#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xyf n GLU 2 N 0.00 0.00 0.03 0.00 -0.00 -1.26 -3.22 120.64 116.20 1xyf n GLU 2 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 57.16 56.85 1xyf n GLU 2 Cb 0.00 -0.25 -0.08 0.00 -0.00 0.00 0.00 31.44 31.11 1xyf n GLU 2 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.13 177.90 1xyf h SER 3 N 0.00 0.00 -2.76 -1.84 0.02 -1.98 -3.45 113.55 103.54 1xyf h SER 3 Ca 0.00 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 60.32 1xyf h SER 3 Cb 1.04 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.43 1xyf h SER 3 CO 0.00 0.57 -0.77 0.42 -1.14 0.00 0.00 176.83 175.91 1xyf s THR 4 N -2.93 2.63 0.10 -2.27 -4.23 -1.26 -5.05 115.64 102.64 1xyf s THR 4 Ca -0.03 -2.08 -0.22 0.00 -1.18 0.00 0.00 61.69 58.18 1xyf s THR 4 Cb 0.09 -2.32 -0.12 0.00 1.34 0.00 0.00 72.50 71.49 1xyf s THR 4 CO 0.81 -0.23 1.74 -0.07 -0.54 0.00 0.00 174.62 176.33 1xyf h LEU 5 N 2.74 0.01 -0.10 4.79 3.38 -1.88 -1.49 115.31 122.75 1xyf h LEU 5 Ca -0.44 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.56 1xyf h LEU 5 Cb 1.23 0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 1xyf h LEU 5 CO 0.54 0.02 -0.01 1.23 0.09 0.00 0.00 178.44 180.30 1xyf h GLY 6 N 0.05 0.08 1.01 0.83 0.00 -0.69 -1.03 103.07 103.33 1xyf h GLY 6 Ca 0.03 0.02 -0.01 0.00 0.00 0.00 0.00 47.33 47.37 1xyf h GLY 6 CO -0.04 -0.03 0.42 0.00 0.00 0.00 0.00 176.54 176.89 1xyf h ALA 7 N 1.09 0.97 -0.37 3.60 0.00 -1.81 -0.36 119.26 122.39 1xyf h ALA 7 Ca 0.05 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.75 1xyf h ALA 7 Cb 0.06 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1xyf h ALA 7 CO -0.09 0.48 -0.17 0.00 0.00 0.00 0.00 179.25 179.47 1xyf h ALA 8 N 1.21 1.03 -0.40 0.00 0.00 -1.10 -2.79 119.26 117.21 1xyf h ALA 8 Ca 0.27 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1xyf h ALA 8 Cb 0.03 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1xyf h ALA 8 CO -0.04 0.58 -0.26 0.00 0.00 0.00 0.00 179.25 179.53 1xyf h ALA 9 N 1.21 0.57 -0.27 0.00 0.00 -0.89 -3.02 119.26 116.87 1xyf h ALA 9 Ca 0.10 -0.40 0.08 0.00 0.00 0.00 0.00 54.91 54.68 1xyf h ALA 9 Cb 0.62 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1xyf h ALA 9 CO 0.04 0.58 0.27 0.00 0.00 0.00 0.00 179.25 180.14 1xyf h ALA 10 N 0.80 1.96 -0.59 0.00 0.00 -0.79 -1.14 119.26 119.49 1xyf h ALA 10 Ca 0.08 -0.01 0.05 0.00 0.00 0.00 0.00 54.91 55.03 1xyf h ALA 10 Cb 0.84 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 1xyf h ALA 10 CO 0.07 -0.41 0.39 1.96 0.00 0.00 0.00 179.25 181.27 1xyf h GLN 11 N 0.00 0.62 -0.53 0.00 4.20 -1.37 -0.27 115.11 117.75 1xyf h GLN 11 Ca 0.13 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.80 1xyf h GLN 11 Cb 0.66 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1xyf h GLN 11 CO -0.00 0.41 0.00 -1.13 -0.67 0.00 0.00 178.83 177.44 1xyf n SER 12 N -4.47 5.10 -0.11 1.46 3.41 -0.49 -4.93 113.62 113.59 1xyf n SER 12 Ca 0.08 -2.81 -0.01 0.00 -0.26 0.00 0.00 58.87 55.86 1xyf n SER 12 Cb 0.19 -0.62 -0.01 0.00 -0.26 0.00 0.00 64.21 63.51 1xyf n SER 12 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xyf n GLY 13 N 0.53 0.51 3.41 5.00 0.00 -0.11 -5.03 105.19 109.50 1xyf n GLY 13 Ca 0.26 -0.33 -0.20 0.00 0.00 0.00 0.00 46.02 45.74 1xyf n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xyf n ARG 14 N -2.50 0.71 -4.23 1.61 1.74 -0.84 -4.93 116.66 108.22 1xyf n ARG 14 Ca -0.01 -2.90 -0.16 0.00 -0.77 0.00 0.00 57.85 54.00 1xyf n ARG 14 Cb 0.10 0.05 -0.11 0.00 -1.02 0.00 0.00 32.46 31.49 1xyf n ARG 14 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1xyf s TYR 15 N -2.30 1.30 -0.21 -1.55 -0.85 -1.10 -2.57 117.35 110.06 1xyf s TYR 15 Ca 0.41 -0.61 0.00 0.00 -0.52 0.00 0.00 57.07 56.34 1xyf s TYR 15 Cb -0.03 -0.68 0.05 0.00 0.38 0.00 0.00 41.96 41.68 1xyf s TYR 15 CO 0.26 0.10 -0.05 0.12 -1.52 0.00 0.00 175.55 174.47 1xyf s PHE 16 N -2.44 2.08 0.45 -3.49 2.19 -1.26 -1.89 117.98 113.62 1xyf s PHE 16 Ca 0.10 -1.48 0.02 0.00 0.33 0.00 0.00 56.93 55.89 1xyf s PHE 16 Cb -0.03 -1.46 0.02 0.00 -1.31 0.00 0.00 43.02 40.23 1xyf s PHE 16 CO 0.02 -0.72 0.13 0.41 1.83 0.00 0.00 175.22 176.89 1xyf n GLY 17 N 4.76 3.33 3.41 13.12 0.00 0.94 -1.34 105.19 129.41 1xyf n GLY 17 Ca -0.12 -2.32 -0.10 0.00 0.00 0.00 0.00 46.02 43.47 1xyf n GLY 17 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1xyf s THR 18 N -2.48 0.00 -0.04 2.61 -1.32 -0.77 -1.55 115.64 112.09 1xyf s THR 18 Ca 0.10 -1.68 -0.13 0.00 -1.21 0.00 0.00 61.69 58.77 1xyf s THR 18 Cb -0.01 -2.33 -0.05 0.00 -1.51 0.00 0.00 72.50 68.60 1xyf s THR 18 CO 0.06 -0.01 0.35 0.00 -2.21 0.00 0.00 174.62 172.81 1xyf s ALA 19 N -4.08 3.72 -0.07 11.08 0.00 -1.10 -1.44 121.76 129.86 1xyf s ALA 19 Ca 0.30 -0.32 0.05 0.00 0.00 0.00 0.00 51.96 51.99 1xyf s ALA 19 Cb 0.03 -2.31 -0.01 0.00 0.00 0.00 0.00 23.12 20.83 1xyf s ALA 19 CO 0.10 0.46 -0.24 0.42 0.00 0.00 0.00 175.76 176.50 1xyf s ILE 20 N -0.89 2.09 -0.23 0.00 -1.09 0.46 -4.22 121.20 117.32 1xyf s ILE 20 Ca 0.21 -1.04 -0.07 0.00 -2.23 0.00 0.00 60.65 57.52 1xyf s ILE 20 Cb -0.15 -1.77 -0.03 0.00 -1.58 0.00 0.00 42.46 38.93 1xyf s ILE 20 CO 0.11 0.57 0.07 0.00 -1.23 0.00 0.00 174.94 174.45 1xyf s ALA 21 N -0.03 3.23 0.52 9.38 0.00 -1.26 -1.15 121.76 132.45 1xyf s ALA 21 Ca -0.08 -1.00 0.29 0.00 0.00 0.00 0.00 51.96 51.17 1xyf s ALA 21 Cb -0.15 -2.02 1.67 0.00 0.00 0.00 0.00 23.12 22.63 1xyf s ALA 21 CO 0.05 -0.26 2.18 0.66 0.00 0.00 0.00 175.76 178.39 1xyf h SER 22 N 7.71 0.00 0.36 0.00 4.64 -1.99 -1.85 113.55 122.42 1xyf h SER 22 Ca -0.37 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.94 1xyf h SER 22 Cb 1.18 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1xyf h SER 22 CO 0.61 0.05 -0.06 1.23 -0.87 0.00 0.00 176.83 177.79 1xyf h GLY 23 N 0.36 0.00 -2.11 -0.77 0.00 -1.99 -2.53 103.07 96.02 1xyf h GLY 23 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xyf h GLY 23 CO 0.01 0.00 0.00 0.28 0.00 0.00 0.00 176.54 176.83 1xyf n LYS 24 N -3.42 2.38 0.08 4.80 5.02 -0.70 -4.36 118.16 121.96 1xyf n LYS 24 Ca -0.02 -2.12 0.08 0.00 -2.02 0.00 0.00 58.31 54.23 1xyf n LYS 24 Cb 0.19 -1.48 0.36 0.00 -0.02 0.00 0.00 35.03 34.08 1xyf n LYS 24 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1xyf n LEU 25 N 1.40 0.32 0.04 -0.35 4.77 -0.95 -1.40 117.00 120.83 1xyf n LEU 25 Ca 0.17 0.61 -0.02 0.00 -0.03 0.00 0.00 56.01 56.74 1xyf n LEU 25 Cb 0.59 -0.60 -0.08 0.00 -2.33 0.00 0.00 43.42 41.00 1xyf n LEU 25 CO 0.15 -0.57 -0.17 1.23 -1.33 0.00 0.00 177.39 176.70 1xyf h GLY 26 N 1.23 0.00 -6.50 -0.72 0.00 -1.80 -3.45 103.07 91.83 1xyf h GLY 26 Ca 0.00 0.00 -0.57 0.00 0.00 0.00 0.00 47.33 46.76 1xyf h GLY 26 CO 0.00 0.00 1.15 -0.35 0.00 0.00 0.00 176.54 177.34 1xyf s ASP 27 N -6.06 6.24 0.35 0.19 -1.08 -0.49 -4.92 116.67 110.90 1xyf s ASP 27 Ca -0.02 1.28 0.09 0.00 -0.52 0.00 0.00 52.55 53.38 1xyf s ASP 27 Cb 0.08 -2.53 0.64 0.00 -1.46 0.00 0.00 42.92 39.65 1xyf s ASP 27 CO 0.80 -1.43 1.82 0.77 0.52 0.00 0.00 175.17 177.65 1xyf h SER 28 N 11.27 0.20 -0.54 -0.34 4.64 -1.86 -1.71 113.55 125.20 1xyf h SER 28 Ca -0.31 -0.06 -0.08 0.00 -0.47 0.00 0.00 61.79 60.86 1xyf h SER 28 Cb 1.14 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.15 1xyf h SER 28 CO 1.03 0.48 0.03 0.00 -0.87 0.00 0.00 176.83 177.51 1xyf h ALA 29 N 1.54 0.97 0.24 5.18 0.00 -1.95 -0.53 119.26 124.71 1xyf h ALA 29 Ca 0.03 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1xyf h ALA 29 Cb 0.60 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1xyf h ALA 29 CO 0.04 0.63 -0.12 -0.92 0.00 0.00 0.00 179.25 178.89 1xyf h TYR 30 N 0.90 -0.30 -0.00 0.00 3.20 -1.80 -3.04 116.97 115.93 1xyf h TYR 30 Ca 0.17 -0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.96 1xyf h TYR 30 Cb 0.48 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.84 1xyf h TYR 30 CO 0.03 0.03 -0.34 1.79 -1.64 0.00 0.00 178.16 178.04 1xyf h THR 31 N -0.67 1.24 -0.32 1.81 1.35 -1.30 -1.76 112.91 113.26 1xyf h THR 31 Ca -0.03 -1.16 -0.00 0.00 -0.55 0.00 0.00 66.41 64.67 1xyf h THR 31 Cb 0.47 1.62 -0.02 0.00 -1.73 0.00 0.00 68.15 68.49 1xyf h THR 31 CO 0.05 0.33 0.18 0.74 -0.25 0.00 0.00 175.52 176.58 1xyf h THR 32 N 0.00 1.12 0.02 6.82 2.02 -1.12 0.51 112.91 122.28 1xyf h THR 32 Ca -0.00 -0.30 -0.00 0.00 0.77 0.00 0.00 66.41 66.88 1xyf h THR 32 Cb 0.60 0.74 0.00 0.00 -1.74 0.00 0.00 68.15 67.75 1xyf h THR 32 CO 0.04 0.12 -0.01 0.40 0.37 0.00 0.00 175.52 176.44 1xyf h ILE 33 N 0.40 1.35 -0.95 3.11 2.04 -1.37 -2.93 117.51 119.17 1xyf h ILE 33 Ca 0.11 -1.15 0.06 0.00 1.00 0.00 0.00 64.86 64.88 1xyf h ILE 33 Cb 0.03 2.12 -0.06 0.00 -0.74 0.00 0.00 36.82 38.17 1xyf h ILE 33 CO -0.02 0.29 0.61 0.00 0.00 0.00 0.00 178.15 179.03 1xyf h ALA 34 N 0.44 1.29 -0.23 1.87 0.00 -1.29 0.43 119.26 121.77 1xyf h ALA 34 Ca -0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1xyf h ALA 34 Cb 0.50 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1xyf h ALA 34 CO 0.00 0.41 -0.44 1.03 0.00 0.00 0.00 179.25 180.26 1xyf h SER 35 N 1.13 0.62 0.12 0.00 0.87 -0.96 -3.14 113.55 112.18 1xyf h SER 35 Ca 0.40 -0.29 -0.21 0.00 -1.23 0.00 0.00 61.79 60.46 1xyf h SER 35 Cb 0.12 -0.17 0.02 0.00 -0.44 0.00 0.00 62.40 61.93 1xyf h SER 35 CO -0.16 0.97 -0.89 -0.09 -0.53 0.00 0.00 176.83 176.13 1xyf h ARG 36 N 0.47 0.39 0.00 2.24 2.43 -1.21 -3.40 114.38 115.29 1xyf h ARG 36 Ca 0.03 -0.58 -0.17 0.00 -0.81 0.00 0.00 59.98 58.45 1xyf h ARG 36 Cb 0.95 0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.67 1xyf h ARG 36 CO 0.08 1.25 -1.24 0.93 -1.51 0.00 0.00 179.97 179.49 1xyf h GLU 37 N -0.18 0.00 -6.58 0.20 4.39 -1.03 -3.45 114.58 107.93 1xyf h GLU 37 Ca -0.15 0.00 -0.65 0.00 0.34 0.00 0.00 59.36 58.90 1xyf h GLU 37 Cb 1.66 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 30.15 1xyf h GLU 37 CO 0.17 0.41 -0.76 -0.06 -1.16 0.00 0.00 179.01 177.61 1xyf s PHE 38 N -2.87 2.60 -0.06 4.33 0.08 -1.19 -0.04 117.98 120.82 1xyf s PHE 38 Ca -0.01 -0.23 0.09 0.00 0.12 0.00 0.00 56.93 56.90 1xyf s PHE 38 Cb 0.08 -1.33 0.14 0.00 -0.57 0.00 0.00 43.02 41.35 1xyf s PHE 38 CO 0.80 0.45 1.03 0.27 -0.10 0.00 0.00 175.22 177.67 1xyf n ASN 39 N 0.45 1.40 -3.76 1.36 0.23 -0.45 -4.81 115.26 109.68 1xyf n ASN 39 Ca -0.13 -2.45 -0.13 0.00 -0.53 0.00 0.00 54.58 51.34 1xyf n ASN 39 Cb 0.54 -0.27 -0.12 0.00 -2.08 0.00 0.00 39.78 37.85 1xyf n ASN 39 CO 0.00 0.00 0.00 -0.32 -0.93 0.00 0.00 177.26 176.01 1xyf s MET 40 N -1.53 0.30 -0.02 -3.83 0.00 -1.25 -1.68 119.30 111.30 1xyf s MET 40 Ca 0.16 0.44 0.04 0.00 0.00 0.00 0.00 55.69 56.33 1xyf s MET 40 Cb 0.14 0.08 -0.01 0.00 0.00 0.00 0.00 34.83 35.04 1xyf s MET 40 CO 0.01 -0.07 -0.14 0.08 0.00 0.00 0.00 175.02 174.90 1xyf s VAL 41 N 0.47 1.09 -0.05 10.11 1.01 -0.02 -1.84 120.40 131.18 1xyf s VAL 41 Ca -0.03 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 61.43 1xyf s VAL 41 Cb -0.04 -0.92 -0.01 0.00 0.00 0.00 0.00 36.38 35.41 1xyf s VAL 41 CO -0.02 0.31 -0.22 -0.89 0.00 0.00 0.00 175.10 174.28 1xyf s THR 42 N -0.23 1.81 -0.05 3.92 2.01 -0.52 -1.06 115.64 121.51 1xyf s THR 42 Ca 0.04 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 60.81 1xyf s THR 42 Cb -0.06 -1.53 -0.03 0.00 0.01 0.00 0.00 72.50 70.89 1xyf s THR 42 CO -0.00 0.51 1.09 0.00 -0.69 0.00 0.00 174.62 175.52 1xyf s ALA 43 N -0.13 3.39 0.12 7.40 0.00 -1.26 -0.41 121.76 130.88 1xyf s ALA 43 Ca -0.03 0.53 -0.20 0.00 0.00 0.00 0.00 51.96 52.27 1xyf s ALA 43 Cb -0.12 -3.45 -0.07 0.00 0.00 0.00 0.00 23.12 19.48 1xyf s ALA 43 CO 0.03 -0.58 1.76 1.49 0.00 0.00 0.00 175.76 178.46 1xyf h GLU 44 N 7.14 0.19 0.00 0.00 4.81 -1.48 -3.40 114.58 121.85 1xyf h GLU 44 Ca -0.35 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.87 1xyf h GLU 44 Cb 1.17 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1xyf h GLU 44 CO 0.84 0.13 -0.25 0.09 -0.73 0.00 0.00 179.01 179.09 1xyf n ASN 45 N -5.00 1.23 0.29 1.04 3.02 -1.26 -4.91 115.26 109.67 1xyf n ASN 45 Ca -0.03 -0.03 0.18 0.00 -0.03 0.00 0.00 54.58 54.66 1xyf n ASN 45 Cb 0.05 0.30 0.97 0.00 -0.61 0.00 0.00 39.78 40.48 1xyf n ASN 45 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1xyf h GLU 46 N 0.00 0.00 -0.35 3.52 3.07 -1.89 -2.53 114.58 116.41 1xyf h GLU 46 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1xyf h GLU 46 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1xyf h GLU 46 CO 0.00 0.00 0.00 -1.33 -1.40 0.00 0.00 179.01 176.28 1xyf n MET 47 N -3.59 3.04 -1.40 2.33 2.81 -1.25 -3.75 117.12 115.30 1xyf n MET 47 Ca -0.02 -2.53 -0.29 0.00 -1.81 0.00 0.00 57.70 53.05 1xyf n MET 47 Cb 0.16 -1.62 0.14 0.00 -0.71 0.00 0.00 33.22 31.18 1xyf n MET 47 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1xyf s LYS 48 N -1.97 1.07 0.06 0.03 1.02 -0.95 -2.60 119.74 116.40 1xyf s LYS 48 Ca 0.36 0.45 -0.24 0.00 0.02 0.00 0.00 55.97 56.56 1xyf s LYS 48 Cb 0.25 -1.82 -0.16 0.00 -0.52 0.00 0.00 37.83 35.58 1xyf s LYS 48 CO 0.14 -2.28 1.61 0.82 -0.92 0.00 0.00 175.35 174.71 1xyf h ILE 49 N -1.56 1.04 -0.47 2.17 2.04 -1.80 -1.80 117.51 117.13 1xyf h ILE 49 Ca -0.51 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.10 1xyf h ILE 49 Cb 1.32 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 38.60 1xyf h ILE 49 CO 0.60 0.07 0.31 -2.24 0.00 0.00 0.00 178.15 176.89 1xyf h ASP 50 N -0.19 0.44 0.34 1.72 2.03 -1.83 -1.40 116.42 117.54 1xyf h ASP 50 Ca -0.01 -0.01 -0.28 0.00 -0.73 0.00 0.00 57.03 56.01 1xyf h ASP 50 Cb 0.17 -0.10 0.02 0.00 -0.83 0.00 0.00 39.33 38.58 1xyf h ASP 50 CO 0.01 0.31 -1.18 0.00 -1.03 0.00 0.00 179.24 177.35 1xyf h ALA 51 N 1.73 0.11 0.00 4.15 0.00 -1.79 -3.23 119.26 120.24 1xyf h ALA 51 Ca 0.19 -0.80 -0.07 0.00 0.00 0.00 0.00 54.91 54.23 1xyf h ALA 51 Cb 0.11 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1xyf h ALA 51 CO -0.05 0.81 -0.99 1.79 0.00 0.00 0.00 179.25 180.81 1xyf h THR 52 N 0.19 0.27 -1.94 0.00 1.35 -1.07 -3.41 112.91 108.31 1xyf h THR 52 Ca -0.15 -1.48 -0.55 0.00 -0.55 0.00 0.00 66.41 63.69 1xyf h THR 52 Cb 1.86 1.84 -0.38 0.00 -1.73 0.00 0.00 68.15 69.74 1xyf h THR 52 CO 0.21 0.15 -1.07 1.21 -0.25 0.00 0.00 175.52 175.77 1xyf n GLU 53 N -2.85 0.67 -0.16 4.72 2.13 -0.55 -0.10 120.64 124.49 1xyf n GLU 53 Ca -0.03 -3.14 0.08 0.00 0.66 0.00 0.00 57.16 54.73 1xyf n GLU 53 Cb 0.67 -1.26 0.39 0.00 0.27 0.00 0.00 31.44 31.51 1xyf n GLU 53 CO 0.00 0.00 0.00 -1.35 -0.41 0.00 0.00 177.13 175.37 1xyf h PRO 54 N 4.14 0.65 -5.12 5.31 0.11 -1.64 -3.41 132.00 132.04 1xyf h PRO 54 Ca 0.08 -0.04 -0.48 0.00 0.11 0.00 0.00 66.00 65.66 1xyf h PRO 54 Cb 0.89 -0.15 -0.30 0.00 0.11 0.00 0.00 31.00 31.56 1xyf h PRO 54 CO 0.44 0.43 -0.81 -0.65 -0.21 0.00 0.00 178.00 177.20 1xyf s GLN 55 N -5.61 1.21 -0.16 1.05 -1.52 -1.25 -4.81 119.66 108.57 1xyf s GLN 55 Ca -0.09 -0.47 -0.38 0.00 -1.95 0.00 0.00 55.36 52.46 1xyf s GLN 55 Cb 0.20 -1.13 -0.15 0.00 -0.22 0.00 0.00 33.01 31.70 1xyf s GLN 55 CO 0.77 0.25 1.71 -2.13 -0.25 0.00 0.00 175.29 175.64 1xyf n ARG 56 N 2.94 1.45 0.00 2.91 0.63 -1.26 -0.48 116.66 122.84 1xyf n ARG 56 Ca -0.16 0.53 0.00 0.00 -0.92 0.00 0.00 57.85 57.30 1xyf n ARG 56 Cb 0.55 -2.25 0.00 0.00 0.45 0.00 0.00 32.46 31.21 1xyf n ARG 56 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1xyf n GLY 57 N 3.97 2.86 3.29 5.14 0.00 -1.26 -4.97 105.19 114.23 1xyf n GLY 57 Ca 0.24 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.81 1xyf n GLY 57 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xyf s GLN 58 N -0.29 3.04 0.07 1.61 -0.21 0.37 -5.06 119.66 119.20 1xyf s GLN 58 Ca 0.00 -1.91 -0.24 0.00 0.02 0.00 0.00 55.36 53.23 1xyf s GLN 58 Cb 0.00 -4.26 -0.06 0.00 1.00 0.00 0.00 33.01 29.69 1xyf s GLN 58 CO 0.00 -1.30 0.73 -0.06 -2.12 0.00 0.00 175.29 172.54 1xyf s PHE 59 N 1.20 3.78 -0.14 0.91 0.08 -1.26 -3.73 117.98 118.83 1xyf s PHE 59 Ca 0.07 1.46 0.00 0.00 0.12 0.00 0.00 56.93 58.58 1xyf s PHE 59 Cb -0.25 -2.75 0.02 0.00 -0.57 0.00 0.00 43.02 39.47 1xyf s PHE 59 CO -0.00 0.37 -0.12 1.21 -0.10 0.00 0.00 175.22 176.58 1xyf s ASN 60 N -0.44 2.50 -0.13 1.36 3.84 0.86 -4.98 114.94 117.95 1xyf s ASN 60 Ca 0.36 -0.42 0.19 0.00 0.21 0.00 0.00 52.86 53.20 1xyf s ASN 60 Cb -0.21 -1.06 0.30 0.00 -0.55 0.00 0.00 41.25 39.74 1xyf s ASN 60 CO 0.23 -0.08 1.16 0.49 -2.79 0.00 0.00 177.10 176.12 1xyf n PHE 61 N 4.81 0.04 0.39 0.43 3.72 -1.26 -4.03 117.46 121.57 1xyf n PHE 61 Ca -0.15 -1.01 -0.18 0.00 -0.05 0.00 0.00 57.45 56.05 1xyf n PHE 61 Cb 0.50 -0.16 -0.09 0.00 -0.94 0.00 0.00 39.48 38.79 1xyf n PHE 61 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1xyf h SER 62 N 0.10 -0.89 -0.46 4.37 0.02 -1.94 0.19 113.55 114.93 1xyf h SER 62 Ca 0.00 0.04 -0.08 0.00 -0.84 0.00 0.00 61.79 60.91 1xyf h SER 62 Cb 1.02 0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.79 1xyf h SER 62 CO 0.01 -0.61 -0.03 0.00 -1.14 0.00 0.00 176.83 175.06 1xyf h ALA 63 N -0.74 0.62 -0.32 3.77 0.00 -1.88 -1.98 119.26 118.73 1xyf h ALA 63 Ca -0.10 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1xyf h ALA 63 Cb 0.78 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 1xyf h ALA 63 CO 0.14 0.45 0.18 0.78 0.00 0.00 0.00 179.25 180.80 1xyf h GLY 64 N 0.68 0.48 1.99 0.00 0.00 -1.64 -2.65 103.07 101.93 1xyf h GLY 64 Ca 0.13 -0.22 -0.06 0.00 0.00 0.00 0.00 47.33 47.18 1xyf h GLY 64 CO 0.03 0.21 -0.28 -0.55 0.00 0.00 0.00 176.54 175.95 1xyf h ASP 65 N 0.40 0.01 -0.26 0.19 5.19 -0.90 -0.12 116.42 120.92 1xyf h ASP 65 Ca 0.11 -0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.50 1xyf h ASP 65 Cb 0.06 -0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.56 1xyf h ASP 65 CO -0.02 0.29 0.09 -0.09 -3.12 0.00 0.00 179.24 176.40 1xyf h ARG 66 N 0.01 0.40 -0.39 3.56 2.43 -1.04 -0.56 114.38 118.79 1xyf h ARG 66 Ca -0.00 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.01 1xyf h ARG 66 Cb 0.51 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1xyf h ARG 66 CO 0.04 0.46 -0.04 0.28 -1.51 0.00 0.00 179.97 179.20 1xyf h VAL 67 N 0.27 1.27 -0.17 0.20 2.07 -1.13 -2.30 116.25 116.46 1xyf h VAL 67 Ca 0.09 -1.08 0.00 0.00 0.82 0.00 0.00 66.70 66.52 1xyf h VAL 67 Cb 0.22 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.17 1xyf h VAL 67 CO -0.00 0.36 0.11 0.22 0.02 0.00 0.00 177.57 178.28 1xyf h TYR 68 N 0.53 0.22 -0.71 1.57 3.20 -0.92 -1.23 116.97 119.62 1xyf h TYR 68 Ca 0.10 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.93 1xyf h TYR 68 Cb 0.54 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 1xyf h TYR 68 CO 0.04 0.15 0.27 -0.91 -1.64 0.00 0.00 178.16 176.07 1xyf h ASN 69 N 0.22 0.99 -0.23 -2.11 2.35 -1.09 -1.68 115.58 114.04 1xyf h ASN 69 Ca 0.06 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1xyf h ASN 69 Cb -0.01 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.09 1xyf h ASN 69 CO -0.01 0.91 0.14 -0.25 -1.65 0.00 0.00 177.43 176.57 1xyf h TRP 70 N 1.02 0.27 0.54 1.19 7.01 -1.23 -1.62 115.95 123.14 1xyf h TRP 70 Ca 0.24 0.01 -0.02 0.00 2.11 0.00 0.00 58.89 61.23 1xyf h TRP 70 Cb 0.23 -0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.18 1xyf h TRP 70 CO 0.02 0.17 -0.48 0.00 -2.79 0.00 0.00 178.44 175.36 1xyf h ALA 71 N 1.09 -1.11 -0.83 2.65 0.00 -0.85 -2.20 119.26 118.01 1xyf h ALA 71 Ca 0.09 -0.19 0.05 0.00 0.00 0.00 0.00 54.91 54.85 1xyf h ALA 71 Cb -0.02 0.67 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 1xyf h ALA 71 CO -0.03 -1.16 0.52 0.28 0.00 0.00 0.00 179.25 178.87 1xyf h VAL 72 N -1.01 1.08 0.00 0.00 2.07 -1.27 -1.04 116.25 116.09 1xyf h VAL 72 Ca -0.07 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.09 1xyf h VAL 72 Cb 0.86 0.01 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1xyf h VAL 72 CO -0.03 0.18 -0.12 1.56 0.02 0.00 0.00 177.57 179.18 1xyf h GLN 73 N 0.99 0.00 -0.54 1.57 1.08 -1.23 -2.46 115.11 114.52 1xyf h GLN 73 Ca 0.35 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.55 1xyf h GLN 73 Cb 0.08 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.51 1xyf h GLN 73 CO -0.14 0.12 0.00 0.09 -0.95 0.00 0.00 178.83 177.95 1xyf n ASN 74 N -3.75 5.04 -1.22 1.46 3.02 -0.69 -4.97 115.26 114.15 1xyf n ASN 74 Ca -0.02 -2.76 -0.08 0.00 -0.03 0.00 0.00 54.58 51.68 1xyf n ASN 74 Cb 0.23 -0.61 0.01 0.00 -0.61 0.00 0.00 39.78 38.80 1xyf n ASN 74 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xyf n GLY 75 N 0.59 0.19 3.33 7.41 0.00 -0.92 -5.00 105.19 110.78 1xyf n GLY 75 Ca 0.26 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.52 1xyf n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xyf s LYS 76 N -4.85 1.75 0.81 1.61 3.01 -0.48 -4.79 119.74 116.80 1xyf s LYS 76 Ca 0.09 -1.07 -0.09 0.00 -1.01 0.00 0.00 55.97 53.89 1xyf s LYS 76 Cb -0.04 -1.91 0.13 0.00 -1.01 0.00 0.00 37.83 35.00 1xyf s LYS 76 CO 0.11 0.49 1.14 -0.65 0.51 0.00 0.00 175.35 176.96 1xyf s GLN 77 N -1.19 1.48 0.04 1.68 -0.21 -0.67 -3.64 119.66 117.15 1xyf s GLN 77 Ca 0.11 -0.47 0.05 0.00 0.02 0.00 0.00 55.36 55.06 1xyf s GLN 77 Cb -0.10 -2.07 -0.02 0.00 1.00 0.00 0.00 33.01 31.82 1xyf s GLN 77 CO 0.02 -1.75 -0.13 0.08 -2.12 0.00 0.00 175.29 171.39 1xyf s VAL 78 N -3.49 1.03 -0.18 1.09 1.01 -1.26 -0.84 120.40 117.76 1xyf s VAL 78 Ca 0.67 -1.02 -0.02 0.00 0.00 0.00 0.00 61.98 61.61 1xyf s VAL 78 Cb -0.07 -0.95 -0.01 0.00 0.00 0.00 0.00 36.38 35.35 1xyf s VAL 78 CO 0.48 -0.06 -0.10 -0.13 0.00 0.00 0.00 175.10 175.29 1xyf s ARG 79 N -1.23 3.33 0.09 2.72 0.52 -0.22 -1.36 118.95 122.81 1xyf s ARG 79 Ca -0.00 -0.68 -0.30 0.00 -0.52 0.00 0.00 55.73 54.23 1xyf s ARG 79 Cb -0.08 -2.79 -0.05 0.00 0.52 0.00 0.00 34.95 32.54 1xyf s ARG 79 CO 0.01 -0.02 0.97 0.20 0.02 0.00 0.00 175.30 176.48 1xyf s GLY 80 N 0.96 2.98 -0.26 -3.53 0.00 0.21 -4.21 107.32 103.48 1xyf s GLY 80 Ca -0.01 0.58 -0.02 0.00 0.00 0.00 0.00 44.72 45.26 1xyf s GLY 80 CO -0.01 1.50 0.22 -1.58 0.00 0.00 0.00 173.10 173.24 1xyf s HIS 81 N 0.16 -0.18 -0.10 1.90 5.04 -1.26 -0.42 115.29 120.43 1xyf s HIS 81 Ca 0.48 -0.28 -0.30 0.00 -1.54 0.00 0.00 55.06 53.42 1xyf s HIS 81 Cb -0.23 -0.57 0.10 0.00 0.04 0.00 0.00 32.58 31.92 1xyf s HIS 81 CO 0.30 -0.80 0.85 -0.08 -2.34 0.00 0.00 174.74 172.66 1xyf s THR 82 N 2.27 0.00 -0.08 0.89 -1.32 -1.07 -3.33 115.64 112.99 1xyf s THR 82 Ca 0.08 0.00 -0.20 0.00 -1.21 0.00 0.00 61.69 60.37 1xyf s THR 82 Cb -0.15 -1.00 -0.29 0.00 -1.51 0.00 0.00 72.50 69.55 1xyf s THR 82 CO -0.28 0.00 0.72 -0.07 -2.21 0.00 0.00 174.62 172.78 1xyf h LEU 83 N 2.72 0.38 -7.87 9.08 3.38 -1.43 -3.37 115.31 118.21 1xyf h LEU 83 Ca -0.22 -0.89 -0.49 0.00 0.09 0.00 0.00 57.88 56.36 1xyf h LEU 83 Cb 1.16 -0.12 -0.34 0.00 0.09 0.00 0.00 40.66 41.44 1xyf h LEU 83 CO 0.35 1.47 -0.80 0.00 0.09 0.00 0.00 178.44 179.54 1xyf s ALA 84 N -2.43 1.15 -0.17 1.53 0.00 -0.17 -4.79 121.76 116.87 1xyf s ALA 84 Ca -0.17 -0.36 -0.23 0.00 0.00 0.00 0.00 51.96 51.20 1xyf s ALA 84 Cb 0.02 -0.61 0.06 0.00 0.00 0.00 0.00 23.12 22.59 1xyf s ALA 84 CO 0.78 -0.03 0.60 -0.46 0.00 0.00 0.00 175.76 176.66 1xyf s TRP 85 N 0.95 -0.63 0.06 0.00 -0.00 -1.26 -1.96 118.94 116.10 1xyf s TRP 85 Ca -0.10 1.42 0.28 0.00 -0.00 0.00 0.00 56.10 57.70 1xyf s TRP 85 Cb -0.15 0.26 1.04 0.00 -0.00 0.00 0.00 33.47 34.62 1xyf s TRP 85 CO 0.00 -0.39 1.87 1.12 -0.00 0.00 0.00 176.95 179.55 1xyf h HIS 86 N 4.58 0.00 -2.79 5.86 2.07 -1.87 -3.44 115.15 119.56 1xyf h HIS 86 Ca -0.28 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 56.65 1xyf h HIS 86 Cb 1.16 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 31.10 1xyf h HIS 86 CO 0.40 0.11 -0.51 0.45 -3.07 0.00 0.00 177.93 175.31 1xyf s SER 87 N -5.98 6.10 -1.45 3.10 0.15 -1.26 -4.56 113.70 109.80 1xyf s SER 87 Ca 0.02 0.13 -0.09 0.00 0.70 0.00 0.00 55.95 56.71 1xyf s SER 87 Cb 0.09 -1.79 0.04 0.00 -1.71 0.00 0.00 66.02 62.65 1xyf s SER 87 CO 0.60 0.11 0.71 0.00 1.20 0.00 0.00 173.24 175.86 1xyf n GLN 88 N -0.09 -4.88 -2.76 5.44 6.02 -1.26 -4.92 117.38 114.91 1xyf n GLN 88 Ca -0.07 0.70 -0.39 0.00 -0.01 0.00 0.00 57.00 57.24 1xyf n GLN 88 Cb 0.53 -5.54 -0.06 0.00 1.02 0.00 0.00 30.24 26.18 1xyf n GLN 88 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1xyf s GLN 89 N -6.06 4.73 0.68 -1.09 -0.21 -1.26 -3.30 119.66 113.14 1xyf s GLN 89 Ca 0.44 1.41 -0.16 0.00 0.02 0.00 0.00 55.36 57.07 1xyf s GLN 89 Cb -0.21 -3.05 0.01 0.00 1.00 0.00 0.00 33.01 30.76 1xyf s GLN 89 CO 0.54 0.40 1.19 -1.25 -2.12 0.00 0.00 175.29 174.05 1xyf s PRO 90 N -1.60 2.52 0.31 2.91 0.04 -1.26 -4.78 135.00 133.14 1xyf s PRO 90 Ca 0.45 1.70 0.09 0.00 0.04 0.00 0.00 61.00 63.29 1xyf s PRO 90 Cb -0.22 -1.89 0.87 0.00 0.04 0.00 0.00 34.50 33.30 1xyf s PRO 90 CO 0.28 -1.53 1.72 0.78 0.04 0.00 0.00 177.00 178.29 1xyf h GLY 91 N 0.12 1.86 1.37 0.56 0.00 -1.95 0.55 103.07 105.57 1xyf h GLY 91 Ca -0.48 -0.29 0.03 0.00 0.00 0.00 0.00 47.33 46.59 1xyf h GLY 91 CO 0.52 -0.26 0.36 0.11 0.00 0.00 0.00 176.54 177.27 1xyf h TRP 92 N 0.54 0.59 0.00 5.60 5.08 -1.90 -1.52 115.95 124.35 1xyf h TRP 92 Ca 0.63 0.01 -0.14 0.00 1.08 0.00 0.00 58.89 60.48 1xyf h TRP 92 Cb 1.21 -0.20 -0.02 0.00 -3.00 0.00 0.00 29.16 27.15 1xyf h TRP 92 CO -0.03 0.35 -0.68 1.98 -1.28 0.00 0.00 178.44 178.78 1xyf h MET 93 N 0.62 0.00 0.00 0.12 4.05 -1.24 -2.97 114.93 115.50 1xyf h MET 93 Ca 0.21 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.60 1xyf h MET 93 Cb 0.09 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 30.88 1xyf h MET 93 CO -0.06 0.68 -0.17 1.96 0.23 0.00 0.00 176.91 179.55 1xyf h GLN 94 N 0.00 0.00 -1.45 0.39 4.20 -0.82 -2.93 115.11 114.51 1xyf h GLN 94 Ca -0.01 0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.32 1xyf h GLN 94 Cb 1.38 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 29.00 1xyf h GLN 94 CO 0.09 0.17 0.49 0.43 -0.67 0.00 0.00 178.83 179.34 1xyf n SER 95 N -3.36 6.67 -4.01 1.46 7.64 -1.01 -4.87 113.62 116.14 1xyf n SER 95 Ca -0.00 -3.18 -0.09 0.00 1.01 0.00 0.00 58.87 56.60 1xyf n SER 95 Cb 0.38 -1.05 -0.08 0.00 -1.01 0.00 0.00 64.21 62.45 1xyf n SER 95 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1xyf s LEU 96 N -2.15 1.48 0.10 -3.43 1.43 -1.11 -5.04 118.68 109.96 1xyf s LEU 96 Ca 0.37 -0.95 -0.26 0.00 -1.03 0.00 0.00 54.13 52.26 1xyf s LEU 96 Cb 0.29 0.77 0.08 0.00 0.03 0.00 0.00 46.19 47.37 1xyf s LEU 96 CO -0.01 -0.78 1.09 -0.94 0.23 0.00 0.00 176.35 175.94 1xyf s SER 97 N -2.97 -0.09 0.73 2.29 1.04 -1.26 -4.86 113.70 108.58 1xyf s SER 97 Ca 0.16 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.22 1xyf s SER 97 Cb 0.05 0.38 0.00 0.00 0.10 0.00 0.00 66.02 66.55 1xyf s SER 97 CO -0.03 -0.71 0.00 0.61 0.98 0.00 0.00 173.24 174.09 1xyf n GLY 98 N -0.55 0.88 0.46 7.32 0.00 -1.26 -2.26 105.19 109.78 1xyf n GLY 98 Ca -0.06 -0.77 0.34 0.00 0.00 0.00 0.00 46.02 45.54 1xyf n GLY 98 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xyf h SER 99 N 2.07 0.27 -0.47 1.61 4.64 -1.98 0.37 113.55 120.07 1xyf h SER 99 Ca 0.00 0.12 -0.07 0.00 -0.47 0.00 0.00 61.79 61.37 1xyf h SER 99 Cb 0.00 0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 62.18 1xyf h SER 99 CO 0.00 -0.13 0.01 0.74 -0.87 0.00 0.00 176.83 176.58 1xyf h THR 100 N 0.14 1.26 -0.04 2.95 2.02 -1.95 -1.04 112.91 116.25 1xyf h THR 100 Ca 0.78 -1.04 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 1xyf h THR 100 Cb 2.38 1.01 -0.00 0.00 -1.74 0.00 0.00 68.15 69.80 1xyf h THR 100 CO -0.39 0.36 -0.01 0.25 0.37 0.00 0.00 175.52 176.10 1xyf h LEU 101 N 0.67 0.08 -0.66 2.58 5.85 0.14 -1.40 115.31 122.58 1xyf h LEU 101 Ca 0.13 -0.38 0.12 0.00 0.84 0.00 0.00 57.88 58.59 1xyf h LEU 101 Cb 0.49 -0.02 -0.09 0.00 0.37 0.00 0.00 40.66 41.41 1xyf h LEU 101 CO 0.02 0.45 0.19 -0.09 -0.34 0.00 0.00 178.44 178.67 1xyf h ARG 102 N -0.28 0.32 -0.55 1.25 9.65 -1.26 0.95 114.38 124.47 1xyf h ARG 102 Ca 0.01 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 58.84 1xyf h ARG 102 Cb 0.41 -0.07 -0.02 0.00 -1.39 0.00 0.00 29.97 28.89 1xyf h ARG 102 CO 0.00 0.21 0.21 0.37 2.80 0.00 0.00 179.97 183.57 1xyf h GLN 103 N 0.33 0.83 -0.41 0.20 5.75 -1.08 -2.14 115.11 118.60 1xyf h GLN 103 Ca 0.35 -0.16 0.00 0.00 -0.15 0.00 0.00 58.65 58.69 1xyf h GLN 103 Cb 0.52 -0.13 -0.02 0.00 1.07 0.00 0.00 27.48 28.92 1xyf h GLN 103 CO -0.40 0.73 0.26 0.00 -2.65 0.00 0.00 178.83 176.78 1xyf h ALA 104 N 1.06 0.51 -0.53 3.38 0.00 0.02 -0.58 119.26 123.12 1xyf h ALA 104 Ca 0.18 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 55.13 1xyf h ALA 104 Cb 0.22 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 1xyf h ALA 104 CO -0.01 -0.02 0.19 1.98 0.00 0.00 0.00 179.25 181.39 1xyf h MET 105 N 0.55 0.37 -0.57 0.00 1.85 -0.65 0.56 114.93 117.04 1xyf h MET 105 Ca 0.15 -0.02 -0.05 0.00 -0.61 0.00 0.00 59.70 59.17 1xyf h MET 105 Cb -0.05 -0.08 -0.02 0.00 0.43 0.00 0.00 31.60 31.87 1xyf h MET 105 CO -0.03 0.24 0.16 0.82 -0.40 0.00 0.00 176.91 177.70 1xyf h ILE 106 N 0.38 1.24 -0.55 1.77 2.04 -0.96 -1.86 117.51 119.57 1xyf h ILE 106 Ca 0.26 -0.84 -0.04 0.00 1.00 0.00 0.00 64.86 65.23 1xyf h ILE 106 Cb 0.28 0.71 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1xyf h ILE 106 CO -0.26 0.31 0.18 0.44 0.00 0.00 0.00 178.15 178.83 1xyf h ASP 107 N 0.81 0.79 -0.46 1.72 3.32 -0.42 -1.93 116.42 120.26 1xyf h ASP 107 Ca 0.18 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1xyf h ASP 107 Cb 0.31 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1xyf h ASP 107 CO -0.00 0.78 0.26 -0.74 -1.72 0.00 0.00 179.24 177.82 1xyf h HIS 108 N 0.76 0.62 -0.04 4.55 2.76 -0.74 0.96 115.15 124.03 1xyf h HIS 108 Ca 0.18 -0.01 0.01 0.00 -2.20 0.00 0.00 60.37 58.35 1xyf h HIS 108 Cb 0.27 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 1xyf h HIS 108 CO 0.02 0.46 -0.01 0.82 -1.30 0.00 0.00 177.93 177.91 1xyf h ILE 109 N 0.60 0.96 -0.38 6.26 2.04 -1.13 -0.41 117.51 125.45 1xyf h ILE 109 Ca 0.16 -0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.96 1xyf h ILE 109 Cb 0.04 0.96 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1xyf h ILE 109 CO -0.03 0.00 -0.02 0.78 0.00 0.00 0.00 178.15 178.88 1xyf h ASN 110 N 0.00 0.58 -0.03 1.72 2.35 -1.22 -0.92 115.58 118.06 1xyf h ASN 110 Ca 0.02 -0.13 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 1xyf h ASN 110 Cb 0.03 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.24 1xyf h ASN 110 CO -0.04 0.67 0.00 1.23 -1.65 0.00 0.00 177.43 177.64 1xyf h GLY 111 N 0.91 0.06 0.47 2.83 0.00 -0.43 -1.54 103.07 105.36 1xyf h GLY 111 Ca 0.12 -0.04 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 1xyf h GLY 111 CO 0.02 0.04 -0.02 -2.08 0.00 0.00 0.00 176.54 174.49 1xyf h VAL 112 N -0.22 1.27 0.00 4.60 2.07 -0.95 -2.79 116.25 120.24 1xyf h VAL 112 Ca 0.01 -1.17 -0.04 0.00 0.82 0.00 0.00 66.70 66.32 1xyf h VAL 112 Cb 0.29 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1xyf h VAL 112 CO 0.00 0.29 -0.19 0.24 0.02 0.00 0.00 177.57 177.93 1xyf h MET 113 N -0.60 0.00 -0.36 1.57 2.07 -1.28 -2.15 114.93 114.18 1xyf h MET 113 Ca -0.01 0.00 -0.09 0.00 -2.07 0.00 0.00 59.70 57.54 1xyf h MET 113 Cb 0.53 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 30.25 1xyf h MET 113 CO 0.01 0.19 -0.12 0.78 1.07 0.00 0.00 176.91 178.84 1xyf h GLY 114 N 0.77 0.77 1.17 8.32 0.00 -1.28 0.54 103.07 113.36 1xyf h GLY 114 Ca -0.00 -0.66 -0.04 0.00 0.00 0.00 0.00 47.33 46.64 1xyf h GLY 114 CO 0.02 0.60 0.31 0.84 0.00 0.00 0.00 176.54 178.31 1xyf h HIS 115 N 0.50 1.07 -0.63 5.60 6.17 -1.13 -2.94 115.15 123.78 1xyf h HIS 115 Ca 0.09 -0.06 0.00 0.00 0.71 0.00 0.00 60.37 61.10 1xyf h HIS 115 Cb 0.64 -0.33 0.00 0.00 2.52 0.00 0.00 27.41 30.24 1xyf h HIS 115 CO 0.05 0.80 0.00 0.66 0.71 0.00 0.00 177.93 180.15 1xyf n TYR 116 N -4.30 1.12 -1.58 5.26 4.01 -0.86 -5.03 117.16 115.77 1xyf n TYR 116 Ca 0.07 -0.56 -0.52 0.00 -0.16 0.00 0.00 57.90 56.73 1xyf n TYR 116 Cb 0.16 -0.11 -0.06 0.00 -0.31 0.00 0.00 39.34 39.02 1xyf n TYR 116 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1xyf n LYS 117 N 1.20 1.09 -0.57 -0.72 4.81 0.19 -1.59 118.16 122.57 1xyf n LYS 117 Ca 0.23 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 58.06 1xyf n LYS 117 Cb 0.72 -2.01 0.00 0.00 0.02 0.00 0.00 35.03 33.76 1xyf n LYS 117 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1xyf n GLY 118 N 2.40 1.33 0.00 3.14 0.00 -1.26 -4.84 105.19 105.96 1xyf n GLY 118 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1xyf n GLY 118 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1xyf n LYS 119 N -2.00 2.07 -4.43 1.61 2.85 -0.62 -4.98 118.16 112.66 1xyf n LYS 119 Ca 0.00 -1.26 -0.34 0.00 -1.05 0.00 0.00 58.31 55.67 1xyf n LYS 119 Cb 0.00 -0.99 -0.14 0.00 -0.65 0.00 0.00 35.03 33.25 1xyf n LYS 119 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1xyf s ILE 120 N -0.76 3.17 0.07 0.58 -1.09 -1.24 -4.70 121.20 117.22 1xyf s ILE 120 Ca 0.00 -0.60 -0.18 0.00 -2.23 0.00 0.00 60.65 57.64 1xyf s ILE 120 Cb 0.00 -2.37 -0.11 0.00 -1.58 0.00 0.00 42.46 38.39 1xyf s ILE 120 CO 0.00 0.49 1.39 0.00 -1.23 0.00 0.00 174.94 175.59 1xyf h ALA 121 N 7.22 0.31 -3.12 9.38 0.00 -1.60 -3.40 119.26 128.05 1xyf h ALA 121 Ca -0.32 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.06 1xyf h ALA 121 Cb 1.19 -0.07 -0.23 0.00 0.00 0.00 0.00 17.79 18.68 1xyf h ALA 121 CO 0.58 0.24 -0.64 -0.65 0.00 0.00 0.00 179.25 178.78 1xyf s GLN 122 N -4.38 0.27 -0.04 0.00 -0.21 -1.22 -1.67 119.66 112.42 1xyf s GLN 122 Ca -0.13 -0.35 0.06 0.00 0.02 0.00 0.00 55.36 54.96 1xyf s GLN 122 Cb 0.07 0.11 -0.01 0.00 1.00 0.00 0.00 33.01 34.17 1xyf s GLN 122 CO 0.78 -0.05 -0.21 -1.58 -2.12 0.00 0.00 175.29 172.11 1xyf s TRP 123 N -0.97 2.04 -0.87 0.91 0.52 0.28 0.67 118.94 121.51 1xyf s TRP 123 Ca -0.11 -0.55 -0.19 0.00 0.02 0.00 0.00 56.10 55.27 1xyf s TRP 123 Cb -0.06 -1.34 0.12 0.00 -1.15 0.00 0.00 33.47 31.03 1xyf s TRP 123 CO -0.00 -0.15 1.08 -0.51 0.02 0.00 0.00 176.95 177.39 1xyf s ASP 124 N -0.17 6.53 0.02 2.95 1.01 0.44 -0.65 116.67 126.80 1xyf s ASP 124 Ca -0.01 -1.84 -0.26 0.00 0.71 0.00 0.00 52.55 51.15 1xyf s ASP 124 Cb -0.12 -2.40 -0.17 0.00 1.01 0.00 0.00 42.92 41.25 1xyf s ASP 124 CO 0.02 -1.13 1.32 0.58 0.21 0.00 0.00 175.17 176.17 1xyf h VAL 125 N 5.86 0.67 -3.56 -1.27 2.07 -1.59 -2.28 116.25 116.15 1xyf h VAL 125 Ca 0.06 -0.49 -0.68 0.00 0.82 0.00 0.00 66.70 66.42 1xyf h VAL 125 Cb 1.03 0.91 -0.32 0.00 -1.52 0.00 0.00 31.29 31.40 1xyf h VAL 125 CO 1.12 0.09 -0.87 -0.69 0.02 0.00 0.00 177.57 177.24 1xyf s VAL 126 N -4.93 2.19 -0.07 2.57 1.01 -1.25 -1.00 120.40 118.92 1xyf s VAL 126 Ca -0.15 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 60.89 1xyf s VAL 126 Cb 0.03 -1.83 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 1xyf s VAL 126 CO 0.56 0.56 -0.23 0.21 0.00 0.00 0.00 175.10 176.20 1xyf s ASN 127 N 0.16 3.26 -1.26 3.32 2.47 -0.83 -1.56 114.94 120.51 1xyf s ASN 127 Ca -0.13 -0.47 -0.21 0.00 0.42 0.00 0.00 52.86 52.47 1xyf s ASN 127 Cb -0.16 -1.00 0.02 0.00 -1.45 0.00 0.00 41.25 38.65 1xyf s ASN 127 CO 0.07 0.23 0.60 -0.62 -3.72 0.00 0.00 177.10 173.66 1xyf n GLU 128 N 3.03 -1.11 0.07 0.43 1.02 -0.16 -4.51 120.64 119.41 1xyf n GLU 128 Ca -0.18 0.25 0.12 0.00 -0.02 0.00 0.00 57.16 57.33 1xyf n GLU 128 Cb 0.52 -3.47 0.18 0.00 -0.02 0.00 0.00 31.44 28.65 1xyf n GLU 128 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1xyf h ALA 129 N 1.15 0.61 -2.37 0.62 0.00 -1.90 -3.45 119.26 113.93 1xyf h ALA 129 Ca -0.68 0.00 -0.50 0.00 0.00 0.00 0.00 54.91 53.73 1xyf h ALA 129 Cb 1.39 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1xyf h ALA 129 CO 0.55 0.00 -0.28 -0.06 0.00 0.00 0.00 179.25 179.46 1xyf s PHE 130 N -3.17 3.48 0.54 0.00 0.40 -1.26 -0.67 117.98 117.30 1xyf s PHE 130 Ca 0.06 0.33 -0.07 0.00 -0.60 0.00 0.00 56.93 56.65 1xyf s PHE 130 Cb 0.13 -1.86 -0.03 0.00 0.51 0.00 0.00 43.02 41.77 1xyf s PHE 130 CO 0.71 0.28 0.88 0.45 0.70 0.00 0.00 175.22 178.24 1xyf s SER 131 N -3.57 6.21 0.00 1.36 0.15 0.58 -4.37 113.70 114.06 1xyf s SER 131 Ca 0.39 1.08 0.16 0.00 0.70 0.00 0.00 55.95 58.29 1xyf s SER 131 Cb -0.10 -2.29 0.12 0.00 -1.71 0.00 0.00 66.02 62.04 1xyf s SER 131 CO 0.32 -0.71 1.00 0.47 1.20 0.00 0.00 173.24 175.52 1xyf n ASP 132 N -2.45 2.30 0.00 5.45 8.00 -1.26 -4.60 116.55 123.99 1xyf n ASP 132 Ca 0.03 -1.65 0.01 0.00 0.71 0.00 0.00 54.79 53.88 1xyf n ASP 132 Cb 0.55 0.05 0.04 0.00 -0.02 0.00 0.00 41.12 41.74 1xyf n ASP 132 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1xyf n ASP 133 N 0.82 0.00 0.00 -2.24 5.68 -1.26 -4.80 116.55 114.75 1xyf n ASP 133 Ca 0.09 -0.96 0.00 0.00 -0.50 0.00 0.00 54.79 53.42 1xyf n ASP 133 Cb 0.41 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.39 1xyf n ASP 133 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1xyf n GLY 134 N 0.00 0.64 0.08 6.12 0.00 -1.26 -4.88 105.19 105.89 1xyf n GLY 134 Ca 0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.96 1xyf n GLY 134 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1xyf h SER 135 N 0.00 0.00 -0.11 1.61 4.64 -1.87 -3.45 113.55 114.37 1xyf h SER 135 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1xyf h SER 135 Cb 0.05 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.12 1xyf h SER 135 CO 0.00 0.94 -0.04 0.61 -0.87 0.00 0.00 176.83 177.47 1xyf n GLY 136 N 1.47 0.56 3.91 -0.77 0.00 -1.26 -4.91 105.19 104.19 1xyf n GLY 136 Ca -0.11 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.81 1xyf n GLY 136 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xyf s GLY 137 N -2.90 2.11 0.63 -0.02 0.00 -1.26 -4.34 107.32 101.55 1xyf s GLY 137 Ca 0.00 -1.81 -0.15 0.00 0.00 0.00 0.00 44.72 42.76 1xyf s GLY 137 CO 0.00 -1.70 1.09 0.50 0.00 0.00 0.00 173.10 172.99 1xyf s ARG 138 N -4.22 3.01 0.19 2.90 0.52 -1.26 -0.31 118.95 119.79 1xyf s ARG 138 Ca 0.49 1.32 -0.25 0.00 -0.52 0.00 0.00 55.73 56.77 1xyf s ARG 138 Cb -0.04 -1.98 -0.08 0.00 0.52 0.00 0.00 34.95 33.36 1xyf s ARG 138 CO 0.29 -1.07 0.79 -0.98 0.02 0.00 0.00 175.30 174.35 1xyf s ARG 139 N -4.08 4.54 -0.47 3.54 1.70 0.16 -4.37 118.95 119.96 1xyf s ARG 139 Ca 0.66 1.15 -0.28 0.00 -0.47 0.00 0.00 55.73 56.78 1xyf s ARG 139 Cb -0.19 -3.16 0.00 0.00 -0.57 0.00 0.00 34.95 31.04 1xyf s ARG 139 CO 0.40 0.51 1.56 0.34 -1.08 0.00 0.00 175.30 177.03 1xyf s ASP 140 N -1.28 6.04 0.24 -2.89 2.15 -1.26 -4.73 116.67 114.94 1xyf s ASP 140 Ca 0.39 0.70 0.02 0.00 0.43 0.00 0.00 52.55 54.09 1xyf s ASP 140 Cb -0.22 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 39.81 1xyf s ASP 140 CO 0.26 -1.70 0.04 -0.94 -0.17 0.00 0.00 175.17 172.65 1xyf s SER 141 N 5.10 1.54 0.52 -0.34 1.04 -1.26 -5.00 113.70 115.30 1xyf s SER 141 Ca 0.63 -1.29 0.17 0.00 0.48 0.00 0.00 55.95 55.94 1xyf s SER 141 Cb -0.15 0.08 1.30 0.00 0.10 0.00 0.00 66.02 67.35 1xyf s SER 141 CO 0.29 -0.61 2.16 -0.55 0.98 0.00 0.00 173.24 175.50 1xyf h ASN 142 N 2.44 0.00 -0.06 7.02 -1.07 -1.93 0.39 115.58 122.36 1xyf h ASN 142 Ca -0.38 0.00 -0.04 0.00 0.07 0.00 0.00 56.30 55.94 1xyf h ASN 142 Cb 1.23 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.48 1xyf h ASN 142 CO 0.63 0.00 -0.13 -0.07 0.07 0.00 0.00 177.43 177.93 1xyf h LEU 143 N 0.00 0.23 -1.53 6.14 3.38 -1.95 -2.86 115.31 118.71 1xyf h LEU 143 Ca 0.00 -0.57 -0.03 0.00 0.09 0.00 0.00 57.88 57.37 1xyf h LEU 143 Cb 0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 1xyf h LEU 143 CO -0.00 0.75 0.00 -0.61 0.09 0.00 0.00 178.44 178.67 1xyf h GLN 144 N -0.29 0.30 0.00 1.13 5.75 -1.63 -1.43 115.11 118.93 1xyf h GLN 144 Ca 0.00 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 1xyf h GLN 144 Cb 0.72 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.21 1xyf h GLN 144 CO 0.03 0.33 0.00 0.00 -2.65 0.00 0.00 178.83 176.54 1xyf h ARG 145 N 0.29 0.00 0.00 1.69 3.08 -0.84 -2.63 114.38 115.98 1xyf h ARG 145 Ca 0.07 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 1xyf h ARG 145 Cb 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1xyf h ARG 145 CO 0.00 0.00 -0.31 1.79 -1.07 0.00 0.00 179.97 180.38 1xyf h THR 146 N 0.00 0.62 0.00 2.04 1.35 -1.03 -3.45 112.91 112.44 1xyf h THR 146 Ca 0.00 -1.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.29 1xyf h THR 146 Cb 0.51 2.07 0.00 0.00 -1.73 0.00 0.00 68.15 69.01 1xyf h THR 146 CO 0.00 0.31 0.00 0.61 -0.25 0.00 0.00 175.52 176.19 1xyf n GLY 147 N 0.72 3.97 0.36 5.82 0.00 -0.99 -4.83 105.19 110.24 1xyf n GLY 147 Ca 0.01 -0.34 0.18 0.00 0.00 0.00 0.00 46.02 45.87 1xyf n GLY 147 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1xyf h ASN 148 N 0.00 0.00 -0.12 1.61 -1.24 -1.89 -1.27 115.58 112.67 1xyf h ASN 148 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1xyf h ASN 148 Cb 0.00 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.05 1xyf h ASN 148 CO 0.00 0.00 0.00 -0.90 -1.29 0.00 0.00 177.43 175.24 1xyf n ASP 149 N -3.56 0.78 -0.23 1.15 5.75 -1.26 -4.21 116.55 114.98 1xyf n ASP 149 Ca 0.03 -1.80 0.01 0.00 -0.01 0.00 0.00 54.79 53.03 1xyf n ASP 149 Cb 0.45 -0.08 0.25 0.00 -1.03 0.00 0.00 41.12 40.71 1xyf n ASP 149 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 1xyf h TRP 150 N 0.93 0.96 -0.12 2.11 5.08 -1.56 0.59 115.95 123.94 1xyf h TRP 150 Ca 0.00 0.02 -0.01 0.00 1.08 0.00 0.00 58.89 59.99 1xyf h TRP 150 Cb 0.21 -0.32 -0.01 0.00 -3.00 0.00 0.00 29.16 26.04 1xyf h TRP 150 CO 0.08 0.58 0.05 0.82 -1.28 0.00 0.00 178.44 178.69 1xyf h ILE 151 N 1.02 1.13 -0.53 0.12 2.04 -1.84 0.21 117.51 119.66 1xyf h ILE 151 Ca 0.30 -0.40 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 1xyf h ILE 151 Cb -0.04 1.19 -0.03 0.00 -0.74 0.00 0.00 36.82 37.20 1xyf h ILE 151 CO -0.08 0.12 0.31 -0.08 0.00 0.00 0.00 178.15 178.43 1xyf h GLU 152 N 0.05 0.73 -0.54 2.37 4.81 -1.71 -1.51 114.58 118.77 1xyf h GLU 152 Ca 0.04 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.22 1xyf h GLU 152 Cb 0.15 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.34 1xyf h GLU 152 CO -0.00 0.54 0.32 0.28 -0.73 0.00 0.00 179.01 179.41 1xyf h VAL 153 N 0.71 1.05 -0.25 0.32 2.07 -0.64 -0.28 116.25 119.23 1xyf h VAL 153 Ca 0.19 -0.22 0.01 0.00 0.82 0.00 0.00 66.70 67.50 1xyf h VAL 153 Cb 0.01 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 1xyf h VAL 153 CO -0.03 0.11 0.15 0.00 0.02 0.00 0.00 177.57 177.82 1xyf h ALA 154 N 1.24 0.32 -0.66 1.67 0.00 -0.01 0.16 119.26 121.98 1xyf h ALA 154 Ca 0.22 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1xyf h ALA 154 Cb 0.03 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1xyf h ALA 154 CO -0.10 -0.23 0.14 0.74 0.00 0.00 0.00 179.25 179.80 1xyf h PHE 155 N 0.31 1.10 -0.35 0.00 0.04 -0.97 0.70 116.94 117.77 1xyf h PHE 155 Ca 0.10 -0.13 -0.05 0.00 2.80 0.00 0.00 57.97 60.69 1xyf h PHE 155 Cb -0.01 -0.31 -0.01 0.00 2.20 0.00 0.00 35.95 37.81 1xyf h PHE 155 CO -0.07 0.91 0.04 0.00 -0.60 0.00 0.00 178.31 178.58 1xyf h ARG 156 N 0.99 0.59 -0.43 1.51 3.08 -0.72 -0.41 114.38 119.00 1xyf h ARG 156 Ca 0.21 -0.17 0.02 0.00 0.07 0.00 0.00 59.98 60.11 1xyf h ARG 156 Cb 0.37 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 1xyf h ARG 156 CO 0.00 0.68 0.25 1.15 -1.07 0.00 0.00 179.97 180.99 1xyf h THR 157 N 0.42 1.05 -0.16 2.04 2.02 -0.34 -2.35 112.91 115.58 1xyf h THR 157 Ca 0.10 -0.18 0.01 0.00 0.77 0.00 0.00 66.41 67.12 1xyf h THR 157 Cb 0.38 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 1xyf h THR 157 CO 0.01 0.09 0.07 0.00 0.37 0.00 0.00 175.52 176.07 1xyf h ALA 158 N 1.19 0.19 -0.79 6.16 0.00 -0.68 -0.95 119.26 124.38 1xyf h ALA 158 Ca 0.17 0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.17 1xyf h ALA 158 Cb 0.01 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.71 1xyf h ALA 158 CO -0.08 -0.36 0.45 -0.09 0.00 0.00 0.00 179.25 179.18 1xyf h ARG 159 N 0.17 0.75 -0.38 0.00 9.65 -0.83 -1.68 114.38 122.06 1xyf h ARG 159 Ca 0.07 -0.05 -0.05 0.00 -1.10 0.00 0.00 59.98 58.85 1xyf h ARG 159 Cb 0.02 -0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 28.41 1xyf h ARG 159 CO -0.05 0.50 0.03 0.00 2.80 0.00 0.00 179.97 183.25 1xyf h ALA 160 N 1.43 0.50 -0.77 2.80 0.00 -0.94 -2.86 119.26 119.43 1xyf h ALA 160 Ca 0.38 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 1xyf h ALA 160 Cb 0.32 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1xyf h ALA 160 CO -0.23 0.24 0.34 0.00 0.00 0.00 0.00 179.25 179.60 1xyf h ALA 161 N 0.89 1.16 -1.50 0.00 0.00 -0.53 -3.40 119.26 115.88 1xyf h ALA 161 Ca 0.11 -0.17 -0.20 0.00 0.00 0.00 0.00 54.91 54.66 1xyf h ALA 161 Cb 0.41 -0.30 -0.26 0.00 0.00 0.00 0.00 17.79 17.64 1xyf h ALA 161 CO 0.01 0.62 -0.55 0.34 0.00 0.00 0.00 179.25 179.68 1xyf s ASP 162 N -6.38 -0.14 0.15 0.00 2.15 -0.69 -4.70 116.67 107.05 1xyf s ASP 162 Ca -0.12 -0.94 0.19 0.00 0.43 0.00 0.00 52.55 52.11 1xyf s ASP 162 Cb 0.16 1.27 0.80 0.00 -0.30 0.00 0.00 42.92 44.85 1xyf s ASP 162 CO 0.82 -0.25 1.58 -0.81 -0.17 0.00 0.00 175.17 176.34 1xyf n PRO 163 N 4.61 0.11 0.17 4.34 -0.04 -1.08 -2.79 135.00 140.31 1xyf n PRO 163 Ca 0.09 0.37 0.06 0.00 -0.04 0.00 0.00 63.50 63.97 1xyf n PRO 163 Cb 0.51 -1.71 0.12 0.00 -0.04 0.00 0.00 33.50 32.38 1xyf n PRO 163 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1xyf h ALA 164 N 2.34 0.80 -2.47 0.55 0.00 -1.95 -3.46 119.26 115.06 1xyf h ALA 164 Ca 0.00 -0.31 -0.51 0.00 0.00 0.00 0.00 54.91 54.09 1xyf h ALA 164 Cb 0.29 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1xyf h ALA 164 CO 0.00 0.43 0.14 0.00 0.00 0.00 0.00 179.25 179.82 1xyf s ALA 165 N -3.11 3.36 -0.00 0.00 0.00 -1.12 -4.98 121.76 115.91 1xyf s ALA 165 Ca 0.04 0.20 -0.27 0.00 0.00 0.00 0.00 51.96 51.93 1xyf s ALA 165 Cb 0.07 -2.86 -0.04 0.00 0.00 0.00 0.00 23.12 20.29 1xyf s ALA 165 CO 0.71 0.30 0.84 0.15 0.00 0.00 0.00 175.76 177.76 1xyf s LYS 166 N -2.17 4.52 -0.27 0.00 1.02 -0.67 -4.94 119.74 117.23 1xyf s LYS 166 Ca 0.46 1.17 -0.10 0.00 0.02 0.00 0.00 55.97 57.52 1xyf s LYS 166 Cb -0.16 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.68 1xyf s LYS 166 CO 0.21 0.08 0.15 -0.51 -0.92 0.00 0.00 175.35 174.36 1xyf s LEU 167 N 0.62 3.84 0.23 3.17 1.43 -1.26 -0.56 118.68 126.15 1xyf s LEU 167 Ca 0.44 -0.09 0.10 0.00 -1.03 0.00 0.00 54.13 53.55 1xyf s LEU 167 Cb -0.20 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.92 1xyf s LEU 167 CO 0.24 -0.05 -0.12 0.00 0.23 0.00 0.00 176.35 176.65 1xyf s TYR 169 N -2.04 3.14 -0.06 0.00 5.04 -0.71 -1.56 117.35 121.15 1xyf s TYR 169 Ca 0.27 -0.14 0.05 0.00 -2.44 0.00 0.00 57.07 54.80 1xyf s TYR 169 Cb -0.07 -2.04 -0.02 0.00 0.35 0.00 0.00 41.96 40.18 1xyf s TYR 169 CO 0.15 0.02 -0.19 1.21 -1.34 0.00 0.00 175.55 175.40 1xyf s ASN 170 N 0.50 3.57 0.12 4.32 2.47 -0.60 -0.38 114.94 124.93 1xyf s ASN 170 Ca 0.00 -0.35 -0.25 0.00 0.42 0.00 0.00 52.86 52.68 1xyf s ASN 170 Cb -0.13 -0.84 0.08 0.00 -1.45 0.00 0.00 41.25 38.90 1xyf s ASN 170 CO 0.02 0.29 0.70 -0.62 -3.72 0.00 0.00 177.10 173.76 1xyf s ASP 171 N -0.41 -0.49 0.34 -4.21 -1.08 -1.10 -0.99 116.67 108.74 1xyf s ASP 171 Ca 0.04 -0.04 0.08 0.00 -0.52 0.00 0.00 52.55 52.12 1xyf s ASP 171 Cb -0.12 0.54 -0.04 0.00 -1.46 0.00 0.00 42.92 41.84 1xyf s ASP 171 CO 0.02 -0.89 0.16 -0.72 0.52 0.00 0.00 175.17 174.27 1xyf s TYR 172 N -3.57 2.73 -1.57 -5.34 1.13 -1.26 -1.65 117.35 107.83 1xyf s TYR 172 Ca 0.03 -0.37 -0.03 0.00 -1.41 0.00 0.00 57.07 55.28 1xyf s TYR 172 Cb -0.01 -1.66 0.01 0.00 -1.10 0.00 0.00 41.96 39.19 1xyf s TYR 172 CO -0.11 0.32 0.39 0.09 -2.51 0.00 0.00 175.55 173.73 1xyf n ASN 173 N -1.18 -5.71 -0.20 -0.18 5.03 -1.26 -4.85 115.26 106.90 1xyf n ASN 173 Ca -0.03 -0.19 0.08 0.00 0.87 0.00 0.00 54.58 55.32 1xyf n ASN 173 Cb 0.61 -4.67 0.13 0.00 -1.02 0.00 0.00 39.78 34.82 1xyf n ASN 173 CO 0.00 0.00 0.00 2.30 -1.83 0.00 0.00 177.26 177.73 1xyf n ILE 174 N -4.25 1.63 0.02 2.41 -5.35 -1.26 -4.34 119.36 108.21 1xyf n ILE 174 Ca -0.15 -2.03 -0.15 0.00 -0.27 0.00 0.00 62.75 60.16 1xyf n ILE 174 Cb 0.63 -0.12 -0.14 0.00 -1.74 0.00 0.00 39.64 38.27 1xyf n ILE 174 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1xyf h GLU 175 N 0.10 0.16 -5.79 6.28 3.07 -1.93 -3.45 114.58 113.02 1xyf h GLU 175 Ca -0.00 -0.27 -0.60 0.00 -0.50 0.00 0.00 59.36 57.99 1xyf h GLU 175 Cb 1.07 0.10 -0.09 0.00 -0.84 0.00 0.00 28.75 28.98 1xyf h GLU 175 CO 0.00 0.92 0.44 1.21 -1.40 0.00 0.00 179.01 180.18 1xyf s ASN 176 N -6.67 6.74 0.42 1.42 3.84 -1.26 -4.17 114.94 115.26 1xyf s ASN 176 Ca -0.11 0.84 0.15 0.00 0.21 0.00 0.00 52.86 53.95 1xyf s ASN 176 Cb 0.07 -2.42 1.02 0.00 -0.55 0.00 0.00 41.25 39.37 1xyf s ASN 176 CO 0.82 -0.57 1.92 -0.25 -2.79 0.00 0.00 177.10 176.22 1xyf h TRP 177 N 7.92 0.52 0.00 0.43 2.91 -1.87 -1.81 115.95 124.06 1xyf h TRP 177 Ca -0.24 0.01 0.00 0.00 1.13 0.00 0.00 58.89 59.80 1xyf h TRP 177 Cb 1.09 -0.17 0.00 0.00 -0.51 0.00 0.00 29.16 29.58 1xyf h TRP 177 CO 0.77 0.20 0.00 1.79 -1.03 0.00 0.00 178.44 180.17 1xyf h THR 178 N 0.45 0.00 -3.90 2.65 1.35 -1.94 -3.41 112.91 108.10 1xyf h THR 178 Ca 0.38 -0.37 -0.52 0.00 -0.55 0.00 0.00 66.41 65.35 1xyf h THR 178 Cb 0.83 1.22 0.06 0.00 -1.73 0.00 0.00 68.15 68.53 1xyf h THR 178 CO -0.13 0.00 0.61 0.26 -0.25 0.00 0.00 175.52 176.01 1xyf s TRP 179 N -3.26 3.03 0.46 4.73 0.51 -0.68 -4.91 118.94 118.82 1xyf s TRP 179 Ca 0.06 1.45 0.11 0.00 -2.12 0.00 0.00 56.10 55.60 1xyf s TRP 179 Cb 0.10 -3.63 1.05 0.00 -0.81 0.00 0.00 33.47 30.18 1xyf s TRP 179 CO 0.49 -1.78 2.09 0.00 -0.51 0.00 0.00 176.95 177.24 1xyf h ALA 180 N 3.18 1.86 -0.31 0.98 0.00 -1.88 -2.09 119.26 120.99 1xyf h ALA 180 Ca -0.49 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.24 1xyf h ALA 180 Cb 1.23 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 1xyf h ALA 180 CO 0.65 0.12 -0.46 -0.22 0.00 0.00 0.00 179.25 179.34 1xyf h LYS 181 N 0.31 0.83 -0.73 0.00 3.64 -1.87 -1.44 116.57 117.31 1xyf h LYS 181 Ca 0.10 -0.47 -0.01 0.00 -1.27 0.00 0.00 60.65 58.99 1xyf h LYS 181 Cb 0.01 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 1xyf h LYS 181 CO -0.02 1.11 0.40 1.15 -2.27 0.00 0.00 179.45 179.82 1xyf h THR 182 N 0.66 1.22 -0.53 1.00 2.02 -1.59 -1.62 112.91 114.08 1xyf h THR 182 Ca 0.04 -0.56 -0.07 0.00 0.77 0.00 0.00 66.41 66.59 1xyf h THR 182 Cb 1.05 0.26 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1xyf h THR 182 CO 0.10 0.25 0.07 1.56 0.37 0.00 0.00 175.52 177.87 1xyf h GLN 183 N 1.01 0.89 -0.22 6.66 1.08 -1.36 -0.24 115.11 122.93 1xyf h GLN 183 Ca 0.26 -0.25 0.02 0.00 -1.45 0.00 0.00 58.65 57.22 1xyf h GLN 183 Cb 0.04 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 1xyf h GLN 183 CO -0.04 0.88 0.10 0.78 -0.95 0.00 0.00 178.83 179.60 1xyf h GLY 184 N 0.78 0.28 0.84 3.46 0.00 -0.78 0.39 103.07 108.04 1xyf h GLY 184 Ca 0.16 -0.07 -0.03 0.00 0.00 0.00 0.00 47.33 47.39 1xyf h GLY 184 CO 0.01 0.06 0.02 -2.08 0.00 0.00 0.00 176.54 174.55 1xyf h VAL 185 N 0.22 1.24 -0.25 4.60 2.07 -1.17 -2.44 116.25 120.52 1xyf h VAL 185 Ca 0.09 -0.81 0.06 0.00 0.82 0.00 0.00 66.70 66.86 1xyf h VAL 185 Cb 0.03 1.36 -0.06 0.00 -1.52 0.00 0.00 31.29 31.10 1xyf h VAL 185 CO -0.07 0.25 -0.17 0.22 0.02 0.00 0.00 177.57 177.82 1xyf h TYR 186 N 0.14 -0.42 -0.70 1.57 3.20 -0.81 -0.96 116.97 119.00 1xyf h TYR 186 Ca 0.06 0.03 0.07 0.00 3.14 0.00 0.00 58.73 62.04 1xyf h TYR 186 Cb 0.36 0.22 -0.04 0.00 1.54 0.00 0.00 36.73 38.81 1xyf h TYR 186 CO 0.03 -0.24 0.46 -0.91 -1.64 0.00 0.00 178.16 175.86 1xyf h ASN 187 N -0.15 0.60 -0.25 -2.11 2.35 -0.82 -0.29 115.58 114.90 1xyf h ASN 187 Ca 0.14 0.01 -0.08 0.00 -0.55 0.00 0.00 56.30 55.82 1xyf h ASN 187 Cb 0.36 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1xyf h ASN 187 CO -0.34 0.38 -0.15 -0.03 -1.65 0.00 0.00 177.43 175.65 1xyf h MET 188 N 0.68 0.54 -0.68 0.81 4.05 -0.72 -1.48 114.93 118.13 1xyf h MET 188 Ca 0.31 -0.25 -0.08 0.00 -0.28 0.00 0.00 59.70 59.40 1xyf h MET 188 Cb 0.32 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 31.08 1xyf h MET 188 CO -0.10 0.81 0.12 0.28 0.23 0.00 0.00 176.91 178.25 1xyf h VAL 189 N 0.26 1.26 -0.03 -5.77 2.07 -0.74 0.68 116.25 113.99 1xyf h VAL 189 Ca 0.05 -1.04 0.03 0.00 0.82 0.00 0.00 66.70 66.56 1xyf h VAL 189 Cb 0.66 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.01 1xyf h VAL 189 CO 0.04 0.39 -0.15 -0.09 0.02 0.00 0.00 177.57 177.79 1xyf h ARG 190 N 1.05 -0.22 0.07 1.57 1.12 -0.99 0.11 114.38 117.10 1xyf h ARG 190 Ca 0.21 0.02 0.00 0.00 -1.11 0.00 0.00 59.98 59.10 1xyf h ARG 190 Cb 0.44 0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.44 1xyf h ARG 190 CO 0.01 -0.15 -0.08 0.22 -3.11 0.00 0.00 179.97 176.87 1xyf h ASP 191 N -0.23 -0.21 -0.58 -3.80 3.58 -0.96 -1.34 116.42 112.88 1xyf h ASP 191 Ca 0.06 0.02 0.10 0.00 0.42 0.00 0.00 57.03 57.63 1xyf h ASP 191 Cb 0.31 0.08 -0.07 0.00 1.72 0.00 0.00 39.33 41.36 1xyf h ASP 191 CO -0.16 -0.12 0.18 -0.26 -2.88 0.00 0.00 179.24 175.99 1xyf h PHE 192 N -0.17 0.30 -0.15 0.28 -1.00 -0.58 0.89 116.94 116.51 1xyf h PHE 192 Ca 0.01 0.03 -0.08 0.00 2.81 0.00 0.00 57.97 60.74 1xyf h PHE 192 Cb 0.17 -0.05 -0.01 0.00 3.61 0.00 0.00 35.95 39.67 1xyf h PHE 192 CO -0.11 0.05 -0.28 0.87 -1.61 0.00 0.00 178.31 177.23 1xyf h LYS 193 N 0.34 0.28 -0.39 1.51 1.79 -0.72 0.26 116.57 119.63 1xyf h LYS 193 Ca 0.29 -0.10 -0.13 0.00 -2.18 0.00 0.00 60.65 58.54 1xyf h LYS 193 Cb 0.39 -0.02 -0.01 0.00 -1.58 0.00 0.00 32.23 31.01 1xyf h LYS 193 CO -0.33 0.54 -0.26 1.96 -1.08 0.00 0.00 179.45 180.28 1xyf h GLN 194 N 0.25 0.87 -0.33 3.15 4.20 0.04 -3.12 115.11 120.17 1xyf h GLN 194 Ca 0.04 -0.41 0.00 0.00 0.06 0.00 0.00 58.65 58.34 1xyf h GLN 194 Cb 0.62 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.39 1xyf h GLN 194 CO 0.05 1.05 0.00 0.54 -0.67 0.00 0.00 178.83 179.80 1xyf n ARG 195 N -4.18 1.88 -1.18 1.46 1.74 0.15 -4.94 116.66 111.59 1xyf n ARG 195 Ca -0.02 -1.36 -0.06 0.00 -0.77 0.00 0.00 57.85 55.64 1xyf n ARG 195 Cb 0.47 -1.34 -0.03 0.00 -1.02 0.00 0.00 32.46 30.54 1xyf n ARG 195 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xyf n GLY 196 N 1.14 0.82 3.73 -0.13 0.00 -0.31 -4.99 105.19 105.46 1xyf n GLY 196 Ca 0.14 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 1xyf n GLY 196 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xyf s VAL 197 N -2.05 2.65 -0.86 1.61 1.01 0.77 -4.89 120.40 118.64 1xyf s VAL 197 Ca 0.00 0.49 -0.25 0.00 0.00 0.00 0.00 61.98 62.22 1xyf s VAL 197 Cb 0.00 -3.32 -0.06 0.00 0.00 0.00 0.00 36.38 33.00 1xyf s VAL 197 CO 0.00 0.05 2.02 -2.84 0.00 0.00 0.00 175.10 174.34 1xyf s PRO 198 N 0.60 2.40 -0.09 2.72 0.02 -1.26 -4.52 135.00 134.86 1xyf s PRO 198 Ca 0.66 -0.08 -0.00 0.00 0.02 0.00 0.00 61.00 61.60 1xyf s PRO 198 Cb -0.43 -4.96 0.02 0.00 0.02 0.00 0.00 34.50 29.15 1xyf s PRO 198 CO 0.36 -3.51 -0.06 -1.50 -0.33 0.00 0.00 177.00 171.96 1xyf s ILE 199 N 10.81 0.86 -0.12 2.83 2.07 -1.26 -4.73 121.20 131.65 1xyf s ILE 199 Ca 0.74 -0.21 0.20 0.00 -1.41 0.00 0.00 60.65 59.96 1xyf s ILE 199 Cb -0.08 -0.89 -0.28 0.00 0.13 0.00 0.00 42.46 41.33 1xyf s ILE 199 CO 0.03 0.33 0.31 0.47 -1.91 0.00 0.00 174.94 174.16 1xyf n ASP 200 N 4.73 0.05 -3.68 4.50 8.00 0.21 -4.90 116.55 125.46 1xyf n ASP 200 Ca -0.14 0.02 -0.10 0.00 0.71 0.00 0.00 54.79 55.28 1xyf n ASP 200 Cb 0.50 1.41 -0.04 0.00 -0.02 0.00 0.00 41.12 42.98 1xyf n ASP 200 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xyf s VAL 202 N -3.85 1.52 -0.16 0.00 1.01 -0.64 -1.74 120.40 116.54 1xyf s VAL 202 Ca 0.07 -0.64 -0.14 0.00 0.00 0.00 0.00 61.98 61.27 1xyf s VAL 202 Cb -0.00 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.94 1xyf s VAL 202 CO -0.06 0.45 0.30 -0.83 0.00 0.00 0.00 175.10 174.95 1xyf s GLY 203 N 1.09 2.21 -0.39 4.51 0.00 0.48 -1.97 107.32 113.25 1xyf s GLY 203 Ca -0.04 -0.45 -0.10 0.00 0.00 0.00 0.00 44.72 44.13 1xyf s GLY 203 CO -0.03 0.44 0.23 -1.36 0.00 0.00 0.00 173.10 172.37 1xyf s PHE 204 N 0.47 3.29 0.25 1.90 0.40 0.36 -2.69 117.98 121.96 1xyf s PHE 204 Ca 0.17 -1.27 -0.03 0.00 -0.60 0.00 0.00 56.93 55.19 1xyf s PHE 204 Cb -0.13 -2.68 0.52 0.00 0.51 0.00 0.00 43.02 41.24 1xyf s PHE 204 CO 0.04 -0.75 1.69 1.96 0.70 0.00 0.00 175.22 178.85 1xyf h GLN 205 N 8.41 0.29 -4.64 0.44 4.20 -1.61 -1.45 115.11 120.75 1xyf h GLN 205 Ca -0.24 -0.02 -0.26 0.00 0.06 0.00 0.00 58.65 58.19 1xyf h GLN 205 Cb 1.09 -0.07 0.12 0.00 0.30 0.00 0.00 27.48 28.92 1xyf h GLN 205 CO 0.71 0.19 -0.54 0.43 -0.67 0.00 0.00 178.83 178.95 1xyf n SER 206 N -5.13 -3.36 -4.44 1.46 7.64 -1.26 -0.97 113.62 107.55 1xyf n SER 206 Ca 0.16 -0.43 -0.44 0.00 1.01 0.00 0.00 58.87 59.17 1xyf n SER 206 Cb 0.50 -3.88 -0.03 0.00 -1.01 0.00 0.00 64.21 59.79 1xyf n SER 206 CO 0.00 0.00 0.00 -1.00 -3.01 0.00 0.00 175.04 171.03 1xyf s HIS 207 N -3.25 3.02 0.02 1.43 3.76 -1.26 -2.84 115.29 116.17 1xyf s HIS 207 Ca 0.18 -1.18 -0.10 0.00 -0.15 0.00 0.00 55.06 53.81 1xyf s HIS 207 Cb -0.08 -4.26 -0.05 0.00 1.11 0.00 0.00 32.58 29.30 1xyf s HIS 207 CO 0.54 -1.51 0.35 -0.06 -0.85 0.00 0.00 174.74 173.21 1xyf s PHE 208 N 2.96 3.62 0.17 1.40 0.08 -0.68 -4.86 117.98 120.68 1xyf s PHE 208 Ca 0.29 0.77 -0.20 0.00 0.12 0.00 0.00 56.93 57.91 1xyf s PHE 208 Cb -0.09 -2.13 0.07 0.00 -0.57 0.00 0.00 43.02 40.30 1xyf s PHE 208 CO -0.04 0.59 0.94 0.27 -0.10 0.00 0.00 175.22 176.88 1xyf n ASN 209 N 1.29 -1.59 0.30 1.36 0.23 -0.97 -1.25 115.26 114.63 1xyf n ASN 209 Ca -0.11 -1.83 0.19 0.00 -0.53 0.00 0.00 54.58 52.30 1xyf n ASN 209 Cb 0.53 2.58 0.90 0.00 -2.08 0.00 0.00 39.78 41.70 1xyf n ASN 209 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1xyf h SER 210 N 1.80 0.00 0.42 0.53 4.64 -1.98 -0.38 113.55 118.58 1xyf h SER 210 Ca -0.25 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 60.82 1xyf h SER 210 Cb 1.10 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.19 1xyf h SER 210 CO 0.33 0.00 -1.07 1.23 -0.87 0.00 0.00 176.83 176.45 1xyf h GLY 211 N 1.19 0.43 -6.46 -0.77 0.00 -1.98 -3.38 103.07 92.10 1xyf h GLY 211 Ca 0.00 -0.86 -0.59 0.00 0.00 0.00 0.00 47.33 45.88 1xyf h GLY 211 CO 0.00 0.76 -0.90 1.44 0.00 0.00 0.00 176.54 177.84 1xyf n SER 212 N -3.68 0.44 -4.82 0.19 7.64 -0.98 -5.13 113.62 107.27 1xyf n SER 212 Ca -0.08 -2.62 -0.30 0.00 1.01 0.00 0.00 58.87 56.89 1xyf n SER 212 Cb 0.91 -0.61 0.08 0.00 -1.01 0.00 0.00 64.21 63.58 1xyf n SER 212 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1xyf s PRO 213 N -0.48 2.29 0.27 1.43 0.04 -0.19 -2.29 135.00 136.08 1xyf s PRO 213 Ca 0.32 0.61 -0.29 0.00 0.04 0.00 0.00 61.00 61.67 1xyf s PRO 213 Cb 0.04 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.54 1xyf s PRO 213 CO -0.18 -1.47 1.12 -0.47 0.04 0.00 0.00 177.00 176.04 1xyf s TYR 214 N -3.20 3.53 0.05 0.56 5.04 -1.26 -4.88 117.35 117.18 1xyf s TYR 214 Ca 0.60 1.65 0.06 0.00 -2.44 0.00 0.00 57.07 56.94 1xyf s TYR 214 Cb -0.14 -3.32 -0.02 0.00 0.35 0.00 0.00 41.96 38.83 1xyf s TYR 214 CO 0.54 -0.70 -0.17 1.21 -1.34 0.00 0.00 175.55 175.09 1xyf s ASN 215 N -0.73 2.01 0.63 4.32 3.84 -1.26 -5.02 114.94 118.72 1xyf s ASN 215 Ca 0.46 -0.50 0.38 0.00 0.21 0.00 0.00 52.86 53.41 1xyf s ASN 215 Cb -0.32 -0.14 2.12 0.00 -0.55 0.00 0.00 41.25 42.36 1xyf s ASN 215 CO 0.41 0.07 2.30 0.77 -2.79 0.00 0.00 177.10 177.86 1xyf h SER 216 N 4.82 0.00 0.00 -4.21 4.64 -1.98 -1.58 113.55 115.24 1xyf h SER 216 Ca -0.40 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 1xyf h SER 216 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1xyf h SER 216 CO 0.43 0.01 0.00 -0.46 -0.87 0.00 0.00 176.83 175.94 1xyf n ASN 217 N -3.35 0.00 -0.15 4.97 0.23 -1.26 -2.42 115.26 113.28 1xyf n ASN 217 Ca -0.03 -0.47 -0.03 0.00 -0.53 0.00 0.00 54.58 53.52 1xyf n ASN 217 Cb 0.10 0.00 0.19 0.00 -2.08 0.00 0.00 39.78 37.99 1xyf n ASN 217 CO 0.00 0.00 0.00 0.15 -0.93 0.00 0.00 177.26 176.48 1xyf h PHE 218 N 0.00 0.89 -0.70 -2.53 3.57 -1.44 -1.22 116.94 115.50 1xyf h PHE 218 Ca 0.00 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.41 1xyf h PHE 218 Cb 0.00 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.44 1xyf h PHE 218 CO 0.00 0.71 0.37 -0.09 -2.23 0.00 0.00 178.31 177.07 1xyf h ARG 219 N 0.85 0.98 -0.35 1.11 2.43 -1.74 -1.20 114.38 116.45 1xyf h ARG 219 Ca 0.19 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 1xyf h ARG 219 Cb 0.24 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1xyf h ARG 219 CO -0.01 0.73 0.01 1.15 -1.51 0.00 0.00 179.97 180.34 1xyf h THR 220 N 0.98 1.26 -0.11 0.20 2.02 -1.49 -0.45 112.91 115.32 1xyf h THR 220 Ca 0.25 -0.96 0.01 0.00 0.77 0.00 0.00 66.41 66.48 1xyf h THR 220 Cb 0.05 1.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1xyf h THR 220 CO -0.04 0.32 0.02 0.74 0.37 0.00 0.00 175.52 176.93 1xyf h THR 221 N 0.43 0.96 -0.58 3.16 2.02 -0.85 0.86 112.91 118.91 1xyf h THR 221 Ca 0.10 -0.02 0.03 0.00 0.77 0.00 0.00 66.41 67.28 1xyf h THR 221 Cb 0.45 0.88 -0.04 0.00 -1.74 0.00 0.00 68.15 67.70 1xyf h THR 221 CO 0.02 0.01 0.35 -0.07 0.37 0.00 0.00 175.52 176.20 1xyf h LEU 222 N 0.07 0.57 -0.65 2.58 3.38 -1.11 -1.21 115.31 118.93 1xyf h LEU 222 Ca 0.05 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.92 1xyf h LEU 222 Cb 0.04 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1xyf h LEU 222 CO -0.06 0.40 -0.11 1.56 0.09 0.00 0.00 178.44 180.31 1xyf h GLN 223 N 0.69 0.94 -0.53 1.13 4.20 -0.78 -0.91 115.11 119.86 1xyf h GLN 223 Ca 0.24 -0.34 -0.07 0.00 0.06 0.00 0.00 58.65 58.54 1xyf h GLN 223 Cb 0.03 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 1xyf h GLN 223 CO -0.10 0.99 0.04 -0.91 -0.67 0.00 0.00 178.83 178.18 1xyf h ASN 224 N 0.84 0.88 -0.31 1.46 2.35 -0.49 -0.66 115.58 119.63 1xyf h ASN 224 Ca 0.13 -0.29 -0.08 0.00 -0.55 0.00 0.00 56.30 55.52 1xyf h ASN 224 Cb 0.65 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.77 1xyf h ASN 224 CO 0.04 0.95 -0.10 -0.26 -1.65 0.00 0.00 177.43 176.41 1xyf h PHE 225 N 0.78 0.70 0.00 1.19 -1.00 -1.16 -2.88 116.94 114.58 1xyf h PHE 225 Ca 0.15 -0.16 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1xyf h PHE 225 Cb 0.47 -0.17 -0.00 0.00 3.61 0.00 0.00 35.95 39.86 1xyf h PHE 225 CO 0.03 0.81 -0.07 0.00 -1.61 0.00 0.00 178.31 177.48 1xyf h ALA 226 N 0.79 1.82 0.00 2.45 0.00 -1.00 -0.79 119.26 122.53 1xyf h ALA 226 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1xyf h ALA 226 Cb 0.60 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1xyf h ALA 226 CO 0.04 0.09 0.00 0.00 0.00 0.00 0.00 179.25 179.38 1xyf h ALA 227 N 1.93 1.00 -0.00 0.00 0.00 -0.89 -2.21 119.26 119.08 1xyf h ALA 227 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xyf h ALA 227 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1xyf h ALA 227 CO 0.01 0.00 -0.11 1.28 0.00 0.00 0.00 179.25 180.43 1xyf n LEU 228 N -2.56 0.16 0.00 0.00 4.77 -0.30 -4.92 117.00 114.15 1xyf n LEU 228 Ca 0.01 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 1xyf n LEU 228 Cb 0.24 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1xyf n LEU 228 CO 0.22 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.93 1xyf n GLY 229 N 1.43 0.96 3.68 -0.72 0.00 -0.83 -5.00 105.19 104.72 1xyf n GLY 229 Ca 0.09 -0.02 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 1xyf n GLY 229 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1xyf s VAL 230 N -2.00 3.81 0.54 1.61 -7.23 -1.25 -4.99 120.40 110.89 1xyf s VAL 230 Ca 0.00 -1.38 -0.10 0.00 -1.81 0.00 0.00 61.98 58.69 1xyf s VAL 230 Cb 0.00 -2.92 -0.05 0.00 0.56 0.00 0.00 36.38 33.97 1xyf s VAL 230 CO 0.00 -0.11 0.92 -1.81 -0.31 0.00 0.00 175.10 173.80 1xyf s ASP 231 N -2.95 6.34 0.10 4.85 1.01 -0.42 -4.14 116.67 121.47 1xyf s ASP 231 Ca 0.28 1.27 0.08 0.00 0.71 0.00 0.00 52.55 54.89 1xyf s ASP 231 Cb -0.09 -2.40 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 1xyf s ASP 231 CO 0.19 -0.69 -0.21 0.68 0.21 0.00 0.00 175.17 175.36 1xyf s VAL 232 N -2.87 1.70 -0.04 -1.27 -7.23 -0.49 -1.63 120.40 108.57 1xyf s VAL 232 Ca 0.53 -1.56 -0.05 0.00 -1.81 0.00 0.00 61.98 59.09 1xyf s VAL 232 Cb -0.11 -1.56 0.01 0.00 0.56 0.00 0.00 36.38 35.29 1xyf s VAL 232 CO 0.45 -0.08 0.13 0.00 -0.31 0.00 0.00 175.10 175.29 1xyf s ALA 233 N -1.22 -0.33 -0.43 1.32 0.00 -0.83 -1.38 121.76 118.89 1xyf s ALA 233 Ca 0.07 0.29 -0.19 0.00 0.00 0.00 0.00 51.96 52.13 1xyf s ALA 233 Cb -0.10 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.88 1xyf s ALA 233 CO 0.04 -0.09 0.54 0.42 0.00 0.00 0.00 175.76 176.68 1xyf s ILE 234 N -0.17 4.95 -0.18 0.00 1.01 -0.85 -0.49 121.20 125.47 1xyf s ILE 234 Ca -0.02 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.55 1xyf s ILE 234 Cb -0.02 -4.13 -0.22 0.00 0.01 0.00 0.00 42.46 38.10 1xyf s ILE 234 CO 0.00 -0.52 0.11 0.35 0.00 0.00 0.00 174.94 174.89 1xyf n THR 235 N 5.65 1.57 -2.59 2.92 -2.24 -0.55 -0.46 114.28 118.59 1xyf n THR 235 Ca -0.04 -0.68 -0.11 0.00 -2.27 0.00 0.00 64.05 60.95 1xyf n THR 235 Cb 0.48 -1.28 0.03 0.00 -2.10 0.00 0.00 70.33 67.45 1xyf n THR 235 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1xyf n GLU 236 N -3.20 2.11 -1.80 -0.78 1.02 -0.15 -4.51 120.64 113.34 1xyf n GLU 236 Ca -0.36 -3.69 -0.42 0.00 -0.02 0.00 0.00 57.16 52.68 1xyf n GLU 236 Cb 1.05 -1.70 -0.03 0.00 -0.02 0.00 0.00 31.44 30.74 1xyf n GLU 236 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1xyf s LEU 237 N -3.51 4.37 -0.28 -4.62 2.96 -0.30 -4.24 118.68 113.06 1xyf s LEU 237 Ca 0.34 2.81 -0.23 0.00 -0.22 0.00 0.00 54.13 56.83 1xyf s LEU 237 Cb 0.39 -3.60 0.09 0.00 0.50 0.00 0.00 46.19 43.57 1xyf s LEU 237 CO -0.02 -0.92 0.84 1.51 -1.32 0.00 0.00 176.35 176.44 1xyf s ASP 238 N 1.03 -0.66 -0.15 3.68 1.47 -1.13 -0.66 116.67 120.25 1xyf s ASP 238 Ca 0.71 1.22 0.01 0.00 1.18 0.00 0.00 52.55 55.67 1xyf s ASP 238 Cb -0.48 1.25 0.02 0.00 -0.34 0.00 0.00 42.92 43.37 1xyf s ASP 238 CO 0.35 -0.21 -0.17 -0.63 0.68 0.00 0.00 175.17 175.19 1xyf s ILE 239 N 0.56 1.75 -0.15 2.11 1.01 -0.89 -1.68 121.20 123.90 1xyf s ILE 239 Ca -0.01 -0.75 -0.35 0.00 0.00 0.00 0.00 60.65 59.54 1xyf s ILE 239 Cb -0.05 -1.60 -0.12 0.00 0.01 0.00 0.00 42.46 40.70 1xyf s ILE 239 CO -0.05 0.49 1.91 1.67 0.00 0.00 0.00 174.94 178.96 1xyf n GLN 240 N 4.60 1.90 0.00 2.79 7.27 -0.38 0.16 117.38 133.72 1xyf n GLN 240 Ca -0.19 0.68 0.00 0.00 0.07 0.00 0.00 57.00 57.56 1xyf n GLN 240 Cb 0.50 -2.57 0.00 0.00 2.41 0.00 0.00 30.24 30.58 1xyf n GLN 240 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1xyf n GLY 241 N 4.68 2.22 3.94 1.69 0.00 0.39 -4.50 105.19 113.62 1xyf n GLY 241 Ca 0.26 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.98 1xyf n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xyf n ALA 242 N -1.40 -1.50 -1.65 4.61 0.00 0.12 -4.87 120.51 115.82 1xyf n ALA 242 Ca 0.00 0.04 -0.49 0.00 0.00 0.00 0.00 53.44 52.99 1xyf n ALA 242 Cb 0.00 -3.51 -0.05 0.00 0.00 0.00 0.00 19.45 15.89 1xyf n ALA 242 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xyf n SER 243 N -2.86 2.71 -0.34 0.00 2.88 -1.26 -4.51 113.62 110.24 1xyf n SER 243 Ca -0.05 1.07 -0.01 0.00 -1.33 0.00 0.00 58.87 58.55 1xyf n SER 243 Cb 0.57 -1.33 0.13 0.00 -0.75 0.00 0.00 64.21 62.82 1xyf n SER 243 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1xyf h SER 244 N 6.20 1.00 -0.35 -3.46 0.02 -1.76 -1.73 113.55 113.47 1xyf h SER 244 Ca -0.46 -0.01 -0.05 0.00 -0.84 0.00 0.00 61.79 60.43 1xyf h SER 244 Cb 1.28 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 1xyf h SER 244 CO 0.87 0.68 0.02 0.28 -1.14 0.00 0.00 176.83 177.54 1xyf h SER 245 N 1.16 0.58 -0.66 3.07 0.02 -1.89 -1.68 113.55 114.15 1xyf h SER 245 Ca 0.37 -0.30 -0.09 0.00 -0.84 0.00 0.00 61.79 60.94 1xyf h SER 245 Cb 0.01 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.37 1xyf h SER 245 CO -0.12 0.73 0.08 0.74 -1.14 0.00 0.00 176.83 177.12 1xyf h THR 246 N 0.41 1.27 -0.71 -2.27 2.02 -1.90 0.11 112.91 111.84 1xyf h THR 246 Ca 0.10 -1.08 -0.06 0.00 0.77 0.00 0.00 66.41 66.14 1xyf h THR 246 Cb 0.43 0.67 -0.03 0.00 -1.74 0.00 0.00 68.15 67.47 1xyf h THR 246 CO 0.01 0.40 0.20 1.88 0.37 0.00 0.00 175.52 178.38 1xyf h TYR 247 N 1.03 1.16 -0.30 3.16 0.05 -1.22 -1.35 116.97 119.51 1xyf h TYR 247 Ca 0.20 -0.12 -0.15 0.00 0.05 0.00 0.00 58.73 58.70 1xyf h TYR 247 Cb 0.48 -0.33 -0.01 0.00 1.01 0.00 0.00 36.73 37.88 1xyf h TYR 247 CO 0.04 0.93 -0.42 0.00 -1.05 0.00 0.00 178.16 177.65 1xyf h ALA 248 N 1.15 0.70 -0.07 3.88 0.00 -1.10 -2.21 119.26 121.61 1xyf h ALA 248 Ca 0.23 -0.46 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1xyf h ALA 248 Cb 0.33 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1xyf h ALA 248 CO -0.00 0.67 0.03 0.00 0.00 0.00 0.00 179.25 179.94 1xyf h ALA 249 N 0.93 0.09 -0.77 0.00 0.00 -0.34 -0.71 119.26 118.46 1xyf h ALA 249 Ca 0.04 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1xyf h ALA 249 Cb 0.97 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 1xyf h ALA 249 CO 0.09 -0.33 0.47 0.28 0.00 0.00 0.00 179.25 179.75 1xyf h VAL 250 N -0.04 1.21 -0.39 0.00 2.07 -1.27 -0.19 116.25 117.65 1xyf h VAL 250 Ca 0.02 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 1xyf h VAL 250 Cb 0.16 0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 30.05 1xyf h VAL 250 CO -0.00 0.22 0.18 0.74 0.02 0.00 0.00 177.57 178.73 1xyf h THR 251 N 1.05 1.18 -0.06 2.57 2.02 -1.25 -2.36 112.91 116.05 1xyf h THR 251 Ca 0.28 -0.51 -0.07 0.00 0.77 0.00 0.00 66.41 66.88 1xyf h THR 251 Cb -0.05 0.80 -0.01 0.00 -1.74 0.00 0.00 68.15 67.15 1xyf h THR 251 CO -0.05 0.19 -0.29 0.78 0.37 0.00 0.00 175.52 176.51 1xyf h ASN 252 N 0.49 0.11 -0.63 4.18 2.35 -0.79 -1.76 115.58 119.54 1xyf h ASN 252 Ca 0.13 -0.03 -0.04 0.00 -0.55 0.00 0.00 56.30 55.81 1xyf h ASN 252 Cb 0.13 -0.03 -0.03 0.00 0.05 0.00 0.00 38.32 38.45 1xyf h ASN 252 CO -0.02 0.41 0.23 0.44 -1.65 0.00 0.00 177.43 176.84 1xyf h ASP 253 N 0.10 0.89 -0.18 5.81 3.32 -0.54 -0.98 116.42 124.83 1xyf h ASP 253 Ca 0.01 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 56.86 1xyf h ASP 253 Cb 0.58 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.89 1xyf h ASP 253 CO 0.04 0.83 0.03 0.00 -1.72 0.00 0.00 179.24 178.43 1xyf h LEU 255 N 0.08 0.00 0.00 0.00 3.38 -1.15 -1.61 115.31 116.02 1xyf h LEU 255 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1xyf h LEU 255 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1xyf h LEU 255 CO 0.00 0.04 -0.04 0.00 0.09 0.00 0.00 178.44 178.53 1xyf n ALA 256 N -2.32 2.43 -3.62 1.53 0.00 -0.39 -4.66 120.51 113.48 1xyf n ALA 256 Ca -0.03 -0.12 -0.35 0.00 0.00 0.00 0.00 53.44 52.95 1xyf n ALA 256 Cb 0.13 -1.44 -0.14 0.00 0.00 0.00 0.00 19.45 18.01 1xyf n ALA 256 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1xyf s VAL 257 N -3.01 3.03 0.48 0.00 1.01 -0.61 -5.00 120.40 116.31 1xyf s VAL 257 Ca 0.14 -1.35 0.20 0.00 0.00 0.00 0.00 61.98 60.97 1xyf s VAL 257 Cb 0.18 -2.73 0.37 0.00 0.00 0.00 0.00 36.38 34.21 1xyf s VAL 257 CO 0.55 -0.09 1.97 0.77 0.00 0.00 0.00 175.10 178.29 1xyf h SER 258 N 8.01 0.18 -0.01 3.32 4.64 -1.83 -0.34 113.55 127.52 1xyf h SER 258 Ca -0.22 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.11 1xyf h SER 258 Cb 1.06 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 1xyf h SER 258 CO 0.54 0.10 0.00 0.54 -0.87 0.00 0.00 176.83 177.14 1xyf n ARG 259 N -4.43 1.18 -2.59 4.77 5.12 -1.26 -4.74 116.66 114.71 1xyf n ARG 259 Ca 0.11 -0.27 -0.43 0.00 -1.93 0.00 0.00 57.85 55.34 1xyf n ARG 259 Cb 0.55 -1.46 -0.02 0.00 -1.16 0.00 0.00 32.46 30.37 1xyf n ARG 259 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1xyf h LEU 261 N 11.56 0.62 0.00 0.00 3.38 -1.52 -3.47 115.31 125.88 1xyf h LEU 261 Ca -0.24 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1xyf h LEU 261 Cb 1.06 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.64 1xyf h LEU 261 CO 1.16 0.89 0.00 0.61 0.09 0.00 0.00 178.44 181.18 1xyf n GLY 262 N -0.20 -1.66 3.05 0.83 0.00 -1.26 -2.72 105.19 103.23 1xyf n GLY 262 Ca -0.01 -1.12 -0.22 0.00 0.00 0.00 0.00 46.02 44.67 1xyf n GLY 262 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xyf s ILE 263 N -2.64 0.99 -0.14 -0.61 1.01 -0.79 -2.01 121.20 117.01 1xyf s ILE 263 Ca 0.00 -0.49 0.01 0.00 0.00 0.00 0.00 60.65 60.17 1xyf s ILE 263 Cb 0.00 -0.86 0.02 0.00 0.01 0.00 0.00 42.46 41.63 1xyf s ILE 263 CO 0.00 0.30 -0.17 -0.89 0.00 0.00 0.00 174.94 174.18 1xyf s THR 264 N 0.05 1.69 0.14 2.92 2.01 0.39 -0.04 115.64 122.80 1xyf s THR 264 Ca -0.02 -0.73 -0.15 0.00 0.31 0.00 0.00 61.69 61.10 1xyf s THR 264 Cb -0.09 -1.55 -0.07 0.00 0.01 0.00 0.00 72.50 70.81 1xyf s THR 264 CO 0.01 0.48 0.56 0.68 -0.69 0.00 0.00 174.62 175.65 1xyf s VAL 265 N 1.20 4.83 -1.43 3.82 -7.23 -0.60 -1.15 120.40 119.84 1xyf s VAL 265 Ca -0.00 0.91 -0.11 0.00 -1.81 0.00 0.00 61.98 60.96 1xyf s VAL 265 Cb -0.14 -3.76 0.06 0.00 0.56 0.00 0.00 36.38 33.09 1xyf s VAL 265 CO -0.07 0.30 2.29 1.87 -0.31 0.00 0.00 175.10 179.18 1xyf n TRP 266 N 0.96 3.08 0.00 2.82 -0.00 0.17 -2.73 117.44 121.74 1xyf n TRP 266 Ca -0.06 -2.94 0.00 0.00 -0.00 0.00 0.00 57.50 54.50 1xyf n TRP 266 Cb 0.52 -2.32 0.00 0.00 -0.00 0.00 0.00 31.31 29.51 1xyf n TRP 266 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1xyf n GLY 267 N 3.44 3.26 0.01 5.87 0.00 -1.26 -4.69 105.19 111.82 1xyf n GLY 267 Ca 0.55 -1.85 -0.01 0.00 0.00 0.00 0.00 46.02 44.71 1xyf n GLY 267 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xyf n VAL 268 N -1.55 0.28 -4.06 1.61 0.31 -1.26 -4.63 118.33 109.03 1xyf n VAL 268 Ca 0.00 0.44 -0.24 0.00 -0.01 0.00 0.00 64.34 64.53 1xyf n VAL 268 Cb 0.00 -1.68 -0.04 0.00 -0.91 0.00 0.00 33.84 31.21 1xyf n VAL 268 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1xyf s ARG 269 N -1.28 3.07 0.39 5.55 0.52 -1.26 -3.79 118.95 122.15 1xyf s ARG 269 Ca -0.04 -0.89 0.16 0.00 -0.52 0.00 0.00 55.73 54.45 1xyf s ARG 269 Cb 0.00 -2.70 1.04 0.00 0.52 0.00 0.00 34.95 33.82 1xyf s ARG 269 CO 0.05 0.45 1.81 -0.44 0.02 0.00 0.00 175.30 177.19 1xyf h ASP 270 N 1.81 0.48 0.80 0.23 3.32 -1.38 0.16 116.42 121.84 1xyf h ASP 270 Ca -0.49 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1xyf h ASP 270 Cb 1.22 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1xyf h ASP 270 CO 0.63 0.15 0.00 0.71 -1.72 0.00 0.00 179.24 179.01 1xyf h THR 271 N 0.46 0.00 0.00 0.35 1.35 -1.87 -2.07 112.91 111.13 1xyf h THR 271 Ca 0.54 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 66.11 1xyf h THR 271 Cb 1.27 1.07 0.00 0.00 -1.73 0.00 0.00 68.15 68.75 1xyf h THR 271 CO -0.25 0.00 -0.71 0.47 -0.25 0.00 0.00 175.52 174.78 1xyf n ASP 272 N -2.37 0.68 -4.77 5.36 8.00 0.56 -4.92 116.55 119.09 1xyf n ASP 272 Ca 0.02 0.06 -0.38 0.00 0.71 0.00 0.00 54.79 55.20 1xyf n ASP 272 Cb 0.25 0.29 -0.01 0.00 -0.02 0.00 0.00 41.12 41.63 1xyf n ASP 272 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1xyf s SER 273 N -4.18 6.33 0.00 -2.24 0.15 -0.78 -4.89 113.70 108.09 1xyf s SER 273 Ca 0.06 2.35 0.14 0.00 0.70 0.00 0.00 55.95 59.20 1xyf s SER 273 Cb 0.13 -2.61 0.61 0.00 -1.71 0.00 0.00 66.02 62.45 1xyf s SER 273 CO 0.74 -0.81 1.46 -2.67 1.20 0.00 0.00 173.24 173.15 1xyf n TRP 274 N -0.19 0.00 -2.59 3.44 4.27 -1.26 -2.56 117.44 118.54 1xyf n TRP 274 Ca 0.06 0.00 -0.14 0.00 -3.89 0.00 0.00 57.50 53.53 1xyf n TRP 274 Cb 0.47 -0.50 0.02 0.00 -1.36 0.00 0.00 31.31 29.95 1xyf n TRP 274 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 1xyf n ARG 275 N -1.50 2.00 -0.19 -2.67 1.74 -1.26 -4.92 116.66 109.86 1xyf n ARG 275 Ca 0.04 -3.68 0.26 0.00 -0.77 0.00 0.00 57.85 53.69 1xyf n ARG 275 Cb 0.17 -1.63 0.66 0.00 -1.02 0.00 0.00 32.46 30.64 1xyf n ARG 275 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1xyf h SER 276 N 2.78 0.11 0.12 0.55 4.64 -1.63 0.84 113.55 120.96 1xyf h SER 276 Ca 0.03 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1xyf h SER 276 Cb 1.15 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1xyf h SER 276 CO 0.57 0.04 -0.02 1.23 -0.87 0.00 0.00 176.83 177.78 1xyf h GLY 277 N 0.11 0.00 -0.65 -0.77 0.00 -1.89 -0.71 103.07 99.17 1xyf h GLY 277 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 1xyf h GLY 277 CO -0.06 0.00 -0.02 1.22 0.00 0.00 0.00 176.54 177.69 1xyf n ASP 278 N -3.53 1.70 -4.13 0.19 8.00 0.29 -4.94 116.55 114.13 1xyf n ASP 278 Ca -0.03 -1.54 -0.36 0.00 0.71 0.00 0.00 54.79 53.57 1xyf n ASP 278 Cb 0.12 0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.19 1xyf n ASP 278 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1xyf n THR 279 N 0.30 -1.64 1.61 -3.53 -2.24 -0.27 -0.46 114.28 108.05 1xyf n THR 279 Ca 0.18 -0.50 0.13 0.00 -2.27 0.00 0.00 64.05 61.58 1xyf n THR 279 Cb 0.39 -1.46 0.58 0.00 -2.10 0.00 0.00 70.33 67.74 1xyf n THR 279 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1xyf n PRO 280 N -4.55 1.44 -2.08 -0.78 -0.04 -1.26 -3.55 135.00 124.19 1xyf n PRO 280 Ca -0.21 -0.64 -0.08 0.00 -0.04 0.00 0.00 63.50 62.54 1xyf n PRO 280 Cb 0.58 -1.43 0.01 0.00 -0.04 0.00 0.00 33.50 32.62 1xyf n PRO 280 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1xyf n LEU 281 N -0.19 0.00 0.03 1.53 4.77 -1.26 -2.10 117.00 119.77 1xyf n LEU 281 Ca 0.18 -0.86 0.11 0.00 -0.03 0.00 0.00 56.01 55.41 1xyf n LEU 281 Cb 0.25 -0.04 0.05 0.00 -2.33 0.00 0.00 43.42 41.35 1xyf n LEU 281 CO 0.15 -0.41 0.06 0.18 -1.33 0.00 0.00 177.39 176.04 1xyf n LEU 282 N 0.00 0.63 -4.21 2.23 4.77 -1.26 -4.85 117.00 114.30 1xyf n LEU 282 Ca 0.01 -0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.74 1xyf n LEU 282 Cb 0.19 -0.11 -0.14 0.00 -2.33 0.00 0.00 43.42 41.03 1xyf n LEU 282 CO 0.12 0.04 -0.51 -0.36 -1.33 0.00 0.00 177.39 175.35 1xyf s PHE 283 N -3.18 1.64 0.80 -1.77 0.40 -1.25 -1.56 117.98 113.07 1xyf s PHE 283 Ca 0.04 -0.36 -0.04 0.00 -0.60 0.00 0.00 56.93 55.98 1xyf s PHE 283 Cb 0.14 -0.99 0.16 0.00 0.51 0.00 0.00 43.02 42.85 1xyf s PHE 283 CO 0.79 0.06 1.10 0.54 0.70 0.00 0.00 175.22 178.41 1xyf s ASN 284 N -1.06 3.91 0.46 1.36 2.20 -0.64 -1.24 114.94 119.94 1xyf s ASN 284 Ca 0.06 -0.32 0.22 0.00 -0.94 0.00 0.00 52.86 51.88 1xyf s ASN 284 Cb -0.08 0.10 1.23 0.00 -2.00 0.00 0.00 41.25 40.50 1xyf s ASN 284 CO 0.01 -2.17 1.89 1.23 -2.94 0.00 0.00 177.10 175.12 1xyf h GLY 285 N -0.85 0.52 2.00 0.45 0.00 -1.92 0.17 103.07 103.44 1xyf h GLY 285 Ca -0.37 -0.11 0.00 0.00 0.00 0.00 0.00 47.33 46.85 1xyf h GLY 285 CO 0.37 0.00 0.00 1.22 0.00 0.00 0.00 176.54 178.13 1xyf n ASP 286 N -4.43 0.70 0.00 0.19 8.00 -1.26 -4.88 116.55 114.87 1xyf n ASP 286 Ca 0.18 0.63 0.00 0.00 0.71 0.00 0.00 54.79 56.31 1xyf n ASP 286 Cb 0.75 -0.79 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 1xyf n ASP 286 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xyf n GLY 287 N 0.47 0.77 3.87 0.44 0.00 0.61 -5.06 105.19 106.29 1xyf n GLY 287 Ca 0.03 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 1xyf n GLY 287 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xyf s SER 288 N -2.02 6.68 0.15 1.61 1.04 -1.26 -4.79 113.70 115.11 1xyf s SER 288 Ca 0.00 0.98 -0.31 0.00 0.48 0.00 0.00 55.95 57.09 1xyf s SER 288 Cb 0.00 -2.25 -0.09 0.00 0.10 0.00 0.00 66.02 63.78 1xyf s SER 288 CO 0.00 -0.04 1.47 -0.54 0.98 0.00 0.00 173.24 175.11 1xyf s LYS 289 N -2.61 4.27 0.80 4.02 1.02 -1.26 -1.63 119.74 124.36 1xyf s LYS 289 Ca 0.45 2.22 -0.09 0.00 0.02 0.00 0.00 55.97 58.57 1xyf s LYS 289 Cb -0.12 -3.19 0.11 0.00 -0.52 0.00 0.00 37.83 34.11 1xyf s LYS 289 CO 0.20 -0.50 1.13 0.15 -0.92 0.00 0.00 175.35 175.41 1xyf s LYS 290 N 0.97 1.62 0.39 1.68 1.02 -0.60 -4.83 119.74 119.99 1xyf s LYS 290 Ca 0.66 -0.36 0.06 0.00 0.02 0.00 0.00 55.97 56.35 1xyf s LYS 290 Cb -0.40 -2.06 0.78 0.00 -0.52 0.00 0.00 37.83 35.63 1xyf s LYS 290 CO 0.32 -1.68 2.02 0.00 -0.92 0.00 0.00 175.35 175.09 1xyf h ALA 291 N -0.98 1.62 -0.46 5.17 0.00 -1.85 -2.25 119.26 120.52 1xyf h ALA 291 Ca -0.43 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.37 1xyf h ALA 291 Cb 1.29 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1xyf h ALA 291 CO 0.52 0.32 0.12 0.00 0.00 0.00 0.00 179.25 180.21 1xyf h ALA 292 N 1.68 1.36 -0.29 0.00 0.00 -1.87 -2.52 119.26 117.62 1xyf h ALA 292 Ca 0.15 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 54.95 1xyf h ALA 292 Cb 0.01 -0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.55 1xyf h ALA 292 CO -0.03 0.46 -0.10 -0.92 0.00 0.00 0.00 179.25 178.67 1xyf h TYR 293 N 0.66 -0.22 -0.64 0.00 5.03 -1.59 0.84 116.97 121.06 1xyf h TYR 293 Ca 0.15 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.44 1xyf h TYR 293 Cb 0.23 0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.63 1xyf h TYR 293 CO 0.01 -0.15 0.21 1.15 -1.32 0.00 0.00 178.16 178.06 1xyf h THR 294 N -0.04 1.24 -0.69 1.81 2.02 -1.52 -0.61 112.91 115.12 1xyf h THR 294 Ca 0.14 -0.80 -0.06 0.00 0.77 0.00 0.00 66.41 66.46 1xyf h THR 294 Cb 0.25 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 1xyf h THR 294 CO -0.32 0.31 0.20 0.00 0.37 0.00 0.00 175.52 176.09 1xyf h ALA 295 N 1.29 0.91 -0.14 6.16 0.00 -0.84 -0.64 119.26 126.00 1xyf h ALA 295 Ca 0.21 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1xyf h ALA 295 Cb 0.25 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1xyf h ALA 295 CO -0.01 0.60 -0.04 0.28 0.00 0.00 0.00 179.25 180.09 1xyf h VAL 296 N 1.02 1.29 -0.66 0.00 2.07 -0.60 -2.18 116.25 117.19 1xyf h VAL 296 Ca 0.22 -0.99 -0.01 0.00 0.82 0.00 0.00 66.70 66.74 1xyf h VAL 296 Cb 0.32 1.68 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 1xyf h VAL 296 CO -0.00 0.29 0.38 0.25 0.02 0.00 0.00 177.57 178.50 1xyf h LEU 297 N -0.05 0.82 -1.02 2.57 5.85 -1.00 -0.88 115.31 121.60 1xyf h LEU 297 Ca 0.03 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.60 1xyf h LEU 297 Cb 0.46 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 1xyf h LEU 297 CO 0.01 0.66 -0.03 0.78 -0.34 0.00 0.00 178.44 179.53 1xyf h ASN 298 N 0.91 0.64 -0.14 1.25 2.35 -1.12 -1.06 115.58 118.41 1xyf h ASN 298 Ca 0.24 -0.15 -0.02 0.00 -0.55 0.00 0.00 56.30 55.82 1xyf h ASN 298 Cb 0.01 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.21 1xyf h ASN 298 CO -0.04 0.73 0.01 0.00 -1.65 0.00 0.00 177.43 176.48 1xyf h ALA 299 N 1.34 0.18 0.00 -0.83 0.00 -0.78 -2.90 119.26 116.28 1xyf h ALA 299 Ca 0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1xyf h ALA 299 Cb 0.43 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1xyf h ALA 299 CO 0.02 -0.14 -0.12 -0.07 0.00 0.00 0.00 179.25 178.94 1xyf h LEU 300 N -0.01 0.00 -0.46 0.00 3.38 -0.90 -2.48 115.31 114.84 1xyf h LEU 300 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1xyf h LEU 300 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1xyf h LEU 300 CO 0.00 0.12 0.00 0.59 0.09 0.00 0.00 178.44 179.24 1xyf n ASN 301 N -4.22 0.71 0.00 -0.43 3.02 -0.43 -4.73 115.26 109.19 1xyf n ASN 301 Ca -0.03 -1.27 0.00 0.00 -0.03 0.00 0.00 54.58 53.25 1xyf n ASN 301 Cb 0.20 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 1xyf n ASN 301 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xyf n GLY 302 N 1.07 2.45 6.16 7.41 0.00 -0.93 -5.07 105.19 116.27 1xyf n GLY 302 Ca 0.21 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.27 1xyf n GLY 302 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyf n GLY 303 N 0.00 2.00 0.00 -0.02 0.00 -1.24 -4.67 105.19 101.25 1xyf n GLY 303 Ca 0.00 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.50 1xyf n GLY 303 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyf n GLY 313 N 0.00 -1.22 3.89 -0.02 0.00 0.71 -4.59 105.19 103.96 1xyf n GLY 313 Ca 0.00 -2.22 -0.29 0.00 0.00 0.00 0.00 46.02 43.51 1xyf n GLY 313 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1xyf s GLN 314 N -0.68 3.63 -0.25 1.61 -0.21 -1.22 -0.68 119.66 121.86 1xyf s GLN 314 Ca 0.00 0.41 0.01 0.00 0.02 0.00 0.00 55.36 55.80 1xyf s GLN 314 Cb 0.00 -2.31 0.06 0.00 1.00 0.00 0.00 33.01 31.76 1xyf s GLN 314 CO 0.00 -0.24 -0.05 0.42 -2.12 0.00 0.00 175.29 173.30 1xyf s ILE 315 N -2.73 1.70 -0.20 1.08 1.01 -1.26 -0.72 121.20 120.08 1xyf s ILE 315 Ca 0.50 -1.41 -0.09 0.00 0.00 0.00 0.00 60.65 59.66 1xyf s ILE 315 Cb -0.10 -1.97 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1xyf s ILE 315 CO 0.43 -0.15 0.10 -0.75 0.00 0.00 0.00 174.94 174.56 1xyf s LYS 316 N 1.30 4.05 0.01 2.79 2.20 0.11 -1.04 119.74 129.16 1xyf s LYS 316 Ca -0.05 -0.30 -0.30 0.00 -0.36 0.00 0.00 55.97 54.96 1xyf s LYS 316 Cb -0.19 -3.33 -0.05 0.00 -1.51 0.00 0.00 37.83 32.75 1xyf s LYS 316 CO -0.07 0.24 1.30 0.20 -0.36 0.00 0.00 175.35 176.66 1xyf s GLY 317 N 0.50 2.06 0.19 5.54 0.00 0.42 0.17 107.32 116.20 1xyf s GLY 317 Ca 0.05 0.82 -0.10 0.00 0.00 0.00 0.00 44.72 45.49 1xyf s GLY 317 CO 0.00 2.31 1.76 -2.08 0.00 0.00 0.00 173.10 175.09 1xyf h VAL 318 N 4.79 1.24 0.00 1.40 2.07 -0.51 0.25 116.25 125.48 1xyf h VAL 318 Ca -0.38 -0.72 -0.10 0.00 0.82 0.00 0.00 66.70 66.32 1xyf h VAL 318 Cb 1.18 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1xyf h VAL 318 CO 0.87 0.29 -0.48 1.23 0.02 0.00 0.00 177.57 179.50 1xyf h GLY 319 N 0.96 0.00 0.00 2.17 0.00 -1.18 -3.36 103.07 101.66 1xyf h GLY 319 Ca 0.23 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.28 1xyf h GLY 319 CO -0.02 0.00 -2.05 -1.14 0.00 0.00 0.00 176.54 173.33 1xyf n SER 320 N -3.53 1.30 -0.01 0.19 3.41 -1.15 -4.96 113.62 108.86 1xyf n SER 320 Ca -0.00 -0.01 -0.00 0.00 -0.26 0.00 0.00 58.87 58.60 1xyf n SER 320 Cb 0.59 0.82 -0.00 0.00 -0.26 0.00 0.00 64.21 65.36 1xyf n SER 320 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1xyf n GLY 321 N 2.09 0.47 3.65 5.00 0.00 0.86 -4.98 105.19 112.27 1xyf n GLY 321 Ca -0.25 -0.21 -0.24 0.00 0.00 0.00 0.00 46.02 45.32 1xyf n GLY 321 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xyf s ARG 322 N -0.46 2.31 0.25 1.61 0.52 -1.25 -4.66 118.95 117.27 1xyf s ARG 322 Ca 0.00 -1.30 -0.00 0.00 -0.52 0.00 0.00 55.73 53.91 1xyf s ARG 322 Cb 0.00 -2.23 -0.04 0.00 0.52 0.00 0.00 34.95 33.20 1xyf s ARG 322 CO 0.00 0.40 0.44 0.00 0.02 0.00 0.00 175.30 176.16 1xyf s LEU 324 N -3.66 4.31 0.01 0.00 2.96 -0.21 -1.35 118.68 120.73 1xyf s LEU 324 Ca 0.39 2.10 0.02 0.00 -0.22 0.00 0.00 54.13 56.42 1xyf s LEU 324 Cb -0.10 -3.55 -0.01 0.00 0.50 0.00 0.00 46.19 43.02 1xyf s LEU 324 CO 0.31 -0.76 -0.06 -0.62 -1.32 0.00 0.00 176.35 173.89 1xyf s ASP 325 N 2.13 0.73 -0.43 3.68 -1.08 0.68 -4.49 116.67 117.89 1xyf s ASP 325 Ca 0.65 -0.20 -0.17 0.00 -0.52 0.00 0.00 52.55 52.31 1xyf s ASP 325 Cb -0.31 -0.05 0.03 0.00 -1.46 0.00 0.00 42.92 41.12 1xyf s ASP 325 CO 0.26 0.02 0.41 -0.69 0.52 0.00 0.00 175.17 175.69 1xyf s VAL 326 N -0.39 5.13 -0.35 1.11 1.01 -0.86 -1.16 120.40 124.88 1xyf s VAL 326 Ca -0.00 -0.48 -0.38 0.00 0.00 0.00 0.00 61.98 61.12 1xyf s VAL 326 Cb -0.04 -4.03 -0.17 0.00 0.00 0.00 0.00 36.38 32.14 1xyf s VAL 326 CO -0.00 -0.43 1.27 -2.65 0.00 0.00 0.00 175.10 173.29 1xyf n PRO 327 N 5.50 0.00 -2.13 2.72 -0.02 -1.26 -1.19 135.00 138.62 1xyf n PRO 327 Ca -0.08 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.27 1xyf n PRO 327 Cb 0.47 -1.25 -0.02 0.00 -0.02 0.00 0.00 33.50 32.68 1xyf n PRO 327 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1xyf n ASN 328 N 3.02 -3.72 -2.88 2.55 3.02 -1.26 -0.75 115.26 115.23 1xyf n ASN 328 Ca 0.24 0.23 -0.22 0.00 -0.03 0.00 0.00 54.58 54.80 1xyf n ASN 328 Cb -0.03 -3.25 0.03 0.00 -0.61 0.00 0.00 39.78 35.92 1xyf n ASN 328 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xyf n ALA 329 N -1.46 -0.92 -1.77 5.41 0.00 -0.33 -4.95 120.51 116.49 1xyf n ALA 329 Ca -0.14 0.27 -0.37 0.00 0.00 0.00 0.00 53.44 53.20 1xyf n ALA 329 Cb 0.55 -3.69 0.00 0.00 0.00 0.00 0.00 19.45 16.31 1xyf n ALA 329 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xyf s SER 330 N -2.66 5.97 0.00 0.00 0.15 0.07 -4.95 113.70 112.27 1xyf s SER 330 Ca 0.27 2.39 0.03 0.00 0.70 0.00 0.00 55.95 59.34 1xyf s SER 330 Cb -0.12 -2.61 0.03 0.00 -1.71 0.00 0.00 66.02 61.61 1xyf s SER 330 CO 0.34 -1.06 0.62 0.35 1.20 0.00 0.00 173.24 174.68 1xyf n THR 331 N -0.64 0.03 -2.32 6.45 -2.24 -1.26 -4.89 114.28 109.40 1xyf n THR 331 Ca 0.08 -0.52 -0.41 0.00 -2.27 0.00 0.00 64.05 60.94 1xyf n THR 331 Cb 0.48 1.05 -0.03 0.00 -2.10 0.00 0.00 70.33 69.73 1xyf n THR 331 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1xyf s THR 332 N -0.30 3.30 0.34 4.28 -4.23 -1.26 -4.98 115.64 112.78 1xyf s THR 332 Ca 0.04 1.19 -0.29 0.00 -1.18 0.00 0.00 61.69 61.46 1xyf s THR 332 Cb 0.03 -3.76 -0.10 0.00 1.34 0.00 0.00 72.50 70.00 1xyf s THR 332 CO 0.04 0.24 1.35 -1.81 -0.54 0.00 0.00 174.62 173.90 1xyf s ASP 333 N -0.28 6.67 0.00 3.99 1.01 -1.26 -2.61 116.67 124.18 1xyf s ASP 333 Ca 0.50 2.77 0.00 0.00 0.71 0.00 0.00 52.55 56.53 1xyf s ASP 333 Cb -0.35 -2.65 0.00 0.00 1.01 0.00 0.00 42.92 40.93 1xyf s ASP 333 CO 0.42 -0.61 0.00 0.61 0.21 0.00 0.00 175.17 175.79 1xyf n GLY 334 N 0.77 0.46 3.66 0.21 0.00 0.03 -4.99 105.19 105.33 1xyf n GLY 334 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 1xyf n GLY 334 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xyf s THR 335 N -2.18 4.08 0.19 2.61 2.01 -1.07 -4.83 115.64 116.43 1xyf s THR 335 Ca 0.00 1.31 -0.30 0.00 0.31 0.00 0.00 61.69 63.02 1xyf s THR 335 Cb 0.00 -3.85 -0.08 0.00 0.01 0.00 0.00 72.50 68.58 1xyf s THR 335 CO 0.00 -0.11 1.03 -1.58 -0.69 0.00 0.00 174.62 173.27 1xyf s GLN 336 N 3.53 4.69 0.70 4.92 0.74 -1.26 -1.55 119.66 131.42 1xyf s GLN 336 Ca 0.60 1.61 -0.11 0.00 0.05 0.00 0.00 55.36 57.50 1xyf s GLN 336 Cb -0.25 -3.29 0.01 0.00 1.10 0.00 0.00 33.01 30.57 1xyf s GLN 336 CO 0.19 0.23 1.08 0.14 -0.55 0.00 0.00 175.29 176.38 1xyf s VAL 337 N -0.50 3.77 0.32 1.34 -7.23 -0.81 -4.55 120.40 112.74 1xyf s VAL 337 Ca 0.46 0.58 -0.00 0.00 -1.81 0.00 0.00 61.98 61.20 1xyf s VAL 337 Cb -0.27 -3.51 0.00 0.00 0.56 0.00 0.00 36.38 33.16 1xyf s VAL 337 CO 0.34 -0.75 0.42 0.00 -0.31 0.00 0.00 175.10 174.79 1xyf n GLN 338 N -3.01 0.60 -3.94 4.82 10.64 -0.31 -2.75 117.38 123.42 1xyf n GLN 338 Ca 0.07 -2.60 -0.37 0.00 -1.83 0.00 0.00 57.00 52.27 1xyf n GLN 338 Cb 0.56 2.45 -0.06 0.00 -0.86 0.00 0.00 30.24 32.32 1xyf n GLN 338 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1xyf s LEU 339 N 0.00 4.28 0.07 2.61 1.43 0.11 -0.23 118.68 126.95 1xyf s LEU 339 Ca 0.28 0.42 -0.23 0.00 -1.03 0.00 0.00 54.13 53.57 1xyf s LEU 339 Cb -0.00 -2.04 0.06 0.00 0.03 0.00 0.00 46.19 44.23 1xyf s LEU 339 CO 0.20 0.40 0.55 -0.47 0.23 0.00 0.00 176.35 177.26 1xyf s TYR 340 N -0.99 -0.46 0.09 0.29 5.04 -0.46 -0.32 117.35 120.54 1xyf s TYR 340 Ca 0.15 0.45 -0.36 0.00 -2.44 0.00 0.00 57.07 54.87 1xyf s TYR 340 Cb -0.12 0.39 -0.16 0.00 0.35 0.00 0.00 41.96 42.43 1xyf s TYR 340 CO 0.04 -0.69 1.45 -0.25 -1.34 0.00 0.00 175.55 174.75 1xyf n ASP 341 N 0.21 2.17 -4.72 4.32 8.00 -1.26 -0.39 116.55 124.88 1xyf n ASP 341 Ca -0.18 1.10 -0.42 0.00 0.71 0.00 0.00 54.79 56.01 1xyf n ASP 341 Cb 0.61 -1.26 -0.03 0.00 -0.02 0.00 0.00 41.12 40.42 1xyf n ASP 341 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xyf s HIS 343 N 0.84 -0.23 -1.03 0.00 -3.43 -1.26 -5.03 115.29 105.15 1xyf s HIS 343 Ca 0.66 0.21 -0.14 0.00 -0.80 0.00 0.00 55.06 54.99 1xyf s HIS 343 Cb -0.42 0.18 -0.08 0.00 -1.43 0.00 0.00 32.58 30.82 1xyf s HIS 343 CO 0.34 -0.53 2.14 0.43 -2.00 0.00 0.00 174.74 175.13 1xyf n SER 344 N 0.67 4.12 -4.45 7.38 7.64 -1.26 -4.81 113.62 122.91 1xyf n SER 344 Ca -0.19 -2.59 -0.27 0.00 1.01 0.00 0.00 58.87 56.82 1xyf n SER 344 Cb 0.59 -1.26 -0.11 0.00 -1.01 0.00 0.00 64.21 62.42 1xyf n SER 344 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xyf s ALA 345 N 3.90 2.60 0.49 -0.43 0.00 -1.26 -5.03 121.76 122.03 1xyf s ALA 345 Ca 0.51 -1.59 0.15 0.00 0.00 0.00 0.00 51.96 51.03 1xyf s ALA 345 Cb 0.13 -0.41 1.18 0.00 0.00 0.00 0.00 23.12 24.02 1xyf s ALA 345 CO 0.02 0.45 2.11 1.79 0.00 0.00 0.00 175.76 180.13 1xyf h THR 346 N 3.19 1.00 0.00 0.00 1.35 -1.94 -1.57 112.91 114.94 1xyf h THR 346 Ca -0.47 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.34 1xyf h THR 346 Cb 1.20 0.85 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1xyf h THR 346 CO 0.48 0.03 0.00 -0.46 -0.25 0.00 0.00 175.52 175.32 1xyf n ASN 347 N -4.51 0.00 0.00 5.36 6.94 -1.26 -2.27 115.26 119.52 1xyf n ASN 347 Ca -0.00 -1.11 0.00 0.00 -0.02 0.00 0.00 54.58 53.45 1xyf n ASN 347 Cb 0.13 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.55 1xyf n ASN 347 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1xyf n GLN 348 N -0.83 0.48 -3.61 -3.83 6.02 -0.60 -2.02 117.38 112.99 1xyf n GLN 348 Ca 0.13 -0.82 -0.40 0.00 -0.01 0.00 0.00 57.00 55.90 1xyf n GLN 348 Cb 0.06 -0.95 -0.11 0.00 1.02 0.00 0.00 30.24 30.25 1xyf n GLN 348 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1xyf s GLN 349 N -0.35 2.84 -0.04 -1.09 -0.21 -0.96 -4.07 119.66 115.79 1xyf s GLN 349 Ca 0.00 -1.07 0.00 0.00 0.02 0.00 0.00 55.36 54.32 1xyf s GLN 349 Cb 0.00 -3.71 -0.03 0.00 1.00 0.00 0.00 33.01 30.27 1xyf s GLN 349 CO 0.00 -0.68 -0.01 -1.58 -2.12 0.00 0.00 175.29 170.89 1xyf s TRP 350 N 1.55 3.07 -0.16 0.91 0.52 0.15 -4.50 118.94 120.48 1xyf s TRP 350 Ca 0.02 0.10 0.01 0.00 0.02 0.00 0.00 56.10 56.25 1xyf s TRP 350 Cb -0.19 -1.71 0.01 0.00 -1.15 0.00 0.00 33.47 30.43 1xyf s TRP 350 CO 0.06 0.44 -0.19 0.99 0.02 0.00 0.00 176.95 178.28 1xyf s THR 351 N -0.97 2.31 -0.35 2.01 2.01 -0.17 -0.21 115.64 120.26 1xyf s THR 351 Ca 0.16 -0.88 -0.21 0.00 0.31 0.00 0.00 61.69 61.07 1xyf s THR 351 Cb -0.11 -1.96 0.00 0.00 0.01 0.00 0.00 72.50 70.44 1xyf s THR 351 CO 0.06 0.53 0.65 -0.47 -0.69 0.00 0.00 174.62 174.70 1xyf s TYR 352 N 0.97 3.15 0.69 4.92 5.04 -1.25 -0.47 117.35 130.39 1xyf s TYR 352 Ca -0.03 0.38 -0.05 0.00 -2.44 0.00 0.00 57.07 54.92 1xyf s TYR 352 Cb -0.15 -3.15 0.06 0.00 0.35 0.00 0.00 41.96 39.07 1xyf s TYR 352 CO -0.04 -0.63 0.98 0.95 -1.34 0.00 0.00 175.55 175.47 1xyf s THR 353 N 2.74 2.32 0.29 4.34 -4.23 0.25 -4.92 115.64 116.43 1xyf s THR 353 Ca 0.25 -0.33 0.23 0.00 -1.18 0.00 0.00 61.69 60.66 1xyf s THR 353 Cb -0.14 -2.99 0.22 0.00 1.34 0.00 0.00 72.50 70.92 1xyf s THR 353 CO 0.15 0.00 1.91 0.44 -0.54 0.00 0.00 174.62 176.58 1xyf h ASP 354 N -0.52 0.00 1.20 3.99 3.32 -1.97 -1.12 116.42 121.32 1xyf h ASP 354 Ca -0.44 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.61 1xyf h ASP 354 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1xyf h ASP 354 CO 0.59 0.23 0.00 0.00 -1.72 0.00 0.00 179.24 178.33 1xyf h ALA 355 N 1.77 1.00 0.00 3.45 0.00 -1.90 -2.35 119.26 121.23 1xyf h ALA 355 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1xyf h ALA 355 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1xyf h ALA 355 CO 0.03 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1xyf n GLY 356 N 0.46 1.05 3.93 0.00 0.00 -0.42 -4.75 105.19 105.46 1xyf n GLY 356 Ca 0.03 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.80 1xyf n GLY 356 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xyf s GLU 357 N -0.33 3.40 -0.43 1.61 2.02 -1.25 -0.05 118.70 123.67 1xyf s GLU 357 Ca 0.00 -0.17 0.04 0.00 0.02 0.00 0.00 54.97 54.86 1xyf s GLU 357 Cb 0.00 -2.53 0.11 0.00 0.10 0.00 0.00 34.13 31.82 1xyf s GLU 357 CO 0.00 -0.09 0.15 -0.51 0.02 0.00 0.00 175.26 174.84 1xyf s LEU 358 N -4.53 4.57 0.17 1.80 1.43 -1.25 -0.58 118.68 120.28 1xyf s LEU 358 Ca 0.45 -2.56 -0.14 0.00 -1.03 0.00 0.00 54.13 50.84 1xyf s LEU 358 Cb -0.10 -1.64 -0.07 0.00 0.03 0.00 0.00 46.19 44.41 1xyf s LEU 358 CO 0.40 -0.31 0.57 -0.13 0.23 0.00 0.00 176.35 177.10 1xyf s ARG 359 N 0.34 3.97 0.03 1.70 0.52 0.38 -1.00 118.95 124.88 1xyf s ARG 359 Ca 0.14 0.49 0.02 0.00 -0.52 0.00 0.00 55.73 55.86 1xyf s ARG 359 Cb -0.22 -2.87 -0.02 0.00 0.52 0.00 0.00 34.95 32.36 1xyf s ARG 359 CO -0.04 0.44 -0.07 0.54 0.02 0.00 0.00 175.30 176.19 1xyf s VAL 360 N -1.53 0.49 -1.15 3.52 0.11 0.31 -1.00 120.40 121.15 1xyf s VAL 360 Ca 0.40 -0.79 0.00 0.00 -2.93 0.00 0.00 61.98 58.66 1xyf s VAL 360 Cb -0.14 -0.52 0.00 0.00 -1.53 0.00 0.00 36.38 34.19 1xyf s VAL 360 CO 0.19 -0.22 0.00 -1.22 -3.33 0.00 0.00 175.10 170.53 1xyf n TYR 361 N 1.96 0.00 0.00 1.54 4.01 -1.26 -1.75 117.16 121.66 1xyf n TYR 361 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 1xyf n TYR 361 Cb 0.56 -2.63 0.00 0.00 -0.31 0.00 0.00 39.34 36.96 1xyf n TYR 361 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1xyf n GLY 362 N -0.05 1.72 0.23 2.72 0.00 -1.26 -4.55 105.19 103.99 1xyf n GLY 362 Ca -0.11 -0.22 0.05 0.00 0.00 0.00 0.00 46.02 45.75 1xyf n GLY 362 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1xyf n ASP 363 N 2.23 1.37 -4.52 1.61 2.03 -1.21 -4.99 116.55 113.08 1xyf n ASP 363 Ca 0.00 -2.56 -0.33 0.00 0.52 0.00 0.00 54.79 52.42 1xyf n ASP 363 Cb 0.00 -0.31 -0.12 0.00 -0.72 0.00 0.00 41.12 39.97 1xyf n ASP 363 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1xyf s LYS 364 N -1.61 2.59 0.06 -0.67 -0.14 -0.72 -2.55 119.74 116.71 1xyf s LYS 364 Ca 0.17 -0.64 0.08 0.00 -1.36 0.00 0.00 55.97 54.23 1xyf s LYS 364 Cb 0.15 -2.46 -0.03 0.00 -1.68 0.00 0.00 37.83 33.81 1xyf s LYS 364 CO 0.02 0.64 -0.20 0.00 -0.76 0.00 0.00 175.35 175.04 1xyf s LEU 366 N -1.58 4.36 -0.01 0.00 2.96 -0.17 -2.05 118.68 122.18 1xyf s LEU 366 Ca 0.15 2.41 0.03 0.00 -0.22 0.00 0.00 54.13 56.50 1xyf s LEU 366 Cb -0.10 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.01 1xyf s LEU 366 CO 0.06 -0.83 -0.11 -0.62 -1.32 0.00 0.00 176.35 173.53 1xyf s ASP 367 N 2.05 1.33 -0.23 3.68 -1.08 0.24 -4.45 116.67 118.21 1xyf s ASP 367 Ca 0.71 -0.21 -0.07 0.00 -0.52 0.00 0.00 52.55 52.46 1xyf s ASP 367 Cb -0.38 -0.21 -0.03 0.00 -1.46 0.00 0.00 42.92 40.83 1xyf s ASP 367 CO 0.31 0.12 0.07 0.00 0.52 0.00 0.00 175.17 176.19 1xyf s ALA 368 N -0.13 3.24 -1.98 3.66 0.00 -0.40 -0.91 121.76 125.24 1xyf s ALA 368 Ca 0.02 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 50.97 1xyf s ALA 368 Cb -0.06 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 21.03 1xyf s ALA 368 CO -0.00 -0.28 0.94 0.00 0.00 0.00 0.00 175.76 176.43 1xyf n ALA 369 N 4.49 2.45 0.00 0.00 0.00 -1.05 -4.86 120.51 121.54 1xyf n ALA 369 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1xyf n ALA 369 Cb 0.52 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.97 1xyf n ALA 369 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xyf n GLY 370 N 0.44 -1.28 0.06 0.00 0.00 -1.26 -4.95 105.19 98.20 1xyf n GLY 370 Ca 0.00 -0.89 0.01 0.00 0.00 0.00 0.00 46.02 45.13 1xyf n GLY 370 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xyf n THR 371 N 1.54 0.41 -3.19 2.61 -2.24 -1.26 -4.84 114.28 107.31 1xyf n THR 371 Ca 0.00 -0.71 -0.19 0.00 -2.27 0.00 0.00 64.05 60.88 1xyf n THR 371 Cb 0.00 0.81 0.01 0.00 -2.10 0.00 0.00 70.33 69.05 1xyf n THR 371 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1xyf s GLY 372 N -0.48 1.97 0.57 3.38 0.00 -1.26 -4.83 107.32 106.67 1xyf s GLY 372 Ca 0.02 -1.80 -0.21 0.00 0.00 0.00 0.00 44.72 42.73 1xyf s GLY 372 CO 0.02 -1.61 1.32 -1.31 0.00 0.00 0.00 173.10 171.51 1xyf s ASN 373 N -4.37 5.18 0.00 1.64 0.01 -1.26 -1.76 114.94 114.39 1xyf s ASN 373 Ca 0.54 2.67 0.00 0.00 -0.71 0.00 0.00 52.86 55.35 1xyf s ASN 373 Cb -0.07 -2.63 0.00 0.00 0.41 0.00 0.00 41.25 38.96 1xyf s ASN 373 CO 0.33 -1.62 0.00 0.61 -1.51 0.00 0.00 177.10 174.91 1xyf n GLY 374 N 0.72 2.17 3.69 0.66 0.00 -0.11 -4.98 105.19 107.34 1xyf n GLY 374 Ca 0.12 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.70 1xyf n GLY 374 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1xyf n THR 375 N -2.00 0.87 -2.32 2.61 -1.04 -0.72 -4.71 114.28 106.97 1xyf n THR 375 Ca 0.00 -0.22 -0.42 0.00 -2.04 0.00 0.00 64.05 61.37 1xyf n THR 375 Cb 0.00 -1.64 -0.03 0.00 -1.82 0.00 0.00 70.33 66.84 1xyf n THR 375 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 1xyf s LYS 376 N -0.29 4.40 -0.22 -2.82 2.20 -1.26 -0.85 119.74 120.90 1xyf s LYS 376 Ca 0.68 1.90 -0.09 0.00 -0.36 0.00 0.00 55.97 58.10 1xyf s LYS 376 Cb -0.60 -3.30 -0.04 0.00 -1.51 0.00 0.00 37.83 32.38 1xyf s LYS 376 CO 0.48 -0.30 0.10 0.08 -0.36 0.00 0.00 175.35 175.35 1xyf s VAL 377 N 0.92 4.94 0.11 4.02 1.01 -1.18 -2.52 120.40 127.70 1xyf s VAL 377 Ca 0.60 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.62 1xyf s VAL 377 Cb -0.33 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 32.78 1xyf s VAL 377 CO 0.31 0.39 0.13 0.00 0.00 0.00 0.00 175.10 175.93 1xyf n GLN 378 N 4.11 0.19 -4.19 2.72 10.64 -0.08 -1.92 117.38 128.84 1xyf n GLN 378 Ca -0.16 -0.94 -0.31 0.00 -1.83 0.00 0.00 57.00 53.76 1xyf n GLN 378 Cb 0.52 0.86 -0.08 0.00 -0.86 0.00 0.00 30.24 30.67 1xyf n GLN 378 CO 0.00 0.00 0.00 0.96 -1.83 0.00 0.00 177.06 176.19 1xyf s ILE 379 N -2.51 4.02 0.11 -0.39 -4.36 -0.60 0.81 121.20 118.29 1xyf s ILE 379 Ca 0.10 -0.88 -0.22 0.00 -0.26 0.00 0.00 60.65 59.40 1xyf s ILE 379 Cb 0.00 -2.87 0.06 0.00 1.25 0.00 0.00 42.46 40.90 1xyf s ILE 379 CO 0.07 0.20 0.54 -0.47 0.24 0.00 0.00 174.94 175.53 1xyf s TYR 380 N -1.23 -0.44 0.34 1.37 5.04 -0.87 -0.79 117.35 120.77 1xyf s TYR 380 Ca 0.24 0.31 -0.27 0.00 -2.44 0.00 0.00 57.07 54.91 1xyf s TYR 380 Cb -0.12 0.43 -0.13 0.00 0.35 0.00 0.00 41.96 42.49 1xyf s TYR 380 CO 0.15 -0.75 1.11 0.43 -1.34 0.00 0.00 175.55 175.15 1xyf n SER 381 N -0.07 1.80 -4.73 4.32 7.64 -1.26 -0.69 113.62 120.63 1xyf n SER 381 Ca -0.17 1.16 -0.41 0.00 1.01 0.00 0.00 58.87 60.45 1xyf n SER 381 Cb 0.63 -1.37 -0.04 0.00 -1.01 0.00 0.00 64.21 62.42 1xyf n SER 381 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xyf n TRP 383 N 3.00 0.00 -0.66 0.00 4.27 -1.26 -5.03 117.44 117.76 1xyf n TRP 383 Ca 0.05 0.00 0.00 0.00 -3.89 0.00 0.00 57.50 53.66 1xyf n TRP 383 Cb 0.47 0.02 0.00 0.00 -1.36 0.00 0.00 31.31 30.43 1xyf n TRP 383 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1xyf n GLY 384 N 0.00 0.61 3.82 -1.67 0.00 -1.26 -5.06 105.19 101.63 1xyf n GLY 384 Ca 0.00 -0.53 -0.33 0.00 0.00 0.00 0.00 46.02 45.17 1xyf n GLY 384 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xyf s GLY 385 N -2.48 2.14 0.60 -0.02 0.00 -1.26 -4.92 107.32 101.38 1xyf s GLY 385 Ca 0.00 0.34 0.39 0.00 0.00 0.00 0.00 44.72 45.45 1xyf s GLY 385 CO 0.00 0.64 2.18 -0.55 0.00 0.00 0.00 173.10 175.36 1xyf h ASP 386 N 0.71 0.00 0.15 1.64 3.32 -1.97 0.19 116.42 120.47 1xyf h ASP 386 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 1xyf h ASP 386 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1xyf h ASP 386 CO 0.59 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.65 1xyf n ASN 387 N -3.06 0.00 -0.13 6.45 6.94 -1.26 -2.40 115.26 121.81 1xyf n ASN 387 Ca -0.01 -0.72 0.04 0.00 -0.02 0.00 0.00 54.58 53.87 1xyf n ASN 387 Cb 0.18 -0.08 0.07 0.00 -2.36 0.00 0.00 39.78 37.59 1xyf n ASN 387 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1xyf n GLN 388 N -1.08 2.50 -4.57 -3.83 6.02 0.05 -1.28 117.38 115.20 1xyf n GLN 388 Ca 0.20 -1.92 -0.33 0.00 -0.01 0.00 0.00 57.00 54.94 1xyf n GLN 388 Cb 0.14 -1.21 -0.11 0.00 1.02 0.00 0.00 30.24 30.08 1xyf n GLN 388 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1xyf s LYS 389 N -1.61 2.65 0.06 -1.09 -0.14 -1.01 -4.20 119.74 114.40 1xyf s LYS 389 Ca 0.13 -0.63 0.01 0.00 -1.36 0.00 0.00 55.97 54.12 1xyf s LYS 389 Cb 0.11 -2.54 -0.04 0.00 -1.68 0.00 0.00 37.83 33.68 1xyf s LYS 389 CO 0.03 0.64 -0.05 -1.58 -0.76 0.00 0.00 175.35 173.62 1xyf s TRP 390 N -0.89 0.65 -0.19 3.18 0.52 0.92 -1.16 118.94 121.97 1xyf s TRP 390 Ca 0.14 -0.85 0.01 0.00 0.02 0.00 0.00 56.10 55.43 1xyf s TRP 390 Cb -0.11 -0.41 0.02 0.00 -1.15 0.00 0.00 33.47 31.82 1xyf s TRP 390 CO 0.04 -0.22 -0.18 1.03 0.02 0.00 0.00 176.95 177.64 1xyf s ARG 391 N -3.17 2.92 -0.63 4.98 0.52 0.49 -4.59 118.95 119.47 1xyf s ARG 391 Ca 0.03 -0.89 -0.19 0.00 -0.52 0.00 0.00 55.73 54.16 1xyf s ARG 391 Cb 0.02 -2.64 0.11 0.00 0.52 0.00 0.00 34.95 32.95 1xyf s ARG 391 CO -0.05 -0.26 0.76 -0.51 0.02 0.00 0.00 175.30 175.26 1xyf s LEU 392 N 1.28 5.31 0.55 2.53 1.43 -1.26 -1.47 118.68 127.04 1xyf s LEU 392 Ca 0.03 -1.46 -0.18 0.00 -1.03 0.00 0.00 54.13 51.50 1xyf s LEU 392 Cb -0.14 -2.32 -0.06 0.00 0.03 0.00 0.00 46.19 43.71 1xyf s LEU 392 CO -0.11 -1.13 1.05 0.20 0.23 0.00 0.00 176.35 176.58 1xyf s ASN 393 N 3.59 6.01 0.57 2.29 0.01 -0.49 -4.94 114.94 121.97 1xyf s ASN 393 Ca 0.14 1.87 0.28 0.00 -0.71 0.00 0.00 52.86 54.43 1xyf s ASN 393 Cb -0.22 -2.54 1.70 0.00 0.41 0.00 0.00 41.25 40.59 1xyf s ASN 393 CO 0.05 -1.01 2.21 0.77 -1.51 0.00 0.00 177.10 177.61 1xyf h SER 394 N 0.89 0.00 0.06 -1.22 4.64 -1.96 -0.96 113.55 115.00 1xyf h SER 394 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1xyf h SER 394 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 1xyf h SER 394 CO 0.58 0.02 0.00 -0.90 -0.87 0.00 0.00 176.83 175.66 1xyf n ASP 395 N -3.90 0.00 0.00 4.97 5.75 -1.26 -4.87 116.55 117.24 1xyf n ASP 395 Ca -0.03 -0.74 0.00 0.00 -0.01 0.00 0.00 54.79 54.01 1xyf n ASP 395 Cb 0.11 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.16 1xyf n ASP 395 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xyf n GLY 396 N 0.71 0.46 3.83 6.12 0.00 -0.36 -4.86 105.19 111.09 1xyf n GLY 396 Ca 0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 1xyf n GLY 396 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1xyf s SER 397 N -2.32 6.64 -0.21 1.61 1.04 -1.26 -0.68 113.70 118.53 1xyf s SER 397 Ca 0.00 1.65 0.01 0.00 0.48 0.00 0.00 55.95 58.10 1xyf s SER 397 Cb 0.00 -2.52 0.04 0.00 0.10 0.00 0.00 66.02 63.64 1xyf s SER 397 CO 0.00 -0.57 -0.13 -0.63 0.98 0.00 0.00 173.24 172.89 1xyf s ILE 398 N -2.43 1.89 -0.12 -1.02 1.01 -1.26 -1.40 121.20 117.87 1xyf s ILE 398 Ca 0.61 -1.15 -0.03 0.00 0.00 0.00 0.00 60.65 60.08 1xyf s ILE 398 Cb -0.10 -1.90 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 1xyf s ILE 398 CO 0.25 0.21 -0.03 -0.69 0.00 0.00 0.00 174.94 174.68 1xyf s VAL 399 N 1.29 3.99 0.14 2.92 1.01 -0.54 -0.98 120.40 128.23 1xyf s VAL 399 Ca -0.02 -0.34 -0.30 0.00 0.00 0.00 0.00 61.98 61.32 1xyf s VAL 399 Cb -0.16 -2.71 -0.07 0.00 0.00 0.00 0.00 36.38 33.43 1xyf s VAL 399 CO -0.09 0.54 1.08 -0.83 0.00 0.00 0.00 175.10 175.80 1xyf s GLY 400 N -0.13 2.82 0.11 4.51 0.00 -0.07 -0.38 107.32 114.17 1xyf s GLY 400 Ca 0.03 0.76 -0.19 0.00 0.00 0.00 0.00 44.72 45.32 1xyf s GLY 400 CO 0.02 1.67 1.64 -2.08 0.00 0.00 0.00 173.10 174.36 1xyf h VAL 401 N 3.95 1.18 -0.12 1.40 2.07 -1.29 0.14 116.25 123.57 1xyf h VAL 401 Ca -0.43 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 1xyf h VAL 401 Cb 1.21 1.04 -0.00 0.00 -1.52 0.00 0.00 31.29 32.02 1xyf h VAL 401 CO 0.74 0.18 -0.04 -0.61 0.02 0.00 0.00 177.57 177.86 1xyf h GLN 402 N 0.27 0.25 0.15 1.57 4.15 -1.73 -3.36 115.11 116.41 1xyf h GLN 402 Ca 0.09 -0.10 -0.24 0.00 0.77 0.00 0.00 58.65 59.17 1xyf h GLN 402 Cb 0.18 -0.01 0.02 0.00 0.21 0.00 0.00 27.48 27.88 1xyf h GLN 402 CO -0.01 0.56 -1.10 0.66 -1.93 0.00 0.00 178.83 177.01 1xyf h SER 403 N -0.08 0.50 0.00 -0.69 4.64 -1.86 -3.48 113.55 112.57 1xyf h SER 403 Ca 0.03 -0.92 0.00 0.00 -0.47 0.00 0.00 61.79 60.43 1xyf h SER 403 Cb 0.48 -0.16 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1xyf h SER 403 CO 0.01 1.51 0.00 0.61 -0.87 0.00 0.00 176.83 178.10 1xyf n GLY 404 N 1.70 0.70 3.99 -0.77 0.00 0.48 -5.01 105.19 106.28 1xyf n GLY 404 Ca -0.18 -0.05 -0.19 0.00 0.00 0.00 0.00 46.02 45.60 1xyf n GLY 404 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xyf s LEU 405 N 0.00 4.03 0.09 0.99 1.02 -1.26 -4.77 118.68 118.78 1xyf s LEU 405 Ca 0.00 -0.14 0.01 0.00 0.02 0.00 0.00 54.13 54.02 1xyf s LEU 405 Cb 0.00 -2.78 -0.04 0.00 0.02 0.00 0.00 46.19 43.40 1xyf s LEU 405 CO 0.00 -0.37 0.23 0.00 0.02 0.00 0.00 176.35 176.22 1xyf s LEU 407 N -2.75 4.42 -0.05 0.00 1.43 -0.15 -1.08 118.68 120.50 1xyf s LEU 407 Ca 0.35 2.50 -0.02 0.00 -1.03 0.00 0.00 54.13 55.92 1xyf s LEU 407 Cb -0.12 -3.62 0.04 0.00 0.03 0.00 0.00 46.19 42.51 1xyf s LEU 407 CO 0.28 -0.54 0.09 -0.62 0.23 0.00 0.00 176.35 175.79 1xyf s ASP 408 N 0.14 0.43 -0.32 2.29 -1.08 0.02 -4.36 116.67 113.78 1xyf s ASP 408 Ca 0.55 0.18 -0.29 0.00 -0.52 0.00 0.00 52.55 52.47 1xyf s ASP 408 Cb -0.38 0.05 -0.00 0.00 -1.46 0.00 0.00 42.92 41.13 1xyf s ASP 408 CO 0.42 -0.19 1.39 0.00 0.52 0.00 0.00 175.17 177.32 1xyf s ALA 409 N 1.63 3.24 -0.48 3.66 0.00 -0.26 -1.10 121.76 128.45 1xyf s ALA 409 Ca -0.03 0.08 -0.47 0.00 0.00 0.00 0.00 51.96 51.55 1xyf s ALA 409 Cb -0.12 -3.84 -0.20 0.00 0.00 0.00 0.00 23.12 18.96 1xyf s ALA 409 CO -0.04 -2.01 1.59 0.28 0.00 0.00 0.00 175.76 175.58 1xyf n VAL 410 N 6.53 0.01 -1.21 0.00 0.31 0.11 -1.21 118.33 122.87 1xyf n VAL 410 Ca 0.16 -0.00 -0.07 0.00 -0.01 0.00 0.00 64.34 64.42 1xyf n VAL 410 Cb 0.47 -0.51 -0.03 0.00 -0.91 0.00 0.00 33.84 32.86 1xyf n VAL 410 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1xyf n GLY 411 N 3.94 0.76 2.18 2.92 0.00 -1.26 -1.61 105.19 112.11 1xyf n GLY 411 Ca 0.31 -0.08 -0.02 0.00 0.00 0.00 0.00 46.02 46.22 1xyf n GLY 411 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xyf n GLY 412 N -0.15 0.57 3.75 -0.02 0.00 -0.35 -4.99 105.19 104.00 1xyf n GLY 412 Ca -0.07 -0.45 -0.38 0.00 0.00 0.00 0.00 46.02 45.12 1xyf n GLY 412 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1xyf s GLY 413 N -2.50 2.87 0.00 -0.02 0.00 -0.63 -4.95 107.32 102.08 1xyf s GLY 413 Ca 0.00 1.27 0.00 0.00 0.00 0.00 0.00 44.72 45.99 1xyf s GLY 413 CO 0.00 1.77 0.02 -1.30 0.00 0.00 0.00 173.10 173.59 1xyf n THR 414 N -1.04 0.00 -1.94 0.90 -2.24 -1.26 -4.82 114.28 103.88 1xyf n THR 414 Ca 0.10 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 61.08 1xyf n THR 414 Cb 0.46 1.00 0.02 0.00 -2.10 0.00 0.00 70.33 69.71 1xyf n THR 414 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xyf s ALA 415 N -0.98 3.07 0.44 6.98 0.00 -1.26 -4.83 121.76 125.17 1xyf s ALA 415 Ca 0.00 -0.21 -0.25 0.00 0.00 0.00 0.00 51.96 51.50 1xyf s ALA 415 Cb 0.00 -3.02 -0.09 0.00 0.00 0.00 0.00 23.12 20.01 1xyf s ALA 415 CO 0.01 -0.81 1.24 0.09 0.00 0.00 0.00 175.76 176.29 1xyf n ASN 416 N -2.79 2.38 0.00 0.00 3.02 -1.26 -1.72 115.26 114.89 1xyf n ASN 416 Ca 0.06 1.08 0.00 0.00 -0.03 0.00 0.00 54.58 55.69 1xyf n ASN 416 Cb 0.55 -1.49 0.00 0.00 -0.61 0.00 0.00 39.78 38.23 1xyf n ASN 416 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xyf n GLY 417 N 0.86 1.96 3.73 7.41 0.00 0.56 -4.98 105.19 114.73 1xyf n GLY 417 Ca 0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 1xyf n GLY 417 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xyf s THR 418 N -2.36 2.23 0.51 2.61 2.01 -0.70 -4.77 115.64 115.17 1xyf s THR 418 Ca 0.00 0.17 -0.04 0.00 0.31 0.00 0.00 61.69 62.13 1xyf s THR 418 Cb 0.00 -3.11 -0.01 0.00 0.01 0.00 0.00 72.50 69.39 1xyf s THR 418 CO 0.00 0.02 0.80 -0.76 -0.69 0.00 0.00 174.62 173.99 1xyf s LEU 419 N 0.66 3.49 -0.06 4.42 1.43 -1.26 -0.71 118.68 126.64 1xyf s LEU 419 Ca 0.70 0.68 0.02 0.00 -1.03 0.00 0.00 54.13 54.49 1xyf s LEU 419 Cb -0.47 -3.56 -0.03 0.00 0.03 0.00 0.00 46.19 42.16 1xyf s LEU 419 CO 0.36 -0.79 -0.11 -0.63 0.23 0.00 0.00 176.35 175.41 1xyf s ILE 420 N -2.78 3.38 0.27 -0.59 -1.09 -1.11 0.06 121.20 119.33 1xyf s ILE 420 Ca 0.50 -0.60 0.03 0.00 -2.23 0.00 0.00 60.65 58.35 1xyf s ILE 420 Cb -0.10 -2.36 -0.03 0.00 -1.58 0.00 0.00 42.46 38.39 1xyf s ILE 420 CO 0.43 0.59 0.22 0.00 -1.23 0.00 0.00 174.94 174.95 1xyf s GLN 421 N -0.71 1.51 0.02 2.79 -2.07 -0.26 -3.08 119.66 117.86 1xyf s GLN 421 Ca 0.11 -1.82 -0.12 0.00 -1.82 0.00 0.00 55.36 51.71 1xyf s GLN 421 Cb -0.11 0.31 -0.05 0.00 -1.09 0.00 0.00 33.01 32.06 1xyf s GLN 421 CO 0.01 -0.54 0.37 -0.51 -1.32 0.00 0.00 175.29 173.30 1xyf s LEU 422 N -3.27 4.41 -0.02 2.60 1.43 -0.03 -0.80 118.68 123.00 1xyf s LEU 422 Ca 0.39 0.82 -0.29 0.00 -1.03 0.00 0.00 54.13 54.02 1xyf s LEU 422 Cb 0.04 -2.68 0.08 0.00 0.03 0.00 0.00 46.19 43.66 1xyf s LEU 422 CO 0.20 0.27 0.72 -0.47 0.23 0.00 0.00 176.35 177.31 1xyf s TYR 423 N -1.21 -0.58 -0.03 0.29 6.14 -0.24 -0.94 117.35 120.79 1xyf s TYR 423 Ca 0.26 0.86 -0.39 0.00 0.64 0.00 0.00 57.07 58.44 1xyf s TYR 423 Cb -0.15 0.45 -0.17 0.00 0.42 0.00 0.00 41.96 42.51 1xyf s TYR 423 CO 0.14 -0.61 1.36 0.43 0.64 0.00 0.00 175.55 177.51 1xyf n SER 424 N 0.58 1.39 -4.74 4.32 7.64 -1.26 -0.74 113.62 120.80 1xyf n SER 424 Ca -0.17 1.12 -0.41 0.00 1.01 0.00 0.00 58.87 60.42 1xyf n SER 424 Cb 0.59 -1.11 -0.02 0.00 -1.01 0.00 0.00 64.21 62.66 1xyf n SER 424 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xyf n SER 426 N 2.42 0.08 0.00 0.00 3.41 -1.26 -5.00 113.62 113.26 1xyf n SER 426 Ca 0.08 -1.04 0.00 0.00 -0.26 0.00 0.00 58.87 57.65 1xyf n SER 426 Cb 0.39 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 1xyf n SER 426 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1xyf n ASN 427 N -0.02 -5.49 -4.77 4.04 5.15 -1.26 -4.95 115.26 107.96 1xyf n ASN 427 Ca 0.00 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.67 1xyf n ASN 427 Cb 0.43 -3.18 0.09 0.00 -0.53 0.00 0.00 39.78 36.59 1xyf n ASN 427 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 1xyf s GLY 428 N -2.00 1.67 0.23 8.20 0.00 -1.26 -4.92 107.32 109.24 1xyf s GLY 428 Ca 0.00 0.20 0.23 0.00 0.00 0.00 0.00 44.72 45.15 1xyf s GLY 428 CO 0.00 0.56 1.70 -1.14 0.00 0.00 0.00 173.10 174.22 1xyf n SER 429 N -3.54 0.62 -0.48 1.64 3.41 -1.26 -1.68 113.62 112.33 1xyf n SER 429 Ca 0.09 0.64 0.12 0.00 -0.26 0.00 0.00 58.87 59.46 1xyf n SER 429 Cb 0.53 -0.78 0.46 0.00 -0.26 0.00 0.00 64.21 64.16 1xyf n SER 429 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1xyf n ASN 430 N -2.18 1.47 0.00 4.04 6.94 -1.26 -0.85 115.26 123.43 1xyf n ASN 430 Ca 0.03 -1.59 0.00 0.00 -0.02 0.00 0.00 54.58 52.99 1xyf n ASN 430 Cb 0.24 -0.06 0.00 0.00 -2.36 0.00 0.00 39.78 37.61 1xyf n ASN 430 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1xyf n GLN 431 N 0.17 0.63 -4.37 -3.83 6.02 -0.68 -1.10 117.38 114.22 1xyf n GLN 431 Ca 0.17 -0.88 -0.34 0.00 -0.01 0.00 0.00 57.00 55.95 1xyf n GLN 431 Cb 0.32 -0.97 -0.12 0.00 1.02 0.00 0.00 30.24 30.49 1xyf n GLN 431 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1xyf s ARG 432 N -0.39 3.68 0.23 -1.09 0.52 -1.14 -4.11 118.95 116.64 1xyf s ARG 432 Ca 0.00 -0.51 0.09 0.00 -0.52 0.00 0.00 55.73 54.79 1xyf s ARG 432 Cb 0.00 -2.93 -0.05 0.00 0.52 0.00 0.00 34.95 32.49 1xyf s ARG 432 CO 0.00 0.23 -0.16 -1.58 0.02 0.00 0.00 175.30 173.81 1xyf s TRP 433 N 0.40 1.92 -0.11 -0.53 0.52 0.14 0.06 118.94 121.34 1xyf s TRP 433 Ca -0.04 -0.49 -0.03 0.00 0.02 0.00 0.00 56.10 55.57 1xyf s TRP 433 Cb -0.14 -0.86 0.04 0.00 -1.15 0.00 0.00 33.47 31.36 1xyf s TRP 433 CO 0.03 0.49 0.04 -0.08 0.02 0.00 0.00 176.95 177.45 1xyf s THR 434 N -2.81 0.18 0.11 2.01 -1.32 0.13 -4.63 115.64 109.31 1xyf s THR 434 Ca 0.25 0.01 -0.30 0.00 -1.21 0.00 0.00 61.69 60.44 1xyf s THR 434 Cb -0.02 -0.54 -0.07 0.00 -1.51 0.00 0.00 72.50 70.36 1xyf s THR 434 CO 0.10 0.03 1.20 -0.13 -2.21 0.00 0.00 174.62 173.61 1xyf s ARG 435 N 2.04 4.46 0.00 7.08 0.52 -1.26 -0.71 118.95 131.08 1xyf s ARG 435 Ca 0.03 1.82 0.00 0.00 -0.52 0.00 0.00 55.73 57.06 1xyf s ARG 435 Cb -0.14 -3.30 0.00 0.00 0.52 0.00 0.00 34.95 32.03 1xyf s ARG 435 CO -0.06 -0.19 0.11 0.25 0.02 0.00 0.00 175.30 175.44