 211 Ca 0.00 -0.18 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 3dhu h ARG 211 Cb 0.25 -0.22 -0.00 0.00 0.08 0.00 0.00 29.97 30.07 3dhu h ARG 211 CO 0.00 0.93 -0.04 0.66 -1.07 0.00 0.00 179.97 180.46 3dhu h SER 212 N 1.21 0.00 -0.73 7.04 4.64 -0.76 -1.00 113.55 123.96 3dhu h SER 212 Ca 0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.61 3dhu h SER 212 Cb 0.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 3dhu h SER 212 CO -0.04 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3dhu n GLN 213 N -3.23 2.83 -0.77 4.77 1.13 -0.95 -4.93 117.38 116.23 3dhu n GLN 213 Ca -0.01 -2.67 0.00 0.00 -1.94 0.00 0.00 57.00 52.37 3dhu n GLN 213 Cb 0.22 -1.61 0.00 0.00 0.11 0.00 0.00 30.24 28.95 3dhu n GLN 213 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 3dhu n GLY 214 N 1.61 1.04 3.81 1.08 0.00 -0.38 -5.04 105.19 107.30 3dhu n GLY 214 Ca 0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.95 3dhu n GLY 214 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dhu s TYR 215 N -3.59 3.09 0.25 1.61 2.02 -0.36 -4.98 117.35 115.39 3dhu s TYR 215 Ca 0.00 1.48 -0.30 0.00 -0.37 0.00 0.00 57.07 57.89 3dhu s TYR 215 Cb 0.00 -2.95 -0.10 0.00 -0.40 0.00 0.00 41.96 38.52 3dhu s TYR 215 CO 0.00 -1.03 1.35 0.99 -1.57 0.00 0.00 175.55 175.30 3dhu s THR 216 N -2.60 2.90 -0.44 -0.71 2.01 -1.26 -3.76 115.64 111.78 3dhu s THR 216 Ca 0.62 0.78 0.06 0.00 0.31 0.00 0.00 61.69 63.46 3dhu s THR 216 Cb -0.15 -3.50 0.18 0.00 0.01 0.00 0.00 72.50 69.04 3dhu s THR 216 CO 0.40 0.14 0.58 -0.83 -0.69 0.00 0.00 174.62 174.22 3dhu s GLY 217 N 0.15 -0.77 0.32 4.40 0.00 -1.15 -4.33 107.32 105.94 3dhu s GLY 217 Ca 0.56 -0.50 -0.27 0.00 0.00 0.00 0.00 44.72 44.51 3dhu s GLY 217 CO 0.43 3.32 1.05 1.08 0.00 0.00 0.00 173.10 178.99 3dhu s LEU 218 N 1.27 4.40 0.92 0.66 1.43 0.35 -4.91 118.68 122.81 3dhu s LEU 218 Ca 0.22 2.12 -0.12 0.00 -1.03 0.00 0.00 54.13 55.33 3dhu s LEU 218 Cb -0.04 -3.85 0.14 0.00 0.03 0.00 0.00 46.19 42.47 3dhu s LEU 218 CO -0.06 -0.23 1.10 -0.94 0.23 0.00 0.00 176.35 176.45 3dhu s SER 219 N -1.20 3.36 0.17 2.29 1.04 -1.26 -4.75 113.70 113.35 3dhu s SER 219 Ca 0.49 1.22 -0.06 0.00 0.48 0.00 0.00 55.95 58.08 3dhu s SER 219 Cb -0.27 -1.87 0.06 0.00 0.10 0.00 0.00 66.02 64.04 3dhu s SER 219 CO 0.34 -2.67 1.49 0.44 0.98 0.00 0.00 173.24 173.82 3dhu h ASP 220 N -1.58 0.75 -0.31 7.02 5.19 -1.95 -2.13 116.42 123.41 3dhu h ASP 220 Ca -0.51 -0.38 -0.10 0.00 -0.62 0.00 0.00 57.03 55.41 3dhu h ASP 220 Cb 1.31 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.59 3dhu h ASP 220 CO 0.58 1.12 -0.16 0.28 -3.12 0.00 0.00 179.24 177.94 3dhu h SER 221 N 0.53 0.77 -0.11 6.45 0.02 -1.92 -1.52 113.55 117.77 3dhu h SER 221 Ca 0.02 -0.25 0.02 0.00 -0.84 0.00 0.00 61.79 60.75 3dhu h SER 221 Cb 1.07 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 63.37 3dhu h SER 221 CO 0.10 0.93 -0.05 -0.33 -1.14 0.00 0.00 176.83 176.35 3dhu h GLU 222 N 0.68 -0.04 -0.95 3.45 5.08 -1.87 -2.47 114.58 118.47 3dhu h GLU 222 Ca 0.11 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.64 3dhu h GLU 222 Cb 0.65 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 29.81 3dhu h GLU 222 CO 0.05 -0.02 0.55 -0.07 -1.00 0.00 0.00 179.01 178.51 3dhu h LEU 223 N -0.04 0.71 -2.71 1.33 3.38 -1.01 -1.45 115.31 115.52 3dhu h LEU 223 Ca 0.06 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.12 3dhu h LEU 223 Cb 0.13 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3dhu h LEU 223 CO -0.13 0.28 0.04 1.88 0.09 0.00 0.00 178.44 180.61 3dhu h TYR 224 N 0.74 0.00 0.00 1.13 0.05 -0.80 0.21 116.97 118.31 3dhu h TYR 224 Ca 0.53 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.30 3dhu h TYR 224 Cb 0.76 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.50 3dhu h TYR 224 CO -0.04 0.00 -0.05 1.96 -1.05 0.00 0.00 178.16 178.98 3dhu h GLN 225 N 0.00 0.00 0.00 4.88 4.20 -1.23 -3.27 115.11 119.69 3dhu h GLN 225 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 3dhu h GLN 225 Cb 0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.88 3dhu h GLN 225 CO -0.00 0.05 -0.72 0.00 -0.67 0.00 0.00 178.83 177.50 3dhu n ALA 226 N -2.36 2.12 -2.38 3.87 0.00 -0.18 -5.00 120.51 116.57 3dhu n ALA 226 Ca -0.03 -0.04 -0.29 0.00 0.00 0.00 0.00 53.44 53.08 3dhu n ALA 226 Cb 0.14 -0.06 -0.14 0.00 0.00 0.00 0.00 19.45 19.40 3dhu n ALA 226 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 3dhu s PHE 227 N -1.77 2.28 0.09 0.00 0.08 0.57 -4.92 117.98 114.31 3dhu s PHE 227 Ca -0.00 -0.39 -0.07 0.00 0.12 0.00 0.00 56.93 56.58 3dhu s PHE 227 Cb 0.01 -1.29 -0.21 0.00 -0.57 0.00 0.00 43.02 40.96 3dhu s PHE 227 CO 0.07 0.25 1.19 -0.44 -0.10 0.00 0.00 175.22 176.20 3dhu h ASP 228 N 4.23 0.59 -4.43 1.36 3.32 -1.41 -3.40 116.42 116.68 3dhu h ASP 228 Ca -0.49 -0.54 -0.35 0.00 0.02 0.00 0.00 57.03 55.67 3dhu h ASP 228 Cb 1.16 -0.18 -0.19 0.00 0.22 0.00 0.00 39.33 40.33 3dhu h ASP 228 CO 0.41 1.38 -0.75 -0.04 -1.72 0.00 0.00 179.24 178.51 3dhu s MET 229 N -2.97 0.81 0.29 3.56 -1.94 -0.77 -3.68 119.30 114.61 3dhu s MET 229 Ca -0.06 -1.05 0.02 0.00 -1.71 0.00 0.00 55.69 52.89 3dhu s MET 229 Cb 0.07 -0.62 -0.06 0.00 2.01 0.00 0.00 34.83 36.23 3dhu s MET 229 CO 0.89 0.12 0.08 0.95 -0.01 0.00 0.00 175.02 177.04 3dhu s THR 230 N -1.93 0.84 0.37 2.05 -4.23 -0.96 -1.54 115.64 110.24 3dhu s THR 230 Ca 0.02 -2.00 -0.17 0.00 -1.18 0.00 0.00 61.69 58.36 3dhu s THR 230 Cb -0.06 -2.69 -0.09 0.00 1.34 0.00 0.00 72.50 70.99 3dhu s THR 230 CO 0.01 -0.01 0.81 -0.31 -0.54 0.00 0.00 174.62 174.58 3dhu s TYR 231 N -3.55 3.36 0.00 3.99 1.51 -1.15 -0.32 117.35 121.19 3dhu s TYR 231 Ca 0.37 1.33 0.00 0.00 -1.01 0.00 0.00 57.07 57.76 3dhu s TYR 231 Cb 0.08 -2.63 0.00 0.00 -0.11 0.00 0.00 41.96 39.30 3dhu s TYR 231 CO 0.14 -0.00 0.89 -0.25 -1.11 0.00 0.00 175.55 175.22 3dhu n ASP 232 N -0.56 2.44 0.03 2.29 9.92 -0.70 -4.29 116.55 125.69 3dhu n ASP 232 Ca 0.05 -1.51 0.10 0.00 -0.53 0.00 0.00 54.79 52.90 3dhu n ASP 232 Cb 0.53 -0.48 0.43 0.00 -0.64 0.00 0.00 41.12 40.96 3dhu n ASP 232 CO 0.00 0.00 0.00 -1.22 0.13 0.00 0.00 177.20 176.11 3dhu n TYR 233 N 1.31 0.23 0.38 1.24 4.01 -1.26 -0.30 117.16 122.77 3dhu n TYR 233 Ca 0.00 0.08 0.14 0.00 -0.16 0.00 0.00 57.90 57.96 3dhu n TYR 233 Cb 0.28 -0.63 0.50 0.00 -0.31 0.00 0.00 39.34 39.18 3dhu n TYR 233 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 3dhu h ASP 234 N 0.00 0.00 0.00 7.72 2.03 -1.75 -3.37 116.42 121.05 3dhu h ASP 234 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3dhu h ASP 234 Cb 0.38 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.88 3dhu h ASP 234 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 179.24 179.54 3dhu n VAL 235 N -2.62 0.00 -0.29 4.15 0.24 -1.04 -4.84 118.33 113.94 3dhu n VAL 235 Ca 0.02 0.00 0.06 0.00 -2.04 0.00 0.00 64.34 62.38 3dhu n VAL 235 Cb 0.32 0.89 0.20 0.00 -1.47 0.00 0.00 33.84 33.78 3dhu n VAL 235 CO 0.00 0.00 0.00 0.15 -2.14 0.00 0.00 176.83 174.84 3dhu h PHE 236 N 0.00 0.75 -0.89 6.34 3.57 -0.82 0.15 116.94 126.04 3dhu h PHE 236 Ca 0.00 0.03 0.10 0.00 3.53 0.00 0.00 57.97 61.63 3dhu h PHE 236 Cb 0.00 -0.21 -0.07 0.00 2.79 0.00 0.00 35.95 38.47 3dhu h PHE 236 CO 0.00 0.21 0.57 0.78 -2.23 0.00 0.00 178.31 177.64 3dhu h GLY 237 N 0.64 1.28 1.44 2.40 0.00 -1.84 -1.31 103.07 105.68 3dhu h GLY 237 Ca 0.43 -0.36 -0.20 0.00 0.00 0.00 0.00 47.33 47.20 3dhu h GLY 237 CO -0.33 0.19 -0.76 -0.55 0.00 0.00 0.00 176.54 175.09 3dhu h ASP 238 N 0.87 0.65 0.24 0.19 3.32 -1.13 -1.37 116.42 119.19 3dhu h ASP 238 Ca 0.42 -0.43 -0.00 0.00 0.02 0.00 0.00 57.03 57.03 3dhu h ASP 238 Cb 0.44 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 3dhu h ASP 238 CO -0.18 1.20 -0.20 0.15 -1.72 0.00 0.00 179.24 178.49 3dhu h PHE 239 N 0.37 -0.52 -0.54 4.55 3.57 -0.47 -1.46 116.94 122.45 3dhu h PHE 239 Ca -0.04 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.53 3dhu h PHE 239 Cb 1.35 0.20 -0.06 0.00 2.79 0.00 0.00 35.95 40.23 3dhu h PHE 239 CO 0.06 -0.30 0.21 0.87 -2.23 0.00 0.00 178.31 176.92 3dhu h LYS 240 N -0.45 0.39 -0.78 1.11 1.57 -1.14 0.37 116.57 117.64 3dhu h LYS 240 Ca -0.01 -0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3dhu h LYS 240 Cb 0.40 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.58 3dhu h LYS 240 CO -0.02 0.26 0.51 -0.44 -0.57 0.00 0.00 179.45 179.19 3dhu h ASP 241 N 0.41 0.87 0.20 0.86 3.32 -1.14 0.40 116.42 121.33 3dhu h ASP 241 Ca 0.26 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.29 3dhu h ASP 241 Cb 0.27 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.62 3dhu h ASP 241 CO -0.25 0.61 -0.10 0.22 -1.72 0.00 0.00 179.24 178.01 3dhu h TYR 242 N 1.02 -0.25 -0.92 4.55 3.20 -0.50 0.16 116.97 124.24 3dhu h TYR 242 Ca 0.30 -0.01 0.08 0.00 3.14 0.00 0.00 58.73 62.24 3dhu h TYR 242 Cb -0.07 0.08 -0.06 0.00 1.54 0.00 0.00 36.73 38.22 3dhu h TYR 242 CO -0.02 -0.05 0.59 2.35 -1.64 0.00 0.00 178.16 179.39 3dhu h TRP 243 N -0.41 1.03 -0.44 -3.82 2.91 0.29 -1.10 115.95 114.41 3dhu h TRP 243 Ca -0.03 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.02 3dhu h TRP 243 Cb 0.31 -0.34 0.00 0.00 -0.51 0.00 0.00 29.16 28.63 3dhu h TRP 243 CO -0.02 0.51 0.00 1.04 -1.03 0.00 0.00 178.44 178.93 3dhu n GLN 244 N -4.51 2.02 -0.92 2.65 6.02 0.14 -4.92 117.38 117.84 3dhu n GLN 244 Ca 0.15 -1.58 0.00 0.00 -0.01 0.00 0.00 57.00 55.55 3dhu n GLN 244 Cb 0.25 -1.34 0.00 0.00 1.02 0.00 0.00 30.24 30.17 3dhu n GLN 244 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3dhu n GLY 245 N 1.20 0.51 0.98 1.08 0.00 -0.42 -4.91 105.19 103.65 3dhu n GLY 245 Ca 0.15 -0.23 0.12 0.00 0.00 0.00 0.00 46.02 46.06 3dhu n GLY 245 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dhu n ARG 246 N -2.92 2.34 -3.98 1.61 1.74 0.48 -4.91 116.66 111.01 3dhu n ARG 246 Ca 0.00 -1.97 -0.08 0.00 -0.77 0.00 0.00 57.85 55.03 3dhu n ARG 246 Cb 0.00 -1.47 -0.09 0.00 -1.02 0.00 0.00 32.46 29.87 3dhu n ARG 246 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 3dhu s SER 247 N -1.88 0.29 0.45 0.55 0.15 -0.88 -4.89 113.70 107.50 3dhu s SER 247 Ca 0.31 -0.72 0.02 0.00 0.70 0.00 0.00 55.95 56.26 3dhu s SER 247 Cb 0.21 0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.74 3dhu s SER 247 CO 0.31 -0.55 0.66 0.42 1.20 0.00 0.00 173.24 175.27 3dhu s THR 248 N -3.14 3.68 0.31 6.45 -4.23 -1.26 -4.41 115.64 113.04 3dhu s THR 248 Ca -0.00 -0.63 0.02 0.00 -1.18 0.00 0.00 61.69 59.89 3dhu s THR 248 Cb 0.02 -3.34 0.16 0.00 1.34 0.00 0.00 72.50 70.68 3dhu s THR 248 CO -0.07 -0.22 1.86 1.62 -0.54 0.00 0.00 174.62 177.27 3dhu h VAL 249 N 0.41 1.21 -0.50 2.29 3.04 -1.93 -2.50 116.25 118.28 3dhu h VAL 249 Ca -0.45 -0.77 -0.03 0.00 -1.01 0.00 0.00 66.70 64.44 3dhu h VAL 249 Cb 1.26 0.79 -0.02 0.00 -2.01 0.00 0.00 31.29 31.31 3dhu h VAL 249 CO 0.55 0.28 0.20 -0.33 -1.01 0.00 0.00 177.57 177.26 3dhu h GLU 250 N 0.65 0.74 -0.41 4.17 3.07 -1.95 0.48 114.58 121.32 3dhu h GLU 250 Ca 0.14 -0.13 -0.03 0.00 -0.50 0.00 0.00 59.36 58.84 3dhu h GLU 250 Cb 0.29 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.06 3dhu h GLU 250 CO 0.00 0.65 0.13 -0.09 -1.40 0.00 0.00 179.01 178.31 3dhu h ARG 251 N 0.66 0.64 0.30 2.33 2.43 -1.92 -0.77 114.38 118.05 3dhu h ARG 251 Ca 0.17 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 3dhu h ARG 251 Cb 0.18 -0.09 0.00 0.00 -0.42 0.00 0.00 29.97 29.64 3dhu h ARG 251 CO -0.01 0.63 -0.14 -0.92 -1.51 0.00 0.00 179.97 178.01 3dhu h TYR 252 N 0.53 -0.38 -0.69 2.20 3.20 -1.18 -2.40 116.97 118.25 3dhu h TYR 252 Ca 0.13 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.97 3dhu h TYR 252 Cb 0.25 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.61 3dhu h TYR 252 CO 0.01 -0.19 0.33 0.28 -1.64 0.00 0.00 178.16 176.95 3dhu h VAL 253 N -0.46 1.22 -0.85 1.81 2.07 -0.93 -1.32 116.25 117.79 3dhu h VAL 253 Ca -0.04 -0.62 0.06 0.00 0.82 0.00 0.00 66.70 66.92 3dhu h VAL 253 Cb 0.35 0.34 -0.05 0.00 -1.52 0.00 0.00 31.29 30.41 3dhu h VAL 253 CO 0.07 0.26 0.56 -0.78 0.02 0.00 0.00 177.57 177.70 3dhu h ASP 254 N 0.97 0.84 -0.20 0.57 3.58 -1.06 -0.18 116.42 120.95 3dhu h ASP 254 Ca 0.24 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.56 3dhu h ASP 254 Cb 0.10 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 40.96 3dhu h ASP 254 CO -0.03 0.54 -0.35 -0.07 -2.88 0.00 0.00 179.24 176.45 3dhu h LEU 255 N 0.95 0.75 -0.84 2.28 3.38 -0.74 -1.24 115.31 119.86 3dhu h LEU 255 Ca 0.37 -0.32 -0.12 0.00 0.09 0.00 0.00 57.88 57.89 3dhu h LEU 255 Cb 0.21 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3dhu h LEU 255 CO -0.13 1.03 -0.54 -0.07 0.09 0.00 0.00 178.44 178.82 3dhu h LEU 256 N 0.60 0.12 0.03 1.67 3.38 -0.98 0.11 115.31 120.24 3dhu h LEU 256 Ca 0.06 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 3dhu h LEU 256 Cb 0.88 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.60 3dhu h LEU 256 CO 0.08 0.64 -0.01 1.56 0.09 0.00 0.00 178.44 180.79 3dhu h GLN 257 N 0.09 -0.04 -0.70 1.13 4.20 -0.86 -1.55 115.11 117.39 3dhu h GLN 257 Ca -0.00 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.81 3dhu h GLN 257 Cb 0.98 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 28.70 3dhu h GLN 257 CO 0.08 0.24 0.34 0.00 -0.67 0.00 0.00 178.83 178.81 3dhu h ARG 258 N -0.31 0.56 -0.72 1.46 3.08 -1.12 -2.36 114.38 114.97 3dhu h ARG 258 Ca -0.00 -0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.07 3dhu h ARG 258 Cb 0.29 -0.13 -0.04 0.00 0.08 0.00 0.00 29.97 30.17 3dhu h ARG 258 CO 0.01 0.37 0.47 0.37 -1.07 0.00 0.00 179.97 180.12 3dhu h GLN 259 N 0.58 0.77 0.00 0.04 4.15 -0.53 -2.76 115.11 117.36 3dhu h GLN 259 Ca 0.35 -0.05 -0.03 0.00 0.77 0.00 0.00 58.65 59.69 3dhu h GLN 259 Cb 0.37 -0.17 -0.00 0.00 0.21 0.00 0.00 27.48 27.89 3dhu h GLN 259 CO -0.27 0.51 -0.12 0.22 -1.93 0.00 0.00 178.83 177.24 3dhu h ASP 260 N 0.80 0.00 -0.45 -0.69 3.58 -0.72 -2.29 116.42 116.64 3dhu h ASP 260 Ca 0.30 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.75 3dhu h ASP 260 Cb 0.18 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.23 3dhu h ASP 260 CO -0.10 0.12 0.00 0.00 -2.88 0.00 0.00 179.24 176.39 3dhu n ALA 261 N -2.17 2.27 0.04 -0.78 0.00 -1.06 -4.38 120.51 114.44 3dhu n ALA 261 Ca 0.00 -1.15 -0.05 0.00 0.00 0.00 0.00 53.44 52.25 3dhu n ALA 261 Cb 0.38 -0.62 -0.10 0.00 0.00 0.00 0.00 19.45 19.11 3dhu n ALA 261 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3dhu h THR 262 N 2.92 1.09 -1.34 0.00 2.02 -1.26 -3.48 112.91 112.87 3dhu h THR 262 Ca 0.00 -2.75 -0.59 0.00 0.77 0.00 0.00 66.41 63.85 3dhu h THR 262 Cb 0.82 2.50 -0.09 0.00 -1.74 0.00 0.00 68.15 69.63 3dhu h THR 262 CO 0.00 0.62 -0.49 -0.36 0.37 0.00 0.00 175.52 175.66 3dhu s PHE 263 N -2.76 2.40 0.76 3.16 0.08 -1.25 -4.93 117.98 115.44 3dhu s PHE 263 Ca -0.01 -0.67 -0.13 0.00 0.12 0.00 0.00 56.93 56.24 3dhu s PHE 263 Cb 0.09 -1.90 0.06 0.00 -0.57 0.00 0.00 43.02 40.70 3dhu s PHE 263 CO 0.81 0.14 1.15 -2.14 -0.10 0.00 0.00 175.22 175.08 3dhu s PRO 264 N -3.92 2.09 0.57 0.24 0.02 -1.26 -4.90 135.00 127.83 3dhu s PRO 264 Ca 0.36 1.50 0.26 0.00 0.02 0.00 0.00 61.00 63.13 3dhu s PRO 264 Cb 0.04 -1.85 1.55 0.00 0.02 0.00 0.00 34.50 34.25 3dhu s PRO 264 CO 0.20 -1.82 2.11 0.78 -0.33 0.00 0.00 177.00 177.93 3dhu h GLY 265 N -0.73 0.00 -1.32 0.52 0.00 -1.99 -0.94 103.07 98.60 3dhu h GLY 265 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 3dhu h GLY 265 CO 0.49 0.00 0.00 1.16 0.00 0.00 0.00 176.54 178.19 3dhu n ASN 266 N -4.05 1.95 -4.73 0.19 6.94 -1.26 -4.99 115.26 109.30 3dhu n ASN 266 Ca 0.02 -1.99 -0.35 0.00 -0.02 0.00 0.00 54.58 52.24 3dhu n ASN 266 Cb 0.31 -0.24 0.08 0.00 -2.36 0.00 0.00 39.78 37.57 3dhu n ASN 266 CO 0.00 0.00 0.00 -0.72 -1.03 0.00 0.00 177.26 175.51 3dhu s TYR 267 N -1.52 2.11 -0.19 -2.53 -0.85 -0.36 -4.44 117.35 109.56 3dhu s TYR 267 Ca 0.25 1.57 -0.01 0.00 -0.52 0.00 0.00 57.07 58.36 3dhu s TYR 267 Cb 0.13 -3.50 0.05 0.00 0.38 0.00 0.00 41.96 39.02 3dhu s TYR 267 CO 0.17 -2.58 -0.04 0.08 -1.52 0.00 0.00 175.55 171.66 3dhu s VAL 268 N -1.85 1.14 0.04 -3.49 1.01 -1.24 -4.89 120.40 111.12 3dhu s VAL 268 Ca 0.76 -0.82 -0.19 0.00 0.00 0.00 0.00 61.98 61.73 3dhu s VAL 268 Cb -0.30 -1.41 -0.06 0.00 0.00 0.00 0.00 36.38 34.61 3dhu s VAL 268 CO 0.43 -0.01 0.57 -0.54 0.00 0.00 0.00 175.10 175.54 3dhu s LYS 269 N 1.60 4.23 -0.23 2.72 -0.14 -1.26 -2.26 119.74 124.40 3dhu s LYS 269 Ca -0.02 0.72 -0.24 0.00 -1.36 0.00 0.00 55.97 55.07 3dhu s LYS 269 Cb -0.17 -3.27 -0.01 0.00 -1.68 0.00 0.00 37.83 32.70 3dhu s LYS 269 CO -0.07 0.55 0.79 1.41 -0.76 0.00 0.00 175.35 177.27 3dhu s MET 270 N -0.78 4.19 -0.13 1.68 -2.45 0.56 -0.65 119.30 121.72 3dhu s MET 270 Ca 0.29 0.89 -0.07 0.00 -1.25 0.00 0.00 55.69 55.55 3dhu s MET 270 Cb -0.19 -3.63 -0.04 0.00 1.25 0.00 0.00 34.83 32.22 3dhu s MET 270 CO 0.18 -0.46 0.11 1.03 1.05 0.00 0.00 175.02 176.92 3dhu s ARG 271 N 2.66 3.54 0.01 4.11 1.81 -0.58 -1.72 118.95 128.79 3dhu s ARG 271 Ca 0.34 -0.21 -0.17 0.00 -1.72 0.00 0.00 55.73 53.97 3dhu s ARG 271 Cb -0.15 -3.16 0.03 0.00 -0.45 0.00 0.00 34.95 31.21 3dhu s ARG 271 CO 0.08 0.64 0.38 -0.59 -0.68 0.00 0.00 175.30 175.13 3dhu s PHE 272 N -0.64 -0.24 -0.32 -0.53 -0.12 -1.26 -1.06 117.98 113.81 3dhu s PHE 272 Ca 0.12 0.27 0.17 0.00 -0.05 0.00 0.00 56.93 57.45 3dhu s PHE 272 Cb -0.12 0.17 -0.24 0.00 -0.63 0.00 0.00 43.02 42.20 3dhu s PHE 272 CO 0.02 -0.49 0.51 1.28 -0.05 0.00 0.00 175.22 176.49 3dhu n LEU 273 N 0.84 0.30 -3.75 -1.99 4.77 -1.26 -5.03 117.00 110.87 3dhu n LEU 273 Ca -0.20 -0.19 -0.06 0.00 -0.03 0.00 0.00 56.01 55.53 3dhu n LEU 273 Cb 0.58 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.65 3dhu n LEU 273 CO 0.21 0.08 0.56 -1.83 -1.33 0.00 0.00 177.39 175.08 3dhu s GLU 274 N -2.98 1.47 0.06 3.23 -1.05 -1.26 -4.23 118.70 113.94 3dhu s GLU 274 Ca -0.02 -0.78 -0.04 0.00 -0.15 0.00 0.00 54.97 53.99 3dhu s GLU 274 Cb 0.12 0.53 0.01 0.00 -0.44 0.00 0.00 34.13 34.35 3dhu s GLU 274 CO 0.72 -0.67 0.18 0.27 0.95 0.00 0.00 175.26 176.71 3dhu n ASN 275 N -0.44 -0.43 0.18 0.83 0.23 -1.26 -4.70 115.26 109.67 3dhu n ASN 275 Ca -0.06 -1.27 0.11 0.00 -0.53 0.00 0.00 54.58 52.83 3dhu n ASN 275 Cb 0.60 0.71 0.65 0.00 -2.08 0.00 0.00 39.78 39.66 3dhu n ASN 275 CO 0.00 0.00 0.00 1.12 -0.93 0.00 0.00 177.26 177.45 3dhu h HIS 276 N 1.20 0.01 -0.01 -2.53 2.07 -1.98 -1.56 115.15 112.36 3dhu h HIS 276 Ca -0.06 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.46 3dhu h HIS 276 Cb 0.25 -0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.23 3dhu h HIS 276 CO 0.00 0.01 -0.14 -0.25 -3.07 0.00 0.00 177.93 174.48 3dhu n ASP 277 N -4.50 1.33 -4.28 3.10 8.00 -1.26 -4.82 116.55 114.12 3dhu n ASP 277 Ca 0.01 -1.21 -0.16 0.00 0.71 0.00 0.00 54.79 54.14 3dhu n ASP 277 Cb 0.23 0.08 -0.10 0.00 -0.02 0.00 0.00 41.12 41.31 3dhu n ASP 277 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 3dhu s ASN 278 N -2.26 2.05 0.64 -2.24 0.01 -0.59 -5.13 114.94 107.42 3dhu s ASN 278 Ca 0.30 -1.02 -0.18 0.00 -0.71 0.00 0.00 52.86 51.26 3dhu s ASN 278 Cb 0.20 -0.05 -0.02 0.00 0.41 0.00 0.00 41.25 41.79 3dhu s ASN 278 CO 0.43 -0.28 1.13 0.00 -1.51 0.00 0.00 177.10 176.88 3dhu n ALA 279 N -0.26 0.62 -1.73 0.60 0.00 -1.26 -4.35 120.51 114.13 3dhu n ALA 279 Ca -0.09 -0.03 -0.36 0.00 0.00 0.00 0.00 53.44 52.96 3dhu n ALA 279 Cb 0.61 -2.22 0.04 0.00 0.00 0.00 0.00 19.45 17.88 3dhu n ALA 279 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3dhu s ARG 280 N -3.16 2.84 0.24 0.00 1.81 -1.26 -4.51 118.95 114.91 3dhu s ARG 280 Ca 0.79 1.88 -0.07 0.00 -1.72 0.00 0.00 55.73 56.61 3dhu s ARG 280 Cb -0.39 -1.91 0.43 0.00 -0.45 0.00 0.00 34.95 32.64 3dhu s ARG 280 CO 0.44 -1.32 1.66 1.98 -0.68 0.00 0.00 175.30 177.37 3dhu h MET 281 N 0.75 0.17 -0.94 3.54 1.85 -1.83 -1.00 114.93 117.47 3dhu h MET 281 Ca -0.50 -0.01 -0.01 0.00 -0.61 0.00 0.00 59.70 58.57 3dhu h MET 281 Cb 1.31 -0.04 -0.00 0.00 0.43 0.00 0.00 31.60 33.29 3dhu h MET 281 CO 0.54 0.11 0.01 -1.33 -0.40 0.00 0.00 176.91 175.84 3dhu n MET 282 N -5.25 1.57 -0.04 0.39 2.81 -1.26 -0.98 117.12 114.37 3dhu n MET 282 Ca 0.13 -0.48 -0.02 0.00 -1.81 0.00 0.00 57.70 55.52 3dhu n MET 282 Cb 0.45 -1.59 -0.08 0.00 -0.71 0.00 0.00 33.22 31.29 3dhu n MET 282 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3dhu n SER 283 N 0.11 2.45 -0.02 7.83 3.41 -0.40 -4.57 113.62 122.42 3dhu n SER 283 Ca 0.05 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.54 3dhu n SER 283 Cb 0.42 0.98 0.01 0.00 -0.26 0.00 0.00 64.21 65.36 3dhu n SER 283 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 3dhu h LEU 284 N 0.00 0.75 -8.69 1.04 3.38 -0.79 -3.47 115.31 107.54 3dhu h LEU 284 Ca -0.20 -0.42 -0.29 0.00 0.09 0.00 0.00 57.88 57.07 3dhu h LEU 284 Cb 1.30 -0.22 -0.15 0.00 0.09 0.00 0.00 40.66 41.68 3dhu h LEU 284 CO 0.01 1.17 -0.60 0.00 0.09 0.00 0.00 178.44 179.11 3dhu s MET 285 N -3.98 1.31 0.00 1.13 0.23 -0.43 -5.05 119.30 112.51 3dhu s MET 285 Ca -0.09 -1.71 0.00 0.00 -1.03 0.00 0.00 55.69 52.87 3dhu s MET 285 Cb 0.11 0.18 0.00 0.00 -1.53 0.00 0.00 34.83 33.59 3dhu s MET 285 CO 0.86 -0.41 0.55 0.72 -2.03 0.00 0.00 175.02 174.71 3dhu n HIS 286 N -0.35 0.00 -3.96 3.16 8.25 -1.26 -4.20 115.22 116.86 3dhu n HIS 286 Ca 0.02 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.40 3dhu n HIS 286 Cb 0.66 0.01 -0.09 0.00 1.12 0.00 0.00 29.99 31.69 3dhu n HIS 286 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3dhu s SER 287 N -0.20 0.25 0.27 0.41 1.04 -1.26 -5.04 113.70 109.17 3dhu s SER 287 Ca 0.00 -0.67 0.01 0.00 0.48 0.00 0.00 55.95 55.77 3dhu s SER 287 Cb 0.00 0.23 0.36 0.00 0.10 0.00 0.00 66.02 66.72 3dhu s SER 287 CO 0.00 -0.56 1.71 0.50 0.98 0.00 0.00 173.24 175.87 3dhu h LYS 288 N 3.43 0.56 -0.47 4.02 3.64 -1.99 -1.96 116.57 123.81 3dhu h LYS 288 Ca -0.33 -0.21 0.09 0.00 -1.27 0.00 0.00 60.65 58.93 3dhu h LYS 288 Cb 1.18 -0.03 -0.08 0.00 -0.41 0.00 0.00 32.23 32.89 3dhu h LYS 288 CO 0.55 0.75 0.01 0.00 -2.27 0.00 0.00 179.45 178.49 3dhu h ALA 289 N 1.26 0.45 -0.43 5.00 0.00 -1.98 -0.38 119.26 123.17 3dhu h ALA 289 Ca 0.07 0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 3dhu h ALA 289 Cb 0.66 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 3dhu h ALA 289 CO 0.05 -0.38 0.22 0.93 0.00 0.00 0.00 179.25 180.07 3dhu h GLU 290 N 0.13 0.62 -0.85 0.00 5.08 -1.88 -2.77 114.58 114.90 3dhu h GLU 290 Ca 0.23 -0.08 0.03 0.00 -1.00 0.00 0.00 59.36 58.54 3dhu h GLU 290 Cb 0.34 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.43 3dhu h GLU 290 CO -0.38 0.52 0.56 0.00 -1.00 0.00 0.00 179.01 178.71 3dhu h ALA 291 N 1.07 1.45 -0.00 3.43 0.00 -0.78 -1.35 119.26 123.08 3dhu h ALA 291 Ca 0.15 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 3dhu h ALA 291 Cb 0.09 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3dhu h ALA 291 CO -0.02 0.47 0.00 0.28 0.00 0.00 0.00 179.25 179.98 3dhu h VAL 292 N 1.08 1.15 -0.48 0.00 2.07 -0.89 0.32 116.25 119.50 3dhu h VAL 292 Ca 0.33 -0.44 0.04 0.00 0.82 0.00 0.00 66.70 67.45 3dhu h VAL 292 Cb -0.00 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 3dhu h VAL 292 CO -0.09 0.11 0.25 0.78 0.02 0.00 0.00 177.57 178.64 3dhu h ASN 293 N -0.18 0.37 0.85 0.57 2.35 -1.26 -0.89 115.58 117.38 3dhu h ASN 293 Ca 0.00 0.02 -0.21 0.00 -0.55 0.00 0.00 56.30 55.56 3dhu h ASN 293 Cb 0.19 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 3dhu h ASN 293 CO -0.00 0.26 -0.97 0.78 -1.65 0.00 0.00 177.43 175.85 3dhu h ASN 294 N 0.50 0.10 0.04 5.81 2.35 -1.14 -1.83 115.58 121.41 3dhu h ASN 294 Ca 0.20 -0.09 -0.15 0.00 -0.55 0.00 0.00 56.30 55.71 3dhu h ASN 294 Cb 0.09 -0.03 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 3dhu h ASN 294 CO -0.13 1.01 -0.50 -0.07 -1.65 0.00 0.00 177.43 176.08 3dhu h LEU 295 N 0.03 0.57 -1.17 1.61 3.38 -0.90 -2.19 115.31 116.64 3dhu h LEU 295 Ca -0.03 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 3dhu h LEU 295 Cb 1.69 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.24 3dhu h LEU 295 CO 0.14 0.98 0.29 0.74 0.09 0.00 0.00 178.44 180.67 3dhu h THR 296 N 0.41 1.20 -0.17 0.22 2.02 -1.06 -2.44 112.91 113.09 3dhu h THR 296 Ca 0.02 -0.58 -0.03 0.00 0.77 0.00 0.00 66.41 66.59 3dhu h THR 296 Cb 1.03 0.43 -0.01 0.00 -1.74 0.00 0.00 68.15 67.86 3dhu h THR 296 CO 0.09 0.24 -0.02 -0.25 0.37 0.00 0.00 175.52 175.95 3dhu h TRP 297 N 0.86 0.35 0.00 3.16 -0.00 -1.14 0.27 115.95 119.46 3dhu h TRP 297 Ca 0.21 -0.07 -0.04 0.00 -0.00 0.00 0.00 58.89 58.99 3dhu h TRP 297 Cb 0.10 -0.09 -0.01 0.00 -0.00 0.00 0.00 29.16 29.17 3dhu h TRP 297 CO 0.01 0.56 -0.19 -0.84 -0.00 0.00 0.00 178.44 177.97 3dhu h ILE 298 N 0.05 0.65 0.09 2.65 3.07 -1.31 -2.52 117.51 120.19 3dhu h ILE 298 Ca 0.05 -0.85 -0.26 0.00 1.55 0.00 0.00 64.86 65.35 3dhu h ILE 298 Cb 0.43 1.55 -0.01 0.00 -0.27 0.00 0.00 36.82 38.52 3dhu h ILE 298 CO 0.01 0.19 -1.20 -0.26 -1.05 0.00 0.00 178.15 175.85 3dhu h PHE 299 N 0.00 0.34 0.00 0.16 0.04 -1.32 -3.38 116.94 112.78 3dhu h PHE 299 Ca -0.00 -0.24 -0.05 0.00 2.80 0.00 0.00 57.97 60.47 3dhu h PHE 299 Cb 0.53 -0.01 -0.01 0.00 2.20 0.00 0.00 35.95 38.66 3dhu h PHE 299 CO 0.00 1.20 -1.11 0.52 -0.60 0.00 0.00 178.31 178.32 3dhu h MET 300 N 0.05 0.00 -7.19 1.51 2.86 -0.86 -3.46 114.93 107.83 3dhu h MET 300 Ca -0.11 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.00 3dhu h MET 300 Cb 1.92 0.00 0.16 0.00 0.06 0.00 0.00 31.60 33.73 3dhu h MET 300 CO 0.18 0.09 0.37 -0.65 1.06 0.00 0.00 176.91 177.96 3dhu s GLN 301 N -3.23 2.02 -0.14 1.72 -0.21 -0.96 -4.92 119.66 113.95 3dhu s GLN 301 Ca -0.01 1.70 -0.29 0.00 0.02 0.00 0.00 55.36 56.78 3dhu s GLN 301 Cb 0.09 -1.83 -0.05 0.00 1.00 0.00 0.00 33.01 32.23 3dhu s GLN 301 CO 0.79 -1.91 1.75 0.50 -2.12 0.00 0.00 175.29 174.31 3dhu s ARG 302 N -4.05 3.87 0.00 2.91 3.52 -1.26 -4.75 118.95 119.19 3dhu s ARG 302 Ca 0.73 1.99 0.00 0.00 -0.13 0.00 0.00 55.73 58.32 3dhu s ARG 302 Cb -0.28 -4.08 0.00 0.00 -1.56 0.00 0.00 34.95 29.03 3dhu s ARG 302 CO 0.47 -1.23 0.00 0.41 -0.81 0.00 0.00 175.30 174.15 3dhu n GLY 303 N 4.64 0.52 2.93 8.12 0.00 -1.26 -4.49 105.19 115.64 3dhu n GLY 303 Ca 0.20 -1.55 -0.27 0.00 0.00 0.00 0.00 46.02 44.40 3dhu n GLY 303 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dhu s ILE 304 N -3.46 1.10 0.39 -0.61 2.07 0.18 -4.36 121.20 116.52 3dhu s ILE 304 Ca 0.00 -0.34 -0.25 0.00 -1.41 0.00 0.00 60.65 58.65 3dhu s ILE 304 Cb 0.00 -1.10 -0.09 0.00 0.13 0.00 0.00 42.46 41.40 3dhu s ILE 304 CO 0.00 0.38 1.11 -2.16 -1.91 0.00 0.00 174.94 172.36 3dhu s PRO 305 N 1.64 4.13 -0.14 3.50 0.04 -1.26 -1.52 135.00 141.38 3dhu s PRO 305 Ca 0.04 1.68 -0.04 0.00 0.04 0.00 0.00 61.00 62.71 3dhu s PRO 305 Cb -0.13 -2.64 -0.03 0.00 0.04 0.00 0.00 34.50 31.74 3dhu s PRO 305 CO -0.08 -0.21 0.01 -1.17 0.04 0.00 0.00 177.00 175.59 3dhu s LEU 306 N -2.51 3.54 -0.19 -3.56 2.96 -0.23 -1.04 118.68 117.66 3dhu s LEU 306 Ca 0.57 0.03 -0.02 0.00 -0.22 0.00 0.00 54.13 54.49 3dhu s LEU 306 Cb -0.27 -1.85 -0.00 0.00 0.50 0.00 0.00 46.19 44.57 3dhu s LEU 306 CO 0.33 0.24 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.87 3dhu s ILE 307 N -0.04 3.03 -0.02 6.68 -1.09 0.05 -4.63 121.20 125.18 3dhu s ILE 307 Ca 0.04 -0.63 -0.20 0.00 -2.23 0.00 0.00 60.65 57.63 3dhu s ILE 307 Cb -0.13 -2.33 -0.05 0.00 -1.58 0.00 0.00 42.46 38.37 3dhu s ILE 307 CO 0.02 0.47 0.59 -0.47 -1.23 0.00 0.00 174.94 174.32 3dhu s TYR 308 N 1.14 3.66 -0.04 3.97 5.04 -1.26 -1.19 117.35 128.67 3dhu s TYR 308 Ca 0.01 1.17 -0.40 0.00 -2.44 0.00 0.00 57.07 55.41 3dhu s TYR 308 Cb -0.14 -2.61 -0.19 0.00 0.35 0.00 0.00 41.96 39.37 3dhu s TYR 308 CO -0.03 0.32 1.25 0.27 -1.34 0.00 0.00 175.55 176.02 3dhu n ASN 309 N 2.90 0.79 0.00 4.32 2.04 0.32 -0.90 115.26 124.72 3dhu n ASN 309 Ca -0.06 1.14 0.00 0.00 -0.44 0.00 0.00 54.58 55.22 3dhu n ASN 309 Cb 0.51 -1.02 0.00 0.00 -2.53 0.00 0.00 39.78 36.74 3dhu n ASN 309 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3dhu n GLY 310 N 2.23 3.46 0.22 4.83 0.00 -1.26 -4.89 105.19 109.78 3dhu n GLY 310 Ca 0.21 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.28 3dhu n GLY 310 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3dhu h GLN 311 N 2.82 0.00 0.00 1.61 4.15 -1.37 -1.42 115.11 120.90 3dhu h GLN 311 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3dhu h GLN 311 Cb 0.00 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.69 3dhu h GLN 311 CO 0.00 0.22 0.00 -0.85 -1.93 0.00 0.00 178.83 176.27 3dhu n GLU 312 N -4.22 0.12 -0.23 1.69 0.00 -1.26 -1.81 120.64 114.93 3dhu n GLU 312 Ca -0.02 0.28 0.07 0.00 0.00 0.00 0.00 57.16 57.49 3dhu n GLU 312 Cb 0.28 -1.70 0.17 0.00 0.00 0.00 0.00 31.44 30.19 3dhu n GLU 312 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 3dhu n PHE 313 N -1.91 0.45 -3.41 -1.84 3.72 -0.62 -1.10 117.46 112.75 3dhu n PHE 313 Ca 0.04 -0.78 -0.20 0.00 -0.05 0.00 0.00 57.45 56.46 3dhu n PHE 313 Cb 0.26 -0.18 0.07 0.00 -0.94 0.00 0.00 39.48 38.69 3dhu n PHE 313 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3dhu n LEU 314 N -0.57 -3.26 -4.72 4.37 4.77 -0.75 -0.49 117.00 116.36 3dhu n LEU 314 Ca 0.15 -0.47 -0.40 0.00 -0.03 0.00 0.00 56.01 55.27 3dhu n LEU 314 Cb 0.64 -2.67 0.03 0.00 -2.33 0.00 0.00 43.42 39.09 3dhu n LEU 314 CO 0.08 0.53 0.92 0.00 -1.33 0.00 0.00 177.39 177.59 3dhu n ALA 315 N -4.53 1.42 -0.01 -1.18 0.00 -0.67 -4.17 120.51 111.37 3dhu n ALA 315 Ca -0.02 0.19 0.04 0.00 0.00 0.00 0.00 53.44 53.65 3dhu n ALA 315 Cb 0.56 -2.31 -0.08 0.00 0.00 0.00 0.00 19.45 17.63 3dhu n ALA 315 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3dhu n GLU 316 N -0.49 0.56 -3.86 0.00 1.02 -1.26 -4.01 120.64 112.60 3dhu n GLU 316 Ca 0.08 -0.08 -0.35 0.00 -0.02 0.00 0.00 57.16 56.79 3dhu n GLU 316 Cb 0.42 -1.25 -0.08 0.00 -0.02 0.00 0.00 31.44 30.51 3dhu n GLU 316 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 3dhu s HIS 317 N -2.67 3.37 -0.47 -0.32 2.46 -1.26 -4.50 115.29 111.91 3dhu s HIS 317 Ca -0.04 0.26 -0.28 0.00 0.47 0.00 0.00 55.06 55.47 3dhu s HIS 317 Cb 0.06 -2.10 0.03 0.00 -0.13 0.00 0.00 32.58 30.44 3dhu s HIS 317 CO 0.43 0.30 1.10 -1.14 -2.47 0.00 0.00 174.74 172.96 3dhu s GLN 318 N 0.17 3.71 0.31 2.88 0.74 -1.26 -4.86 119.66 121.34 3dhu s GLN 318 Ca 0.07 0.52 -0.29 0.00 0.05 0.00 0.00 55.36 55.71 3dhu s GLN 318 Cb -0.12 -3.90 -0.12 0.00 1.10 0.00 0.00 33.01 29.97 3dhu s GLN 318 CO -0.01 -1.33 1.38 -2.30 -0.55 0.00 0.00 175.29 172.48 3dhu n PRO 319 N 7.69 2.21 -1.71 1.67 -0.02 -1.26 -4.95 135.00 138.64 3dhu n PRO 319 Ca 0.11 0.78 -0.38 0.00 -2.02 0.00 0.00 63.50 61.99 3dhu n PRO 319 Cb 0.49 -2.42 0.06 0.00 -0.02 0.00 0.00 33.50 31.61 3dhu n PRO 319 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3dhu n SER 320 N 1.32 1.95 0.03 2.55 2.88 -1.26 -4.93 113.62 116.15 3dhu n SER 320 Ca 0.07 0.87 0.12 0.00 -1.33 0.00 0.00 58.87 58.60 3dhu n SER 320 Cb 0.35 -1.52 0.30 0.00 -0.75 0.00 0.00 64.21 62.58 3dhu n SER 320 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 3dhu n LEU 321 N -1.35 0.51 -0.04 2.46 4.77 -1.26 -4.58 117.00 117.50 3dhu n LEU 321 Ca 0.14 0.21 -0.05 0.00 -0.03 0.00 0.00 56.01 56.28 3dhu n LEU 321 Cb 0.47 -0.27 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 3dhu n LEU 321 CO 0.50 0.02 -0.78 0.49 -1.33 0.00 0.00 177.39 176.28 3dhu n PHE 322 N -1.77 0.00 -4.29 -1.77 3.72 -1.26 -3.67 117.46 108.42 3dhu n PHE 322 Ca 0.05 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.23 3dhu n PHE 322 Cb 0.38 -0.39 -0.12 0.00 -0.94 0.00 0.00 39.48 38.41 3dhu n PHE 322 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 3dhu s ASP 323 N -4.24 2.46 0.13 4.37 1.01 -1.26 -1.36 116.67 117.78 3dhu s ASP 323 Ca -0.06 -0.76 -0.35 0.00 0.71 0.00 0.00 52.55 52.09 3dhu s ASP 323 Cb 0.03 -0.13 -0.16 0.00 1.01 0.00 0.00 42.92 43.67 3dhu s ASP 323 CO 0.30 -0.01 1.34 -1.14 0.21 0.00 0.00 175.17 175.88 3dhu n ARG 324 N 0.76 1.38 -2.91 8.23 0.63 -1.26 -4.60 116.66 118.88 3dhu n ARG 324 Ca -0.17 0.50 -0.13 0.00 -0.92 0.00 0.00 57.85 57.13 3dhu n ARG 324 Cb 0.55 -2.13 0.03 0.00 0.45 0.00 0.00 32.46 31.37 3dhu n ARG 324 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 3dhu n ASP 325 N 2.52 -0.44 -4.60 6.15 -0.08 -1.26 -4.95 116.55 113.88 3dhu n ASP 325 Ca 0.17 -3.14 -0.50 0.00 -1.51 0.00 0.00 54.79 49.81 3dhu n ASP 325 Cb 0.23 0.42 -0.05 0.00 2.34 0.00 0.00 41.12 44.06 3dhu n ASP 325 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 3dhu n THR 326 N 0.17 0.32 -0.30 5.18 -1.04 -1.26 -4.75 114.28 112.59 3dhu n THR 326 Ca 0.14 -0.08 0.10 0.00 -2.04 0.00 0.00 64.05 62.17 3dhu n THR 326 Cb 0.71 -0.98 0.28 0.00 -1.82 0.00 0.00 70.33 68.53 3dhu n THR 326 CO 0.00 0.00 0.00 1.15 -0.64 0.00 0.00 175.07 175.58 3dhu n MET 327 N 2.40 2.75 -0.19 -2.82 0.00 -0.49 -4.64 117.12 114.12 3dhu n MET 327 Ca 0.17 -2.51 -0.08 0.00 0.00 0.00 0.00 57.70 55.28 3dhu n MET 327 Cb 0.23 -1.50 0.02 0.00 0.00 0.00 0.00 33.22 31.97 3dhu n MET 327 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 3dhu h VAL 328 N 3.79 1.20 -0.00 3.17 2.07 -1.83 -2.49 116.25 122.15 3dhu h VAL 328 Ca 0.00 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.98 3dhu h VAL 328 Cb 0.93 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.28 3dhu h VAL 328 CO 0.00 0.22 -0.09 0.00 0.02 0.00 0.00 177.57 177.72 3dhu n ALA 329 N -2.31 2.68 -1.70 1.67 0.00 -1.26 -4.30 120.51 115.28 3dhu n ALA 329 Ca 0.03 -0.22 -0.37 0.00 0.00 0.00 0.00 53.44 52.87 3dhu n ALA 329 Cb 0.11 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.15 3dhu n ALA 329 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3dhu n ASP 330 N -1.12 8.03 -4.09 0.00 2.03 -0.94 -4.86 116.55 115.60 3dhu n ASP 330 Ca 0.14 -2.95 -0.25 0.00 0.52 0.00 0.00 54.79 52.24 3dhu n ASP 330 Cb 0.27 -1.41 -0.16 0.00 -0.72 0.00 0.00 41.12 39.10 3dhu n ASP 330 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 3dhu s ARG 331 N -0.11 1.77 -0.00 -0.67 0.52 -1.26 -3.77 118.95 115.42 3dhu s ARG 331 Ca 0.60 -0.53 0.00 0.00 -0.52 0.00 0.00 55.73 55.28 3dhu s ARG 331 Cb 0.20 -1.49 0.01 0.00 0.52 0.00 0.00 34.95 34.19 3dhu s ARG 331 CO -0.09 0.15 0.66 0.72 0.02 0.00 0.00 175.30 176.76 3dhu n HIS 332 N 3.42 0.00 -3.85 -0.53 8.25 0.35 -5.00 115.22 117.86 3dhu n HIS 332 Ca -0.20 -0.05 0.00 0.00 -0.26 0.00 0.00 57.72 57.21 3dhu n HIS 332 Cb 0.53 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.62 3dhu n HIS 332 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dhu n GLY 333 N -0.06 -1.14 3.17 -1.41 0.00 -1.11 -4.94 105.19 99.70 3dhu n GLY 333 Ca 0.00 -1.13 -0.05 0.00 0.00 0.00 0.00 46.02 44.84 3dhu n GLY 333 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dhu s ASP 334 N -4.00 -0.43 -0.22 1.61 3.68 -1.26 -4.32 116.67 111.72 3dhu s ASP 334 Ca 0.00 0.79 0.14 0.00 2.13 0.00 0.00 52.55 55.61 3dhu s ASP 334 Cb 0.00 1.56 0.56 0.00 -1.45 0.00 0.00 42.92 43.59 3dhu s ASP 334 CO 0.00 -0.26 1.48 1.33 0.13 0.00 0.00 175.17 177.86 3dhu n VAL 335 N 5.40 2.43 -0.12 1.11 0.24 -0.26 -4.74 118.33 122.40 3dhu n VAL 335 Ca -0.06 -2.02 -0.07 0.00 -2.04 0.00 0.00 64.34 60.15 3dhu n VAL 335 Cb 0.50 -0.28 -0.00 0.00 -1.47 0.00 0.00 33.84 32.58 3dhu n VAL 335 CO 0.00 0.00 0.00 0.74 -2.14 0.00 0.00 176.83 175.43 3dhu h THR 336 N 1.77 0.28 -0.89 3.34 2.02 -1.95 -1.25 112.91 116.23 3dhu h THR 336 Ca 0.08 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.35 3dhu h THR 336 Cb 1.61 0.28 -0.06 0.00 -1.74 0.00 0.00 68.15 68.24 3dhu h THR 336 CO 0.33 0.00 0.57 -0.65 0.37 0.00 0.00 175.52 176.14 3dhu h PRO 337 N -0.21 0.87 -0.17 6.66 0.11 -1.95 -0.24 132.00 137.06 3dhu h PRO 337 Ca 0.19 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 66.23 3dhu h PRO 337 Cb 0.51 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 3dhu h PRO 337 CO -0.53 0.57 0.07 1.25 -0.21 0.00 0.00 178.00 179.16 3dhu h LEU 338 N 0.89 0.23 -0.29 2.35 5.85 -1.75 -1.50 115.31 121.10 3dhu h LEU 338 Ca 0.41 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 3dhu h LEU 338 Cb 0.38 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 3dhu h LEU 338 CO -0.17 0.32 0.16 0.40 -0.34 0.00 0.00 178.44 178.81 3dhu h ILE 339 N 0.13 1.12 -0.82 4.05 2.04 -0.26 0.63 117.51 124.40 3dhu h ILE 339 Ca 0.06 -0.30 0.11 0.00 1.00 0.00 0.00 64.86 65.72 3dhu h ILE 339 Cb 0.16 0.80 -0.08 0.00 -0.74 0.00 0.00 36.82 36.96 3dhu h ILE 339 CO -0.01 0.12 0.45 1.56 0.00 0.00 0.00 178.15 180.28 3dhu h GLN 340 N 0.35 0.71 -0.33 2.37 4.20 -1.04 0.17 115.11 121.54 3dhu h GLN 340 Ca 0.10 -0.04 -0.17 0.00 0.06 0.00 0.00 58.65 58.60 3dhu h GLN 340 Cb 0.05 -0.16 -0.00 0.00 0.30 0.00 0.00 27.48 27.66 3dhu h GLN 340 CO -0.02 0.47 -0.46 -0.22 -0.67 0.00 0.00 178.83 177.93 3dhu h LYS 341 N 0.73 0.89 -0.71 1.46 1.63 -0.84 -1.69 116.57 118.04 3dhu h LYS 341 Ca 0.41 -0.51 -0.05 0.00 -0.85 0.00 0.00 60.65 59.65 3dhu h LYS 341 Cb 0.43 0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 32.07 3dhu h LYS 341 CO -0.28 1.15 0.24 -0.07 -3.45 0.00 0.00 179.45 177.05 3dhu h LEU 342 N 0.71 1.00 -1.03 5.20 3.38 -0.37 -2.56 115.31 121.63 3dhu h LEU 342 Ca 0.04 -0.17 0.03 0.00 0.09 0.00 0.00 57.88 57.87 3dhu h LEU 342 Cb 1.06 -0.26 -0.06 0.00 0.09 0.00 0.00 40.66 41.49 3dhu h LEU 342 CO 0.11 0.92 0.65 0.58 0.09 0.00 0.00 178.44 180.78 3dhu h VAL 343 N 1.05 1.19 -0.36 1.22 2.07 -0.37 0.21 116.25 121.25 3dhu h VAL 343 Ca 0.23 -0.43 -0.10 0.00 0.82 0.00 0.00 66.70 67.22 3dhu h VAL 343 Cb 0.26 -0.19 -0.02 0.00 -1.52 0.00 0.00 31.29 29.82 3dhu h VAL 343 CO -0.01 0.23 -0.17 0.71 0.02 0.00 0.00 177.57 178.35 3dhu h THR 344 N 1.26 1.26 -0.15 2.57 1.35 -0.92 -2.39 112.91 115.89 3dhu h THR 344 Ca 0.39 -1.21 -0.08 0.00 -0.55 0.00 0.00 66.41 64.96 3dhu h THR 344 Cb -0.02 1.17 -0.00 0.00 -1.73 0.00 0.00 68.15 67.57 3dhu h THR 344 CO -0.12 0.40 -0.21 0.40 -0.25 0.00 0.00 175.52 175.74 3dhu h ILE 345 N 0.60 1.35 -0.20 6.82 2.04 -1.20 -3.25 117.51 123.68 3dhu h ILE 345 Ca 0.10 -1.42 0.06 0.00 1.00 0.00 0.00 64.86 64.59 3dhu h ILE 345 Cb 0.63 1.92 -0.01 0.00 -0.74 0.00 0.00 36.82 38.62 3dhu h ILE 345 CO 0.04 0.42 0.23 0.50 0.00 0.00 0.00 178.15 179.35 3dhu h LYS 346 N 0.04 0.00 0.00 2.37 1.63 -0.28 -1.18 116.57 119.15 3dhu h LYS 346 Ca 0.02 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.82 3dhu h LYS 346 Cb 0.77 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.40 3dhu h LYS 346 CO 0.05 0.00 0.00 1.96 -3.45 0.00 0.00 179.45 178.01 3dhu h GLN 347 N 0.00 0.00 -6.91 1.90 4.20 -1.46 -3.38 115.11 109.46 3dhu h GLN 347 Ca 0.09 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.27 3dhu h GLN 347 Cb 0.55 0.00 0.09 0.00 0.30 0.00 0.00 27.48 28.42 3dhu h GLN 347 CO -0.00 0.00 0.74 -0.51 -0.67 0.00 0.00 178.83 178.39 3dhu s LEU 348 N -5.74 4.36 0.51 1.46 1.43 -0.45 -4.90 118.68 115.35 3dhu s LEU 348 Ca 0.03 2.91 0.21 0.00 -1.03 0.00 0.00 54.13 56.26 3dhu s LEU 348 Cb 0.09 -3.66 1.29 0.00 0.03 0.00 0.00 46.19 43.94 3dhu s LEU 348 CO 0.54 -0.76 2.01 -0.65 0.23 0.00 0.00 176.35 177.73 3dhu h PRO 349 N 3.30 0.09 -0.27 1.29 0.11 -1.90 -1.93 132.00 132.69 3dhu h PRO 349 Ca -0.50 -0.01 0.08 0.00 0.11 0.00 0.00 66.00 65.69 3dhu h PRO 349 Cb 1.23 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 3dhu h PRO 349 CO 0.66 0.06 0.23 -0.07 -0.21 0.00 0.00 178.00 178.67 3dhu h LEU 350 N 0.09 0.00 -2.23 2.35 3.38 -1.95 -1.37 115.31 115.59 3dhu h LEU 350 Ca 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 3dhu h LEU 350 Cb 0.77 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 3dhu h LEU 350 CO -0.02 0.00 -0.05 -0.07 0.09 0.00 0.00 178.44 178.38 3dhu h LEU 351 N 0.00 0.00 -0.58 1.67 -0.00 -1.65 -0.34 115.31 114.41 3dhu h LEU 351 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.01 3dhu h LEU 351 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.24 3dhu h LEU 351 CO -0.00 0.05 -0.04 0.54 -0.00 0.00 0.00 178.44 179.00 3dhu n ARG 352 N -3.51 1.29 -1.91 1.13 1.74 -0.52 -4.83 116.66 110.05 3dhu n ARG 352 Ca -0.02 -0.58 -0.40 0.00 -0.77 0.00 0.00 57.85 56.08 3dhu n ARG 352 Cb 0.17 -1.49 0.01 0.00 -1.02 0.00 0.00 32.46 30.13 3dhu n ARG 352 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dhu s ALA 353 N -2.11 3.28 0.19 7.54 0.00 -0.14 -4.92 121.76 125.60 3dhu s ALA 353 Ca 0.38 1.37 -0.02 0.00 0.00 0.00 0.00 51.96 53.69 3dhu s ALA 353 Cb 0.21 -3.55 0.12 0.00 0.00 0.00 0.00 23.12 19.90 3dhu s ALA 353 CO 0.38 -1.02 1.50 0.00 0.00 0.00 0.00 175.76 176.62 3dhu h ALA 354 N 2.54 0.69 -1.35 0.00 0.00 -1.89 -3.39 119.26 115.86 3dhu h ALA 354 Ca -0.50 -0.53 -0.56 0.00 0.00 0.00 0.00 54.91 53.32 3dhu h ALA 354 Cb 1.25 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 18.88 3dhu h ALA 354 CO 0.62 0.70 1.09 0.34 0.00 0.00 0.00 179.25 182.00 3dhu s ASP 355 N -6.93 6.24 -0.08 0.00 -1.08 -1.25 -4.96 116.67 108.60 3dhu s ASP 355 Ca -0.07 -0.72 0.03 0.00 -0.52 0.00 0.00 52.55 51.27 3dhu s ASP 355 Cb 0.11 -2.55 0.01 0.00 -1.46 0.00 0.00 42.92 39.03 3dhu s ASP 355 CO 0.84 -1.73 -0.17 -0.47 0.52 0.00 0.00 175.17 174.16 3dhu s TYR 356 N 5.38 1.91 0.01 -5.34 5.04 -1.26 -1.10 117.35 122.00 3dhu s TYR 356 Ca 0.36 -0.76 0.04 0.00 -2.44 0.00 0.00 57.07 54.26 3dhu s TYR 356 Cb -0.07 -1.34 -0.01 0.00 0.35 0.00 0.00 41.96 40.89 3dhu s TYR 356 CO 0.09 -0.35 -0.12 -0.65 -1.34 0.00 0.00 175.55 173.19 3dhu s GLN 357 N 0.57 0.87 -0.05 4.97 -1.52 0.25 -4.99 119.66 119.77 3dhu s GLN 357 Ca -0.16 -0.53 0.05 0.00 -1.95 0.00 0.00 55.36 52.78 3dhu s GLN 357 Cb -0.17 -0.84 -0.02 0.00 -0.22 0.00 0.00 33.01 31.76 3dhu s GLN 357 CO 0.05 0.22 -0.21 -0.51 -0.25 0.00 0.00 175.29 174.60 3dhu s LEU 358 N -0.61 2.34 0.03 2.90 1.43 -1.26 -0.94 118.68 122.56 3dhu s LEU 358 Ca 0.02 -0.37 -0.04 0.00 -1.03 0.00 0.00 54.13 52.72 3dhu s LEU 358 Cb -0.06 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.71 3dhu s LEU 358 CO 0.00 0.30 0.05 0.00 0.23 0.00 0.00 176.35 176.93 3dhu s ALA 359 N -0.50 0.02 -0.26 4.21 0.00 0.11 -4.99 121.76 120.35 3dhu s ALA 359 Ca 0.06 -0.57 -0.11 0.00 0.00 0.00 0.00 51.96 51.35 3dhu s ALA 359 Cb -0.11 0.20 -0.05 0.00 0.00 0.00 0.00 23.12 23.15 3dhu s ALA 359 CO 0.01 -0.25 0.17 0.08 0.00 0.00 0.00 175.76 175.76 3dhu s VAL 360 N -2.18 5.29 0.00 0.00 1.01 -1.26 -0.09 120.40 123.17 3dhu s VAL 360 Ca -0.09 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.05 3dhu s VAL 360 Cb -0.04 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.85 3dhu s VAL 360 CO -0.03 0.30 0.00 1.33 0.00 0.00 0.00 175.10 176.70 3dhu n VAL 361 N 4.67 0.00 -1.66 2.92 0.24 0.48 -4.97 118.33 120.01 3dhu n VAL 361 Ca -0.15 0.00 -0.44 0.00 -2.04 0.00 0.00 64.34 61.71 3dhu n VAL 361 Cb 0.52 -0.00 -0.02 0.00 -1.47 0.00 0.00 33.84 32.87 3dhu n VAL 361 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3dhu n GLU 362 N 0.00 1.90 -1.67 7.34 4.71 -1.26 -1.39 120.64 130.27 3dhu n GLU 362 Ca 0.00 0.67 -0.14 0.00 -0.01 0.00 0.00 57.16 57.68 3dhu n GLU 362 Cb 0.00 -2.23 -0.05 0.00 -1.01 0.00 0.00 31.44 28.15 3dhu n GLU 362 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 3dhu n GLU 363 N 1.18 -1.51 -1.09 3.49 1.02 -1.26 -1.13 120.64 121.33 3dhu n GLU 363 Ca 0.09 0.78 -0.03 0.00 -0.02 0.00 0.00 57.16 57.98 3dhu n GLU 363 Cb 0.33 -5.13 -0.01 0.00 -0.02 0.00 0.00 31.44 26.60 3dhu n GLU 363 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dhu n GLY 364 N -0.41 0.63 3.75 0.62 0.00 -0.49 -4.96 105.19 104.34 3dhu n GLY 364 Ca -0.15 -0.55 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 3dhu n GLY 364 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3dhu n ILE 365 N -2.83 3.30 -3.61 -0.61 5.41 -0.28 -4.79 119.36 115.95 3dhu n ILE 365 Ca -0.03 -0.50 -0.36 0.00 1.00 0.00 0.00 62.75 62.86 3dhu n ILE 365 Cb 0.14 -1.76 -0.08 0.00 -0.71 0.00 0.00 39.64 37.24 3dhu n ILE 365 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 3dhu s VAL 366 N -1.24 5.34 -0.23 1.39 1.01 -0.71 -0.39 120.40 125.58 3dhu s VAL 366 Ca 0.66 0.39 -0.05 0.00 0.00 0.00 0.00 61.98 62.98 3dhu s VAL 366 Cb -0.43 -3.57 -0.02 0.00 0.00 0.00 0.00 36.38 32.36 3dhu s VAL 366 CO 0.53 0.39 -0.00 -0.75 0.00 0.00 0.00 175.10 175.27 3dhu s LYS 367 N 0.57 3.48 -0.13 2.72 2.20 0.87 -0.43 119.74 129.02 3dhu s LYS 367 Ca 0.13 -0.57 -0.05 0.00 -0.36 0.00 0.00 55.97 55.12 3dhu s LYS 367 Cb -0.12 -3.12 -0.04 0.00 -1.51 0.00 0.00 37.83 33.04 3dhu s LYS 367 CO 0.02 -0.19 0.06 0.42 -0.36 0.00 0.00 175.35 175.30 3dhu s ILE 368 N 1.51 4.76 -0.05 5.43 1.01 -0.13 -0.71 121.20 133.03 3dhu s ILE 368 Ca 0.06 -0.06 0.01 0.00 0.00 0.00 0.00 60.65 60.65 3dhu s ILE 368 Cb -0.15 -3.07 0.02 0.00 0.01 0.00 0.00 42.46 39.28 3dhu s ILE 368 CO -0.01 0.56 -0.04 -0.89 0.00 0.00 0.00 174.94 174.56 3dhu s THR 369 N -0.49 0.55 -0.11 2.92 2.01 -0.12 -0.73 115.64 119.66 3dhu s THR 369 Ca 0.10 -0.12 -0.02 0.00 0.31 0.00 0.00 61.69 61.96 3dhu s THR 369 Cb -0.12 -0.58 -0.03 0.00 0.01 0.00 0.00 72.50 71.78 3dhu s THR 369 CO 0.02 0.23 -0.03 -0.31 -0.69 0.00 0.00 174.62 173.84 3dhu s TYR 370 N 0.99 3.04 -0.06 4.92 2.02 -0.39 -0.58 117.35 127.29 3dhu s TYR 370 Ca -0.10 -0.08 0.03 0.00 -0.37 0.00 0.00 57.07 56.55 3dhu s TYR 370 Cb -0.14 -1.85 0.01 0.00 -0.40 0.00 0.00 41.96 39.57 3dhu s TYR 370 CO -0.00 0.20 -0.14 1.03 -1.57 0.00 0.00 175.55 175.06 3dhu s ARG 371 N -0.27 1.75 -0.27 -0.62 0.52 -0.26 -1.48 118.95 118.33 3dhu s ARG 371 Ca 0.05 -0.49 -0.24 0.00 -0.52 0.00 0.00 55.73 54.52 3dhu s ARG 371 Cb -0.13 -1.46 0.07 0.00 0.52 0.00 0.00 34.95 33.95 3dhu s ARG 371 CO 0.02 0.11 0.73 0.00 0.02 0.00 0.00 175.30 176.19 3dhu s ALA 372 N 0.41 -1.80 -1.35 2.13 0.00 -0.39 -3.97 121.76 116.80 3dhu s ALA 372 Ca -0.11 2.06 -0.01 0.00 0.00 0.00 0.00 51.96 53.90 3dhu s ALA 372 Cb -0.14 -1.22 0.01 0.00 0.00 0.00 0.00 23.12 21.77 3dhu s ALA 372 CO 0.03 -0.34 0.67 0.00 0.00 0.00 0.00 175.76 176.12 3dhu n ALA 373 N 2.81 -1.95 -1.10 0.00 0.00 -1.26 -1.35 120.51 117.66 3dhu n ALA 373 Ca -0.14 -0.16 -0.03 0.00 0.00 0.00 0.00 53.44 53.10 3dhu n ALA 373 Cb 0.55 -2.06 -0.01 0.00 0.00 0.00 0.00 19.45 17.93 3dhu n ALA 373 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dhu n GLY 374 N -1.66 0.54 3.32 0.00 0.00 -1.26 -5.00 105.19 101.14 3dhu n GLY 374 Ca -0.27 -0.15 -0.18 0.00 0.00 0.00 0.00 46.02 45.41 3dhu n GLY 374 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dhu s GLU 375 N -1.66 1.26 0.02 1.61 2.02 -0.46 -4.51 118.70 116.98 3dhu s GLU 375 Ca 0.00 -1.52 -0.05 0.00 0.02 0.00 0.00 54.97 53.42 3dhu s GLU 375 Cb 0.00 -1.05 -0.01 0.00 0.10 0.00 0.00 34.13 33.17 3dhu s GLU 375 CO 0.00 0.18 0.08 0.00 0.02 0.00 0.00 175.26 175.54 3dhu s ALA 376 N -2.86 -0.12 -0.10 5.21 0.00 0.59 -1.26 121.76 123.22 3dhu s ALA 376 Ca 0.20 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.79 3dhu s ALA 376 Cb -0.01 0.16 0.01 0.00 0.00 0.00 0.00 23.12 23.28 3dhu s ALA 376 CO 0.06 -0.23 -0.19 -1.17 0.00 0.00 0.00 175.76 174.23 3dhu s LEU 377 N -1.64 1.91 -0.09 0.00 2.96 -0.55 -0.52 118.68 120.75 3dhu s LEU 377 Ca -0.12 -0.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.35 3dhu s LEU 377 Cb -0.06 -1.21 -0.01 0.00 0.50 0.00 0.00 46.19 45.41 3dhu s LEU 377 CO -0.01 0.08 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.01 3dhu s THR 378 N 0.66 2.43 -0.20 3.68 2.01 -0.47 -1.27 115.64 122.49 3dhu s THR 378 Ca -0.13 -0.91 -0.01 0.00 0.31 0.00 0.00 61.69 60.96 3dhu s THR 378 Cb -0.16 -1.95 0.01 0.00 0.01 0.00 0.00 72.50 70.41 3dhu s THR 378 CO 0.03 0.56 -0.14 0.00 -0.69 0.00 0.00 174.62 174.38 3dhu s ALA 379 N 0.07 2.53 -0.37 7.40 0.00 0.09 -0.80 121.76 130.67 3dhu s ALA 379 Ca -0.09 -1.21 -0.20 0.00 0.00 0.00 0.00 51.96 50.46 3dhu s ALA 379 Cb -0.15 -1.40 0.01 0.00 0.00 0.00 0.00 23.12 21.58 3dhu s ALA 379 CO 0.06 -0.40 0.61 -1.58 0.00 0.00 0.00 175.76 174.44 3dhu s TRP 380 N 1.36 3.14 -0.29 0.00 0.51 0.67 -0.95 118.94 123.38 3dhu s TRP 380 Ca 0.05 0.21 0.01 0.00 -2.12 0.00 0.00 56.10 54.25 3dhu s TRP 380 Cb -0.14 -3.13 0.06 0.00 -0.81 0.00 0.00 33.47 29.45 3dhu s TRP 380 CO -0.09 -0.66 -0.04 0.42 -0.51 0.00 0.00 176.95 176.06 3dhu s ILE 381 N 2.65 2.49 -1.12 2.03 1.01 0.43 -1.22 121.20 127.46 3dhu s ILE 381 Ca 0.22 -1.67 -0.15 0.00 0.00 0.00 0.00 60.65 59.05 3dhu s ILE 381 Cb -0.15 -2.51 0.16 0.00 0.01 0.00 0.00 42.46 39.97 3dhu s ILE 381 CO 0.15 -0.16 1.33 -2.16 0.00 0.00 0.00 174.94 174.11 3dhu s PRO 382 N 1.12 3.94 0.56 2.79 0.04 -1.26 -1.73 135.00 140.46 3dhu s PRO 382 Ca -0.05 -2.35 0.26 0.00 0.04 0.00 0.00 61.00 58.90 3dhu s PRO 382 Cb -0.20 -5.00 1.54 0.00 0.04 0.00 0.00 34.50 30.87 3dhu s PRO 382 CO -0.04 -1.75 2.10 -0.07 0.04 0.00 0.00 177.00 177.27 3dhu h LEU 383 N 9.85 0.00 -2.85 -3.56 3.38 -1.91 0.73 115.31 120.95 3dhu h LEU 383 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3dhu h LEU 383 Cb 0.92 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.67 3dhu h LEU 383 CO 1.19 0.00 0.00 0.29 0.09 0.00 0.00 178.44 180.01 3dhu n LYS 384 N -4.07 2.89 -1.48 1.13 4.76 -1.26 -4.86 118.16 115.27 3dhu n LYS 384 Ca 0.02 -2.49 -0.03 0.00 -2.87 0.00 0.00 58.31 52.94 3dhu n LYS 384 Cb 0.32 -1.51 -0.01 0.00 -1.84 0.00 0.00 35.03 31.99 3dhu n LYS 384 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dhu n GLY 385 N 1.15 0.46 3.76 0.72 0.00 0.25 -4.99 105.19 106.54 3dhu n GLY 385 Ca 0.20 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.93 3dhu n GLY 385 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dhu s GLN 386 N -3.01 4.22 -0.22 1.61 1.11 -1.26 -4.27 119.66 117.84 3dhu s GLN 386 Ca 0.00 2.40 0.02 0.00 0.01 0.00 0.00 55.36 57.79 3dhu s GLN 386 Cb 0.00 -3.05 0.04 0.00 -1.01 0.00 0.00 33.01 28.99 3dhu s GLN 386 CO 0.00 -0.44 -0.15 0.08 0.01 0.00 0.00 175.29 174.78 3dhu s VAL 387 N -0.49 2.12 -0.08 1.09 1.01 -1.26 -1.15 120.40 121.64 3dhu s VAL 387 Ca 0.57 -1.30 -0.31 0.00 0.00 0.00 0.00 61.98 60.93 3dhu s VAL 387 Cb -0.44 -2.08 0.12 0.00 0.00 0.00 0.00 36.38 33.98 3dhu s VAL 387 CO 0.51 0.24 1.01 0.28 0.00 0.00 0.00 175.10 177.14 3dhu s THR 388 N 1.19 0.00 0.35 3.92 -1.32 -0.60 -4.98 115.64 114.21 3dhu s THR 388 Ca -0.02 0.00 -0.25 0.00 -1.21 0.00 0.00 61.69 60.21 3dhu s THR 388 Cb -0.17 -1.00 -0.10 0.00 -1.51 0.00 0.00 72.50 69.73 3dhu s THR 388 CO -0.09 0.00 0.98 0.00 -2.21 0.00 0.00 174.62 173.30 3dhu s ALA 389 N -2.68 3.17 0.07 11.08 0.00 -1.26 -0.80 121.76 131.34 3dhu s ALA 389 Ca 0.06 0.57 0.08 0.00 0.00 0.00 0.00 51.96 52.67 3dhu s ALA 389 Cb -0.01 -3.21 -0.03 0.00 0.00 0.00 0.00 23.12 19.87 3dhu s ALA 389 CO -0.07 0.06 -0.22 0.14 0.00 0.00 0.00 175.76 175.67 3dhu s VAL 390 N -1.67 1.77 0.34 0.00 -7.23 0.13 -4.90 120.40 108.85 3dhu s VAL 390 Ca 0.53 -1.38 -0.24 0.00 -1.81 0.00 0.00 61.98 59.08 3dhu s VAL 390 Cb -0.19 -1.56 -0.10 0.00 0.56 0.00 0.00 36.38 35.09 3dhu s VAL 390 CO 0.24 0.12 0.92 0.00 -0.31 0.00 0.00 175.10 176.07 3dhu s ALA 391 N -0.95 3.19 0.03 1.32 0.00 -1.26 -0.98 121.76 123.12 3dhu s ALA 391 Ca 0.08 0.45 -0.14 0.00 0.00 0.00 0.00 51.96 52.35 3dhu s ALA 391 Cb -0.09 -3.14 0.02 0.00 0.00 0.00 0.00 23.12 19.91 3dhu s ALA 391 CO 0.03 0.18 0.30 -0.08 0.00 0.00 0.00 175.76 176.19 3dhu s THR 392 N -1.76 0.08 -2.33 0.00 -1.32 -0.55 -4.90 115.64 104.86 3dhu s THR 392 Ca 0.53 -0.65 0.22 0.00 -1.21 0.00 0.00 61.69 60.57 3dhu s THR 392 Cb -0.16 -0.88 0.47 0.00 -1.51 0.00 0.00 72.50 70.42 3dhu s THR 392 CO 0.21 -0.36 1.44 0.29 -2.21 0.00 0.00 174.62 173.99 3dhu n LYS 393 N 0.70 2.44 -2.07 7.08 5.02 -1.26 -4.41 118.16 125.65 3dhu n LYS 393 Ca -0.19 -2.19 -0.40 0.00 -2.02 0.00 0.00 58.31 53.51 3dhu n LYS 393 Cb 0.59 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 34.09 3dhu n LYS 393 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3dhu s LEU 394 N -1.36 4.25 0.66 -0.35 1.43 -1.26 -5.00 118.68 117.05 3dhu s LEU 394 Ca 0.40 2.65 -0.17 0.00 -1.03 0.00 0.00 54.13 55.98 3dhu s LEU 394 Cb 0.22 -3.86 -0.00 0.00 0.03 0.00 0.00 46.19 42.58 3dhu s LEU 394 CO 0.31 -0.78 1.22 0.00 0.23 0.00 0.00 176.35 177.32 3dhu s ALA 395 N -1.24 2.35 0.69 4.21 0.00 -1.26 -4.64 121.76 121.87 3dhu s ALA 395 Ca 0.55 0.98 -0.17 0.00 0.00 0.00 0.00 51.96 53.33 3dhu s ALA 395 Cb -0.38 -3.47 0.01 0.00 0.00 0.00 0.00 23.12 19.27 3dhu s ALA 395 CO 0.49 -1.52 1.14 0.00 0.00 0.00 0.00 175.76 175.87 3dhu n ALA 396 N -2.12 0.40 0.00 0.00 0.00 -1.26 -4.82 120.51 112.71 3dhu n ALA 396 Ca 0.14 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3dhu n ALA 396 Cb 0.50 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.72 3dhu n ALA 396 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dhu n GLY 397 N 0.96 0.92 3.66 0.00 0.00 -0.26 -4.94 105.19 105.52 3dhu n GLY 397 Ca 0.14 -1.98 -0.36 0.00 0.00 0.00 0.00 46.02 43.82 3dhu n GLY 397 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dhu s SER 398 N -2.70 6.01 0.26 1.61 0.15 -1.26 -0.26 113.70 117.51 3dhu s SER 398 Ca 0.00 0.11 0.11 0.00 0.70 0.00 0.00 55.95 56.88 3dhu s SER 398 Cb 0.00 -2.07 -0.05 0.00 -1.71 0.00 0.00 66.02 62.19 3dhu s SER 398 CO 0.00 0.10 -0.16 -0.31 1.20 0.00 0.00 173.24 174.07 3dhu s TYR 399 N 0.83 2.40 -0.28 3.44 2.02 -0.26 -4.90 117.35 120.61 3dhu s TYR 399 Ca 0.07 -0.30 -0.21 0.00 -0.37 0.00 0.00 57.07 56.26 3dhu s TYR 399 Cb -0.13 -1.08 -0.01 0.00 -0.40 0.00 0.00 41.96 40.34 3dhu s TYR 399 CO 0.02 0.65 0.66 -1.14 -1.57 0.00 0.00 175.55 174.17 3dhu s GLN 400 N -3.37 4.01 -0.45 -0.62 0.74 -1.26 0.02 119.66 118.73 3dhu s GLN 400 Ca 0.29 0.46 -0.28 0.00 0.05 0.00 0.00 55.36 55.88 3dhu s GLN 400 Cb -0.06 -3.69 -0.00 0.00 1.10 0.00 0.00 33.01 30.35 3dhu s GLN 400 CO 0.15 -0.51 1.63 1.21 -0.55 0.00 0.00 175.29 177.22 3dhu s ASN 401 N 1.55 5.94 0.55 6.67 3.84 -0.40 -4.52 114.94 128.58 3dhu s ASN 401 Ca 0.27 0.79 0.30 0.00 0.21 0.00 0.00 52.86 54.43 3dhu s ASN 401 Cb -0.15 -2.53 1.46 0.00 -0.55 0.00 0.00 41.25 39.48 3dhu s ASN 401 CO 0.10 -1.76 1.90 -0.07 -2.79 0.00 0.00 177.10 174.48 3dhu h LEU 402 N 13.67 0.00 -0.29 3.21 4.07 -1.15 0.65 115.31 135.47 3dhu h LEU 402 Ca -0.29 0.00 -0.18 0.00 0.08 0.00 0.00 57.88 57.49 3dhu h LEU 402 Cb 1.13 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.88 3dhu h LEU 402 CO 1.11 0.00 -0.52 0.25 -1.08 0.00 0.00 178.44 178.20 3dhu h LEU 403 N 0.00 0.96 0.00 1.67 5.85 -1.90 -3.34 115.31 118.55 3dhu h LEU 403 Ca 0.35 -0.53 0.00 0.00 0.84 0.00 0.00 57.88 58.54 3dhu h LEU 403 Cb 1.49 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.24 3dhu h LEU 403 CO -0.00 1.30 -1.32 0.35 -0.34 0.00 0.00 178.44 178.43 3dhu n THR 404 N -4.04 0.00 -2.08 1.05 -2.24 -0.84 -4.97 114.28 101.16 3dhu n THR 404 Ca -0.04 -0.28 -0.20 0.00 -2.27 0.00 0.00 64.05 61.26 3dhu n THR 404 Cb 0.61 0.45 -0.04 0.00 -2.10 0.00 0.00 70.33 69.25 3dhu n THR 404 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3dhu n ASP 405 N -1.77 -5.62 -4.77 3.42 8.00 0.22 -5.01 116.55 111.02 3dhu n ASP 405 Ca -0.01 0.18 -0.27 0.00 0.71 0.00 0.00 54.79 55.39 3dhu n ASP 405 Cb 0.32 -4.74 -0.06 0.00 -0.02 0.00 0.00 41.12 36.62 3dhu n ASP 405 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 3dhu s GLY 406 N -2.35 1.78 0.52 0.44 0.00 -1.22 -4.88 107.32 101.61 3dhu s GLY 406 Ca 0.00 -1.20 -0.21 0.00 0.00 0.00 0.00 44.72 43.32 3dhu s GLY 406 CO 0.00 -1.20 1.15 2.56 0.00 0.00 0.00 173.10 175.61 3dhu s PRO 407 N -2.91 3.48 -0.10 2.90 0.04 -1.26 -1.27 135.00 135.87 3dhu s PRO 407 Ca 0.30 1.69 -0.01 0.00 0.04 0.00 0.00 61.00 63.02 3dhu s PRO 407 Cb -0.10 -2.15 0.03 0.00 0.04 0.00 0.00 34.50 32.32 3dhu s PRO 407 CO 0.22 -0.77 -0.02 0.99 0.04 0.00 0.00 177.00 177.47 3dhu s THR 408 N -1.67 0.61 -0.19 1.26 2.01 0.10 -4.82 115.64 112.94 3dhu s THR 408 Ca 0.70 -0.12 -0.22 0.00 0.31 0.00 0.00 61.69 62.36 3dhu s THR 408 Cb -0.26 -0.78 -0.02 0.00 0.01 0.00 0.00 72.50 71.45 3dhu s THR 408 CO 0.30 0.22 0.69 -1.61 -0.69 0.00 0.00 174.62 173.53 3dhu s GLU 409 N 1.87 4.23 -0.24 4.92 0.41 -1.26 -1.10 118.70 127.52 3dhu s GLU 409 Ca 0.04 0.73 -0.15 0.00 -0.41 0.00 0.00 54.97 55.17 3dhu s GLU 409 Cb -0.13 -3.58 -0.04 0.00 -1.78 0.00 0.00 34.13 28.60 3dhu s GLU 409 CO -0.07 -0.28 0.39 0.08 -0.49 0.00 0.00 175.26 174.90 3dhu s VAL 410 N 2.02 5.18 -0.07 2.63 1.01 0.64 -4.36 120.40 127.44 3dhu s VAL 410 Ca 0.31 0.64 -0.00 0.00 0.00 0.00 0.00 61.98 62.93 3dhu s VAL 410 Cb -0.16 -3.72 0.02 0.00 0.00 0.00 0.00 36.38 32.53 3dhu s VAL 410 CO 0.11 0.19 -0.03 -0.69 0.00 0.00 0.00 175.10 174.67 3dhu s VAL 411 N 1.80 0.59 -1.47 2.92 1.01 0.18 -1.10 120.40 124.33 3dhu s VAL 411 Ca 0.17 -0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.06 3dhu s VAL 411 Cb -0.15 -0.67 0.02 0.00 0.00 0.00 0.00 36.38 35.58 3dhu s VAL 411 CO 0.09 0.28 0.39 0.47 0.00 0.00 0.00 175.10 176.32 3dhu n ASP 412 N 4.70 -0.43 -1.60 3.32 8.00 -1.26 -1.59 116.55 127.68 3dhu n ASP 412 Ca -0.14 -1.05 -0.14 0.00 0.71 0.00 0.00 54.79 54.16 3dhu n ASP 412 Cb 0.50 -2.77 -0.01 0.00 -0.02 0.00 0.00 41.12 38.83 3dhu n ASP 412 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dhu n GLY 413 N -2.02 -0.12 3.15 0.44 0.00 -1.26 -4.98 105.19 100.40 3dhu n GLY 413 Ca -0.27 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.34 3dhu n GLY 413 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dhu s LYS 414 N -4.63 0.37 0.06 1.61 1.02 -0.62 -1.48 119.74 116.07 3dhu s LYS 414 Ca 0.00 0.21 0.05 0.00 0.02 0.00 0.00 55.97 56.25 3dhu s LYS 414 Cb 0.00 0.17 -0.03 0.00 -0.52 0.00 0.00 37.83 37.46 3dhu s LYS 414 CO 0.00 -0.06 -0.14 -1.17 -0.92 0.00 0.00 175.35 173.06 3dhu s LEU 415 N -0.20 2.24 -0.21 3.17 0.20 -0.15 -0.65 118.68 123.08 3dhu s LEU 415 Ca -0.03 -0.56 -0.20 0.00 0.69 0.00 0.00 54.13 54.02 3dhu s LEU 415 Cb -0.03 -0.51 -0.02 0.00 -0.43 0.00 0.00 46.19 45.19 3dhu s LEU 415 CO 0.01 -0.05 0.62 -0.89 -0.29 0.00 0.00 176.35 175.74 3dhu s THR 416 N -1.15 5.02 -0.34 3.68 2.01 -1.26 0.23 115.64 123.83 3dhu s THR 416 Ca -0.02 1.14 -0.12 0.00 0.31 0.00 0.00 61.69 63.01 3dhu s THR 416 Cb -0.09 -3.93 -0.01 0.00 0.01 0.00 0.00 72.50 68.48 3dhu s THR 416 CO 0.02 0.10 0.21 -0.69 -0.69 0.00 0.00 174.62 173.56 3dhu s VAL 417 N 2.04 4.97 -0.77 3.82 1.01 0.02 -4.96 120.40 126.52 3dhu s VAL 417 Ca 0.27 -0.38 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 3dhu s VAL 417 Cb -0.16 -3.58 0.37 0.00 0.00 0.00 0.00 36.38 33.02 3dhu s VAL 417 CO 0.10 -0.02 2.05 -0.67 0.00 0.00 0.00 175.10 176.56 3dhu n ASP 418 N 5.05 7.56 0.00 3.32 2.03 -1.26 -1.55 116.55 131.70 3dhu n ASP 418 Ca -0.13 -3.80 0.00 0.00 0.52 0.00 0.00 54.79 51.38 3dhu n ASP 418 Cb 0.49 -1.04 0.00 0.00 -0.72 0.00 0.00 41.12 39.85 3dhu n ASP 418 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3dhu n GLY 419 N -0.62 0.40 3.08 0.27 0.00 -0.30 -4.90 105.19 103.12 3dhu n GLY 419 Ca 0.57 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.50 3dhu n GLY 419 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3dhu s GLN 420 N -0.49 0.58 0.56 1.61 -1.52 -1.26 -4.42 119.66 114.73 3dhu s GLN 420 Ca 0.00 -1.09 -0.20 0.00 -1.95 0.00 0.00 55.36 52.12 3dhu s GLN 420 Cb 0.00 0.11 -0.04 0.00 -0.22 0.00 0.00 33.01 32.86 3dhu s GLN 420 CO 0.00 -0.08 1.22 -2.14 -0.25 0.00 0.00 175.29 174.04 3dhu s PRO 421 N -3.31 3.13 -0.18 2.91 0.02 -1.26 -4.72 135.00 131.59 3dhu s PRO 421 Ca 0.02 1.86 0.01 0.00 0.02 0.00 0.00 61.00 62.91 3dhu s PRO 421 Cb 0.03 -2.04 0.03 0.00 0.02 0.00 0.00 34.50 32.54 3dhu s PRO 421 CO -0.07 -1.09 -0.16 0.08 -0.33 0.00 0.00 177.00 175.43 3dhu s VAL 422 N -1.56 1.89 -0.24 3.83 1.01 -0.36 -4.88 120.40 120.10 3dhu s VAL 422 Ca 0.74 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 61.75 3dhu s VAL 422 Cb -0.31 -1.79 0.02 0.00 0.00 0.00 0.00 36.38 34.30 3dhu s VAL 422 CO 0.35 0.39 -0.06 -0.76 0.00 0.00 0.00 175.10 175.02 3dhu s LEU 423 N 1.33 3.11 -0.11 3.92 1.02 -1.26 -0.23 118.68 126.45 3dhu s LEU 423 Ca 0.02 -0.79 0.01 0.00 0.02 0.00 0.00 54.13 53.40 3dhu s LEU 423 Cb -0.14 -1.67 0.02 0.00 0.02 0.00 0.00 46.19 44.41 3dhu s LEU 423 CO -0.11 -0.11 -0.14 -0.63 0.02 0.00 0.00 176.35 175.39 3dhu s ILE 424 N 1.35 1.43 -0.11 -0.59 1.01 0.02 -0.57 121.20 123.73 3dhu s ILE 424 Ca 0.01 -0.59 -0.13 0.00 0.00 0.00 0.00 60.65 59.95 3dhu s ILE 424 Cb -0.16 -1.33 -0.05 0.00 0.01 0.00 0.00 42.46 40.93 3dhu s ILE 424 CO -0.05 0.43 0.30 -0.75 0.00 0.00 0.00 174.94 174.87 3dhu s LYS 425 N 1.16 4.04 0.21 2.79 2.20 -1.26 -1.37 119.74 127.50 3dhu s LYS 425 Ca -0.03 0.14 -0.16 0.00 -0.36 0.00 0.00 55.97 55.56 3dhu s LYS 425 Cb -0.14 -3.34 0.02 0.00 -1.51 0.00 0.00 37.83 32.86 3dhu s LYS 425 CO -0.04 0.44 0.49 1.52 -0.36 0.00 0.00 175.35 177.40 3dhu s TYR 426 N -0.16 0.05 -2.00 4.03 1.13 0.32 -4.97 117.35 115.75 3dhu s TYR 426 Ca 0.18 -0.41 0.31 0.00 -1.41 0.00 0.00 57.07 55.74 3dhu s TYR 426 Cb -0.14 0.31 1.84 0.00 -1.10 0.00 0.00 41.96 42.87 3dhu s TYR 426 CO 0.06 -0.93 2.17 0.28 -2.51 0.00 0.00 175.55 174.62