#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dyf h PRO 2 N 0.00 0.64 -0.83 3.17 0.13 -2.02 0.11 132.00 133.19 3dyf h PRO 2 Ca 0.00 -0.04 0.01 0.00 -0.87 0.00 0.00 66.00 65.10 3dyf h PRO 2 Cb 0.00 -0.15 -0.04 0.00 0.13 0.00 0.00 31.00 30.94 3dyf h PRO 2 CO 0.00 0.43 0.54 1.98 -0.23 0.00 0.00 178.00 180.72 3dyf h MET 3 N 0.66 1.10 0.00 0.86 1.85 -2.00 0.12 114.93 117.53 3dyf h MET 3 Ca 0.54 -0.07 -0.20 0.00 -0.61 0.00 0.00 59.70 59.36 3dyf h MET 3 Cb 0.97 -0.25 -0.03 0.00 0.43 0.00 0.00 31.60 32.73 3dyf h MET 3 CO -0.31 0.73 -0.97 -0.56 -0.40 0.00 0.00 176.91 175.41 3dyf h GLN 4 N 1.13 0.00 0.00 0.39 3.07 -1.29 -1.64 115.11 116.77 3dyf h GLN 4 Ca 0.30 0.00 -0.02 0.00 0.09 0.00 0.00 58.65 59.02 3dyf h GLN 4 Cb -0.12 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 27.44 3dyf h GLN 4 CO -0.06 0.97 -0.10 0.00 0.09 0.00 0.00 178.83 179.73 3dyf h MET 5 N 0.00 0.00 0.01 0.06 -0.00 -0.77 -1.66 114.93 112.58 3dyf h MET 5 Ca -0.01 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.65 3dyf h MET 5 Cb 1.72 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 33.33 3dyf h MET 5 CO 0.13 0.10 -0.16 0.35 -0.00 0.00 0.00 176.91 177.32 3dyf h PHE 6 N 0.00 0.14 0.00 -0.10 3.57 -0.69 -2.98 116.94 116.88 3dyf h PHE 6 Ca -0.00 -0.08 -0.03 0.00 3.53 0.00 0.00 57.97 61.39 3dyf h PHE 6 Cb 1.01 -0.01 -0.00 0.00 2.79 0.00 0.00 35.95 39.73 3dyf h PHE 6 CO 0.00 0.94 -0.13 0.52 -2.23 0.00 0.00 178.31 177.41 3dyf h MET 7 N -0.71 0.00 -0.42 1.11 2.86 -1.29 -1.96 114.93 114.52 3dyf h MET 7 Ca -0.02 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 3dyf h MET 7 Cb 1.00 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.64 3dyf h MET 7 CO 0.03 0.13 -0.03 0.37 1.06 0.00 0.00 176.91 178.48 3dyf h GLN 8 N 0.00 0.77 0.00 1.72 4.15 -1.30 -2.68 115.11 117.77 3dyf h GLN 8 Ca -0.00 -0.26 -0.07 0.00 0.77 0.00 0.00 58.65 59.09 3dyf h GLN 8 Cb 0.30 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.92 3dyf h GLN 8 CO 0.02 0.86 -0.33 0.28 -1.93 0.00 0.00 178.83 177.72 3dyf h VAL 9 N 0.60 0.81 -0.32 2.39 2.07 -1.22 -2.82 116.25 117.76 3dyf h VAL 9 Ca 0.12 -1.38 -0.01 0.00 0.82 0.00 0.00 66.70 66.24 3dyf h VAL 9 Cb 0.53 1.86 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 3dyf h VAL 9 CO 0.03 0.32 0.15 0.22 0.02 0.00 0.00 177.57 178.31 3dyf h TYR 10 N 0.00 0.46 -0.69 1.57 3.20 -1.08 0.15 116.97 120.58 3dyf h TYR 10 Ca -0.00 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.84 3dyf h TYR 10 Cb 0.83 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.93 3dyf h TYR 10 CO 0.00 0.41 0.40 -0.44 -1.64 0.00 0.00 178.16 176.90 3dyf h ASP 11 N 0.38 0.84 -0.50 -2.11 3.32 -1.37 0.25 116.42 117.23 3dyf h ASP 11 Ca 0.11 -0.07 0.06 0.00 0.02 0.00 0.00 57.03 57.15 3dyf h ASP 11 Cb 0.12 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.41 3dyf h ASP 11 CO -0.01 0.67 0.20 -0.08 -1.72 0.00 0.00 179.24 178.29 3dyf h GLU 12 N 0.94 0.38 -0.13 3.56 4.81 -1.19 -0.15 114.58 122.79 3dyf h GLU 12 Ca 0.25 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.38 3dyf h GLU 12 Cb -0.01 -0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 3dyf h GLU 12 CO -0.04 0.25 -0.21 0.82 -0.73 0.00 0.00 179.01 179.10 3dyf h ILE 13 N 0.39 1.37 -0.99 2.32 2.04 -0.13 -2.89 117.51 119.62 3dyf h ILE 13 Ca 0.24 -1.44 0.04 0.00 1.00 0.00 0.00 64.86 64.70 3dyf h ILE 13 Cb 0.23 1.99 -0.06 0.00 -0.74 0.00 0.00 36.82 38.24 3dyf h ILE 13 CO -0.22 0.42 0.65 -0.61 0.00 0.00 0.00 178.15 178.39 3dyf h GLN 14 N -0.02 1.20 -0.09 2.37 4.15 -0.27 -1.84 115.11 120.60 3dyf h GLN 14 Ca 0.01 -0.07 -0.00 0.00 0.77 0.00 0.00 58.65 59.36 3dyf h GLN 14 Cb 0.78 -0.27 -0.00 0.00 0.21 0.00 0.00 27.48 28.19 3dyf h GLN 14 CO 0.05 0.79 0.05 1.98 -1.93 0.00 0.00 178.83 179.77 3dyf h MET 15 N 1.23 0.12 0.56 1.69 4.05 -1.03 -1.12 114.93 120.43 3dyf h MET 15 Ca 0.40 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.79 3dyf h MET 15 Cb 0.05 -0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.81 3dyf h MET 15 CO -0.14 0.15 -0.38 0.35 0.23 0.00 0.00 176.91 177.12 3dyf h PHE 16 N 0.07 -1.02 0.23 1.39 3.57 -1.21 -0.36 116.94 119.60 3dyf h PHE 16 Ca 0.03 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.53 3dyf h PHE 16 Cb 0.06 0.37 -0.03 0.00 2.79 0.00 0.00 35.95 39.14 3dyf h PHE 16 CO -0.05 -0.57 -0.31 -0.07 -2.23 0.00 0.00 178.31 175.08 3dyf h LEU 17 N -0.90 -0.87 -0.98 0.59 3.38 -1.35 0.10 115.31 115.28 3dyf h LEU 17 Ca -0.06 0.09 0.03 0.00 0.09 0.00 0.00 57.88 58.02 3dyf h LEU 17 Cb 0.75 0.31 -0.05 0.00 0.09 0.00 0.00 40.66 41.76 3dyf h LEU 17 CO 0.04 -0.42 0.65 -0.07 0.09 0.00 0.00 178.44 178.72 3dyf h LEU 18 N -0.60 1.09 -0.43 1.67 3.38 -1.20 -1.09 115.31 118.14 3dyf h LEU 18 Ca 0.00 -0.02 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 3dyf h LEU 18 Cb 0.58 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.05 3dyf h LEU 18 CO -0.11 0.77 -0.73 -0.33 0.09 0.00 0.00 178.44 178.12 3dyf h GLU 19 N 1.28 0.00 -0.31 1.13 5.08 -0.89 -2.75 114.58 118.12 3dyf h GLU 19 Ca 0.38 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.65 3dyf h GLU 19 Cb -0.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3dyf h GLU 19 CO -0.10 0.73 -0.16 1.49 -1.00 0.00 0.00 179.01 179.97 3dyf h GLU 20 N 0.00 0.54 -0.47 2.33 4.81 -0.08 -0.36 114.58 121.35 3dyf h GLU 20 Ca -0.01 -0.18 -0.12 0.00 -0.13 0.00 0.00 59.36 58.92 3dyf h GLU 20 Cb 1.36 -0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.68 3dyf h GLU 20 CO 0.10 0.69 -0.19 -0.07 -0.73 0.00 0.00 179.01 178.80 3dyf h LEU 21 N 0.50 0.96 -0.52 1.64 3.38 -1.05 0.15 115.31 120.37 3dyf h LEU 21 Ca 0.08 -0.35 -0.16 0.00 0.09 0.00 0.00 57.88 57.54 3dyf h LEU 21 Cb 0.57 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3dyf h LEU 21 CO 0.04 1.12 -0.72 -0.33 0.09 0.00 0.00 178.44 178.64 3dyf h GLU 22 N 0.82 0.14 0.01 1.13 5.08 -1.18 -2.10 114.58 118.48 3dyf h GLU 22 Ca 0.11 -0.12 -0.30 0.00 -1.00 0.00 0.00 59.36 58.05 3dyf h GLU 22 Cb 0.75 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.98 3dyf h GLU 22 CO 0.06 0.80 -1.78 1.28 -1.00 0.00 0.00 179.01 178.37 3dyf n LEU 23 N -3.75 0.97 0.00 1.33 4.77 -0.18 -3.91 117.00 116.24 3dyf n LEU 23 Ca -0.02 0.37 0.00 0.00 -0.03 0.00 0.00 56.01 56.33 3dyf n LEU 23 Cb 0.70 0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 3dyf n LEU 23 CO 0.45 0.43 0.26 0.29 -1.33 0.00 0.00 177.39 177.49 3dyf n LYS 24 N -3.06 -0.64 0.00 3.23 5.02 0.53 -4.59 118.16 118.65 3dyf n LYS 24 Ca -0.19 -0.56 0.00 0.00 -2.02 0.00 0.00 58.31 55.54 3dyf n LYS 24 Cb 1.06 -0.98 0.00 0.00 -0.02 0.00 0.00 35.03 35.09 3dyf n LYS 24 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 3dyf n PHE 25 N -0.04 0.00 -3.47 2.13 3.72 -0.83 -5.01 117.46 113.95 3dyf n PHE 25 Ca 0.00 -0.20 -0.19 0.00 -0.05 0.00 0.00 57.45 57.01 3dyf n PHE 25 Cb 0.03 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 38.55 3dyf n PHE 25 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3dyf n ASP 26 N -0.20 -2.75 -4.89 4.37 5.75 -0.96 -4.92 116.55 112.95 3dyf n ASP 26 Ca 0.00 -0.65 -0.31 0.00 -0.01 0.00 0.00 54.79 53.82 3dyf n ASP 26 Cb 0.38 -0.95 -0.05 0.00 -1.03 0.00 0.00 41.12 39.47 3dyf n ASP 26 CO 0.00 0.00 0.00 -0.32 -0.11 0.00 0.00 177.20 176.77 3dyf s MET 27 N -4.56 3.66 0.29 0.11 1.75 -0.97 -5.00 119.30 114.58 3dyf s MET 27 Ca 0.08 0.00 -0.11 0.00 -1.25 0.00 0.00 55.69 54.42 3dyf s MET 27 Cb -0.05 -2.78 -0.07 0.00 2.84 0.00 0.00 34.83 34.77 3dyf s MET 27 CO 0.55 0.41 0.64 0.16 -0.65 0.00 0.00 175.02 176.14 3dyf s ASP 28 N -2.49 6.64 0.37 1.11 1.47 -1.26 -4.63 116.67 117.89 3dyf s ASP 28 Ca 0.43 1.05 0.14 0.00 1.18 0.00 0.00 52.55 55.35 3dyf s ASP 28 Cb -0.12 -2.28 0.99 0.00 -0.34 0.00 0.00 42.92 41.17 3dyf s ASP 28 CO 0.24 -0.17 1.79 -0.65 0.68 0.00 0.00 175.17 177.06 3dyf h PRO 29 N 2.18 0.49 0.27 2.11 0.11 -1.98 0.68 132.00 135.85 3dyf h PRO 29 Ca -0.47 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 3dyf h PRO 29 Cb 1.18 -0.11 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 3dyf h PRO 29 CO 0.67 0.33 -0.25 -0.91 -0.21 0.00 0.00 178.00 177.62 3dyf h ASN 30 N 0.51 -0.67 1.07 -2.05 2.35 -1.99 0.81 115.58 115.62 3dyf h ASN 30 Ca 0.56 0.06 -0.03 0.00 -0.55 0.00 0.00 56.30 56.34 3dyf h ASN 30 Cb 1.24 0.23 -0.00 0.00 0.05 0.00 0.00 38.32 39.83 3dyf h ASN 30 CO -0.29 -0.37 -0.14 0.03 -1.65 0.00 0.00 177.43 175.00 3dyf h ARG 31 N -0.54 0.00 -0.27 0.81 3.08 -1.61 -1.63 114.38 114.22 3dyf h ARG 31 Ca -0.01 0.00 -0.18 0.00 0.07 0.00 0.00 59.98 59.86 3dyf h ARG 31 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 3dyf h ARG 31 CO -0.05 0.14 -0.52 0.28 -1.07 0.00 0.00 179.97 178.75 3dyf h VAL 32 N 0.00 1.28 -0.74 2.04 2.07 -0.49 -2.05 116.25 118.37 3dyf h VAL 32 Ca -0.00 -1.71 -0.02 0.00 0.82 0.00 0.00 66.70 65.79 3dyf h VAL 32 Cb 0.72 1.69 -0.03 0.00 -1.52 0.00 0.00 31.29 32.15 3dyf h VAL 32 CO 0.02 0.55 0.40 -0.09 0.02 0.00 0.00 177.57 178.47 3dyf h ARG 33 N 0.59 1.03 0.27 1.57 2.43 -0.46 -1.28 114.38 118.53 3dyf h ARG 33 Ca 0.01 -0.12 -0.01 0.00 -0.81 0.00 0.00 59.98 59.05 3dyf h ARG 33 Cb 1.13 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 30.48 3dyf h ARG 33 CO 0.12 0.77 -0.15 -0.92 -1.51 0.00 0.00 179.97 178.28 3dyf h TYR 34 N 1.02 -0.38 -0.08 2.20 3.20 -1.15 -1.17 116.97 120.61 3dyf h TYR 34 Ca 0.26 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 3dyf h TYR 34 Cb 0.04 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.44 3dyf h TYR 34 CO -0.00 -0.23 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.08 3dyf h LEU 35 N -0.39 0.11 -0.36 2.82 3.38 -1.18 0.68 115.31 120.36 3dyf h LEU 35 Ca -0.03 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 3dyf h LEU 35 Cb 0.31 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3dyf h LEU 35 CO 0.05 0.26 -0.18 -0.09 0.09 0.00 0.00 178.44 178.57 3dyf h ARG 36 N 0.11 0.75 -0.15 1.13 2.43 -0.97 0.27 114.38 117.94 3dyf h ARG 36 Ca 0.02 -0.33 -0.03 0.00 -0.81 0.00 0.00 59.98 58.83 3dyf h ARG 36 Cb 0.31 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 3dyf h ARG 36 CO 0.02 0.94 -0.02 -0.22 -1.51 0.00 0.00 179.97 179.18 3dyf h LYS 37 N 0.54 0.29 -0.15 0.20 3.64 -0.34 -1.47 116.57 119.28 3dyf h LYS 37 Ca 0.08 -0.10 0.04 0.00 -1.27 0.00 0.00 60.65 59.40 3dyf h LYS 37 Cb 0.72 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.48 3dyf h LYS 37 CO 0.05 0.54 -0.12 1.98 -2.27 0.00 0.00 179.45 179.64 3dyf h MET 38 N 0.00 -0.12 0.36 1.90 4.05 0.47 -1.12 114.93 120.48 3dyf h MET 38 Ca 0.04 0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.47 3dyf h MET 38 Cb 0.43 0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 31.22 3dyf h MET 38 CO 0.01 -0.08 -0.52 1.98 0.23 0.00 0.00 176.91 178.53 3dyf h MET 39 N -0.13 -0.89 -1.00 0.39 1.85 -0.35 -0.32 114.93 114.49 3dyf h MET 39 Ca 0.10 0.06 0.11 0.00 -0.61 0.00 0.00 59.70 59.36 3dyf h MET 39 Cb 0.27 0.20 -0.08 0.00 0.43 0.00 0.00 31.60 32.42 3dyf h MET 39 CO -0.23 -0.59 0.64 -0.44 -0.40 0.00 0.00 176.91 175.88 3dyf h ASP 40 N -0.92 0.94 -0.04 1.39 3.32 -1.09 0.23 116.42 120.25 3dyf h ASP 40 Ca -0.04 0.04 -0.21 0.00 0.02 0.00 0.00 57.03 56.84 3dyf h ASP 40 Cb 0.84 -0.15 0.01 0.00 0.22 0.00 0.00 39.33 40.24 3dyf h ASP 40 CO -0.15 0.52 -0.75 0.74 -1.72 0.00 0.00 179.24 177.87 3dyf h THR 41 N 1.02 1.30 0.00 0.35 2.02 -0.96 -1.94 112.91 114.71 3dyf h THR 41 Ca 0.49 -2.01 -0.22 0.00 0.77 0.00 0.00 66.41 65.44 3dyf h THR 41 Cb 0.44 2.00 -0.04 0.00 -1.74 0.00 0.00 68.15 68.81 3dyf h THR 41 CO -0.25 0.63 -1.30 0.71 0.37 0.00 0.00 175.52 175.67 3dyf h THR 42 N 0.47 1.01 0.00 3.16 1.35 -0.73 -3.38 112.91 114.79 3dyf h THR 42 Ca -0.04 -2.69 -0.12 0.00 -0.55 0.00 0.00 66.41 63.01 3dyf h THR 42 Cb 1.37 2.46 -0.02 0.00 -1.73 0.00 0.00 68.15 70.22 3dyf h THR 42 CO 0.15 0.58 -1.78 0.00 -0.25 0.00 0.00 175.52 174.21 3dyf s LEU 44 N -5.15 3.63 0.00 0.00 1.43 -0.73 -4.64 118.68 113.22 3dyf s LEU 44 Ca -0.06 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 3dyf s LEU 44 Cb 0.10 -2.25 0.00 0.00 0.03 0.00 0.00 46.19 44.07 3dyf s LEU 44 CO 0.85 -0.33 0.00 0.61 0.23 0.00 0.00 176.35 177.71 3dyf n GLY 45 N -1.37 0.43 0.00 -3.19 0.00 -1.26 -4.79 105.19 95.00 3dyf n GLY 45 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3dyf n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dyf n GLY 46 N -2.00 -0.39 0.10 -0.02 0.00 -1.26 -4.91 105.19 96.71 3dyf n GLY 46 Ca 0.00 -1.75 0.12 0.00 0.00 0.00 0.00 46.02 44.39 3dyf n GLY 46 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3dyf n LYS 47 N -0.70 0.32 -1.52 1.61 5.02 -1.26 -4.95 118.16 116.69 3dyf n LYS 47 Ca 0.00 -0.20 -0.18 0.00 -2.02 0.00 0.00 58.31 55.91 3dyf n LYS 47 Cb 0.00 -1.50 -0.08 0.00 -0.02 0.00 0.00 35.03 33.44 3dyf n LYS 47 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 3dyf n TYR 48 N -1.17 -0.09 -0.05 2.13 4.01 -1.26 -4.86 117.16 115.87 3dyf n TYR 48 Ca 0.08 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.74 3dyf n TYR 48 Cb 0.34 -3.19 -0.02 0.00 -0.31 0.00 0.00 39.34 36.16 3dyf n TYR 48 CO 0.00 0.00 0.00 -0.91 -0.46 0.00 0.00 176.86 175.49 3dyf h ASN 49 N 0.00 -0.16 -0.08 7.72 -0.26 -1.98 0.12 115.58 120.94 3dyf h ASN 49 Ca -0.37 0.06 0.03 0.00 -0.56 0.00 0.00 56.30 55.46 3dyf h ASN 49 Cb 1.22 0.12 -0.03 0.00 -1.06 0.00 0.00 38.32 38.57 3dyf h ASN 49 CO 0.54 -0.05 -0.11 0.03 -1.06 0.00 0.00 177.43 176.78 3dyf h ARG 50 N 0.03 -0.14 -0.26 0.81 3.08 -1.89 0.05 114.38 116.06 3dyf h ARG 50 Ca 0.11 0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.12 3dyf h ARG 50 Cb 0.16 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.23 3dyf h ARG 50 CO -0.21 -0.09 -0.04 0.78 -1.07 0.00 0.00 179.97 179.34 3dyf h GLY 51 N -0.14 0.52 2.00 0.04 0.00 -1.69 -2.97 103.07 100.82 3dyf h GLY 51 Ca 0.07 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 3dyf h GLY 51 CO -0.17 0.37 -0.22 1.41 0.00 0.00 0.00 176.54 177.94 3dyf h LEU 52 N 0.24 0.00 -0.32 3.11 3.38 -0.67 -2.54 115.31 118.52 3dyf h LEU 52 Ca 0.07 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 3dyf h LEU 52 Cb 0.48 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3dyf h LEU 52 CO 0.02 0.22 0.08 0.74 0.09 0.00 0.00 178.44 179.59 3dyf h THR 53 N 0.00 1.22 -0.09 0.22 2.02 -0.86 -1.73 112.91 113.68 3dyf h THR 53 Ca -0.00 -0.73 0.04 0.00 0.77 0.00 0.00 66.41 66.49 3dyf h THR 53 Cb 0.44 1.09 -0.05 0.00 -1.74 0.00 0.00 68.15 67.89 3dyf h THR 53 CO 0.03 0.24 -0.25 0.58 0.37 0.00 0.00 175.52 176.49 3dyf h VAL 54 N 0.36 0.41 -0.63 3.16 2.07 -1.31 -0.39 116.25 119.91 3dyf h VAL 54 Ca 0.10 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.68 3dyf h VAL 54 Cb 0.29 0.41 -0.06 0.00 -1.52 0.00 0.00 31.29 30.41 3dyf h VAL 54 CO 0.00 0.00 0.33 0.40 0.02 0.00 0.00 177.57 178.32 3dyf h ILE 55 N -0.34 0.93 -0.08 4.57 2.04 -1.42 -1.54 117.51 121.66 3dyf h ILE 55 Ca 0.09 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.74 3dyf h ILE 55 Cb 0.47 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 3dyf h ILE 55 CO -0.29 0.11 0.05 -0.78 0.00 0.00 0.00 178.15 177.25 3dyf h ASP 56 N 0.61 0.10 -0.14 1.72 3.58 -0.62 0.35 116.42 122.02 3dyf h ASP 56 Ca 0.29 -0.01 0.04 0.00 0.42 0.00 0.00 57.03 57.77 3dyf h ASP 56 Cb 0.21 -0.02 -0.04 0.00 1.72 0.00 0.00 39.33 41.20 3dyf h ASP 56 CO -0.20 0.08 -0.13 0.58 -2.88 0.00 0.00 179.24 176.69 3dyf h VAL 57 N 0.10 0.65 0.22 2.25 2.07 -0.73 0.18 116.25 121.00 3dyf h VAL 57 Ca 0.03 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 3dyf h VAL 57 Cb -0.00 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.39 3dyf h VAL 57 CO -0.01 0.00 -0.34 0.00 0.02 0.00 0.00 177.57 177.24 3dyf h ALA 58 N 0.94 -0.95 -0.33 1.67 0.00 -1.04 -1.46 119.26 118.10 3dyf h ALA 58 Ca 0.09 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 54.95 3dyf h ALA 58 Cb 0.28 0.65 -0.08 0.00 0.00 0.00 0.00 17.79 18.64 3dyf h ALA 58 CO -0.22 -1.00 -0.49 1.49 0.00 0.00 0.00 179.25 179.03 3dyf h GLU 59 N -0.60 -0.40 -0.65 0.00 4.81 -0.70 -2.13 114.58 114.91 3dyf h GLU 59 Ca -0.03 0.03 0.13 0.00 -0.13 0.00 0.00 59.36 59.36 3dyf h GLU 59 Cb 0.55 0.09 -0.12 0.00 0.63 0.00 0.00 28.75 29.90 3dyf h GLU 59 CO -0.11 -0.27 -0.14 0.77 -0.73 0.00 0.00 179.01 178.54 3dyf h SER 60 N -0.42 -0.56 0.00 1.04 0.02 -0.51 0.69 113.55 113.82 3dyf h SER 60 Ca 0.09 0.19 0.00 0.00 -0.84 0.00 0.00 61.79 61.23 3dyf h SER 60 Cb 0.61 0.39 0.00 0.00 0.14 0.00 0.00 62.40 63.54 3dyf h SER 60 CO -0.54 -0.20 0.00 0.18 -1.14 0.00 0.00 176.83 175.13 3dyf n LEU 61 N -5.42 1.40 -4.56 5.07 4.32 -0.56 -4.82 117.00 112.43 3dyf n LEU 61 Ca 0.08 -0.70 -0.40 0.00 -0.02 0.00 0.00 56.01 54.98 3dyf n LEU 61 Cb 0.35 -0.50 -0.03 0.00 -1.62 0.00 0.00 43.42 41.62 3dyf n LEU 61 CO 0.04 0.30 1.46 -0.76 -1.22 0.00 0.00 177.39 177.21 3dyf s LEU 62 N 0.00 3.29 -0.31 2.23 1.43 0.23 -5.03 118.68 120.53 3dyf s LEU 62 Ca 0.00 0.23 -0.13 0.00 -1.03 0.00 0.00 54.13 53.20 3dyf s LEU 62 Cb 0.00 -2.68 0.19 0.00 0.03 0.00 0.00 46.19 43.73 3dyf s LEU 62 CO 0.00 -2.13 1.13 -0.55 0.23 0.00 0.00 176.35 175.03 3dyf s SER 63 N 6.52 -0.11 0.11 2.29 0.15 -1.26 -5.12 113.70 116.28 3dyf s SER 63 Ca 0.59 -0.04 0.00 0.00 0.70 0.00 0.00 55.95 57.20 3dyf s SER 63 Cb -0.12 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.51 3dyf s SER 63 CO 0.21 -0.01 0.00 -0.67 1.20 0.00 0.00 173.24 173.97 3dyf n ASP 74 N 3.85 -2.20 -0.04 5.45 2.03 -1.26 -5.12 116.55 119.27 3dyf n ASP 74 Ca 0.06 0.23 -0.04 0.00 0.52 0.00 0.00 54.79 55.56 3dyf n ASP 74 Cb 0.63 -2.07 -0.14 0.00 -0.72 0.00 0.00 41.12 38.83 3dyf n ASP 74 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3dyf n GLY 75 N -2.24 -1.05 0.11 0.27 0.00 -1.26 -3.81 105.19 97.21 3dyf n GLY 75 Ca -0.01 -0.27 -0.01 0.00 0.00 0.00 0.00 46.02 45.73 3dyf n GLY 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dyf h ALA 76 N 1.27 0.60 0.50 4.61 0.00 -2.05 -3.16 119.26 121.02 3dyf h ALA 76 Ca -0.33 -0.62 -0.02 0.00 0.00 0.00 0.00 54.91 53.94 3dyf h ALA 76 Cb 1.85 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3dyf h ALA 76 CO 0.04 0.85 -0.24 -0.09 0.00 0.00 0.00 179.25 179.81 3dyf h ARG 77 N 0.00 -0.64 -0.93 0.00 2.43 -2.00 -1.38 114.38 111.85 3dyf h ARG 77 Ca -0.01 0.04 0.27 0.00 -0.81 0.00 0.00 59.98 59.48 3dyf h ARG 77 Cb 1.46 0.15 -0.16 0.00 -0.42 0.00 0.00 29.97 31.00 3dyf h ARG 77 CO 0.09 -0.38 0.19 -0.09 -1.51 0.00 0.00 179.97 178.27 3dyf h ARG 78 N -1.13 0.10 0.67 0.20 2.43 -1.67 0.25 114.38 115.24 3dyf h ARG 78 Ca -0.07 -0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.06 3dyf h ARG 78 Cb 0.56 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 3dyf h ARG 78 CO 0.11 0.07 -0.37 -0.22 -1.51 0.00 0.00 179.97 178.05 3dyf h LYS 79 N 0.11 -0.92 -0.42 0.20 3.64 -1.50 -1.18 116.57 116.49 3dyf h LYS 79 Ca 0.60 0.06 0.09 0.00 -1.27 0.00 0.00 60.65 60.13 3dyf h LYS 79 Cb 1.29 0.21 -0.09 0.00 -0.41 0.00 0.00 32.23 33.23 3dyf h LYS 79 CO -0.77 -0.62 -0.25 -0.09 -2.27 0.00 0.00 179.45 175.45 3dyf h ARG 80 N -0.96 -0.17 -0.20 1.90 2.43 0.29 -1.32 114.38 116.35 3dyf h ARG 80 Ca -0.09 0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.15 3dyf h ARG 80 Cb 0.75 0.04 -0.07 0.00 -0.42 0.00 0.00 29.97 30.27 3dyf h ARG 80 CO 0.12 -0.11 -0.24 0.28 -1.51 0.00 0.00 179.97 178.51 3dyf h VAL 81 N -0.18 0.41 -0.49 0.20 2.07 -0.59 0.12 116.25 117.79 3dyf h VAL 81 Ca 0.20 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.78 3dyf h VAL 81 Cb 0.49 0.41 -0.03 0.00 -1.52 0.00 0.00 31.29 30.64 3dyf h VAL 81 CO -0.52 0.00 0.33 -0.07 0.02 0.00 0.00 177.57 177.33 3dyf h LEU 82 N -0.26 0.37 0.04 2.57 3.38 -0.57 0.36 115.31 121.20 3dyf h LEU 82 Ca 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 3dyf h LEU 82 Cb 0.45 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.12 3dyf h LEU 82 CO -0.36 0.24 -0.02 -0.74 0.09 0.00 0.00 178.44 177.65 3dyf h HIS 83 N 0.42 -0.05 -0.89 1.13 2.76 -0.00 -2.25 115.15 116.27 3dyf h HIS 83 Ca 0.21 -0.00 0.15 0.00 -2.20 0.00 0.00 60.37 58.54 3dyf h HIS 83 Cb 0.31 0.02 -0.07 0.00 1.55 0.00 0.00 27.41 29.22 3dyf h HIS 83 CO -0.00 0.42 0.57 -0.44 -1.30 0.00 0.00 177.93 177.19 3dyf h ASP 84 N -0.56 0.61 -0.36 3.26 3.32 -0.02 0.57 116.42 123.25 3dyf h ASP 84 Ca -0.01 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 3dyf h ASP 84 Cb 0.50 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.96 3dyf h ASP 84 CO 0.01 0.30 0.15 0.00 -1.72 0.00 0.00 179.24 177.97 3dyf h ALA 85 N 1.61 0.47 -0.86 3.45 0.00 -0.83 -1.95 119.26 121.14 3dyf h ALA 85 Ca 0.45 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 55.27 3dyf h ALA 85 Cb 0.79 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.38 3dyf h ALA 85 CO -0.20 0.07 0.55 0.00 0.00 0.00 0.00 179.25 179.66 3dyf h VAL 87 N 1.04 1.21 -0.61 0.00 2.07 -1.10 -1.97 116.25 116.90 3dyf h VAL 87 Ca 0.36 -0.66 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 3dyf h VAL 87 Cb 0.07 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 3dyf h VAL 87 CO -0.14 0.24 0.18 0.00 0.02 0.00 0.00 177.57 177.88 3dyf h GLY 89 N 0.87 0.41 2.00 0.00 0.00 -0.51 -0.62 103.07 105.23 3dyf h GLY 89 Ca 0.19 -0.03 -0.06 0.00 0.00 0.00 0.00 47.33 47.43 3dyf h GLY 89 CO -0.00 -0.02 -0.30 1.49 0.00 0.00 0.00 176.54 177.70 3dyf h TRP 90 N 0.20 0.00 -0.41 5.60 4.06 -1.15 0.12 115.95 124.37 3dyf h TRP 90 Ca 0.17 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.11 3dyf h TRP 90 Cb 0.18 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.32 3dyf h TRP 90 CO -0.18 0.30 0.25 0.52 -3.56 0.00 0.00 178.44 175.77 3dyf h MET 91 N 0.00 0.56 -0.34 0.49 2.86 -0.02 1.03 114.93 119.50 3dyf h MET 91 Ca -0.00 -0.05 -0.14 0.00 -2.06 0.00 0.00 59.70 57.45 3dyf h MET 91 Cb 0.55 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 32.09 3dyf h MET 91 CO 0.04 0.41 -0.32 0.82 1.06 0.00 0.00 176.91 178.92 3dyf h ILE 92 N 0.54 1.29 -0.63 -1.22 2.04 -0.69 -0.35 117.51 118.49 3dyf h ILE 92 Ca 0.15 -1.49 -0.03 0.00 1.00 0.00 0.00 64.86 64.49 3dyf h ILE 92 Cb -0.01 1.46 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3dyf h ILE 92 CO -0.03 0.49 0.26 -0.33 0.00 0.00 0.00 178.15 178.54 3dyf h GLU 93 N 0.61 0.94 0.00 2.37 4.39 -0.37 0.78 114.58 123.30 3dyf h GLU 93 Ca 0.06 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.53 3dyf h GLU 93 Cb 0.90 -0.15 -0.01 0.00 -0.10 0.00 0.00 28.75 29.39 3dyf h GLU 93 CO 0.08 0.79 -0.29 0.74 -1.16 0.00 0.00 179.01 179.17 3dyf h PHE 94 N 0.88 0.00 -0.18 4.33 -1.00 0.12 -1.37 116.94 119.72 3dyf h PHE 94 Ca 0.21 0.00 -0.20 0.00 2.81 0.00 0.00 57.97 60.79 3dyf h PHE 94 Cb 0.19 0.00 0.01 0.00 3.61 0.00 0.00 35.95 39.76 3dyf h PHE 94 CO 0.01 0.29 -0.66 1.25 -1.61 0.00 0.00 178.31 177.60 3dyf h LEU 95 N 0.00 0.89 -0.67 1.54 5.85 0.24 -1.65 115.31 121.52 3dyf h LEU 95 Ca -0.00 -0.60 -0.14 0.00 0.84 0.00 0.00 57.88 57.97 3dyf h LEU 95 Cb 0.66 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 3dyf h LEU 95 CO 0.04 1.34 -0.61 -0.61 -0.34 0.00 0.00 178.44 178.26 3dyf h GLN 96 N 0.49 0.19 -0.24 1.25 4.15 -0.72 -2.47 115.11 117.75 3dyf h GLN 96 Ca -0.03 -0.13 0.00 0.00 0.77 0.00 0.00 58.65 59.26 3dyf h GLN 96 Cb 1.28 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.98 3dyf h GLN 96 CO 0.14 0.74 0.16 0.00 -1.93 0.00 0.00 178.83 177.94 3dyf h ALA 97 N 1.22 0.31 -0.90 3.38 0.00 -1.15 0.26 119.26 122.38 3dyf h ALA 97 Ca -0.01 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.92 3dyf h ALA 97 Cb 1.11 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.75 3dyf h ALA 97 CO 0.09 -0.22 0.58 1.25 0.00 0.00 0.00 179.25 180.96 3dyf h HIS 98 N 0.33 1.10 0.00 0.00 -0.00 -1.12 -2.12 115.15 113.34 3dyf h HIS 98 Ca 0.09 0.03 -0.16 0.00 -0.00 0.00 0.00 60.37 60.33 3dyf h HIS 98 Cb -0.03 -0.36 -0.02 0.00 -0.00 0.00 0.00 27.41 26.99 3dyf h HIS 98 CO -0.06 0.64 -0.76 1.88 -0.00 0.00 0.00 177.93 179.62 3dyf h TYR 99 N 1.14 0.00 -0.16 5.26 0.05 -0.95 -3.09 116.97 119.23 3dyf h TYR 99 Ca 0.36 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.94 3dyf h TYR 99 Cb -0.01 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.74 3dyf h TYR 99 CO -0.01 0.76 -0.65 -0.07 -1.05 0.00 0.00 178.16 177.14 3dyf h LEU 100 N 0.00 0.85 0.40 3.88 3.38 -0.23 -0.19 115.31 123.40 3dyf h LEU 100 Ca -0.01 -0.62 -0.01 0.00 0.09 0.00 0.00 57.88 57.34 3dyf h LEU 100 Cb 1.41 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 3dyf h LEU 100 CO 0.10 1.32 -0.46 0.58 0.09 0.00 0.00 178.44 180.07 3dyf h VAL 101 N 0.42 0.10 -0.85 1.22 2.07 -1.44 0.59 116.25 118.36 3dyf h VAL 101 Ca -0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.46 3dyf h VAL 101 Cb 1.28 0.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 3dyf h VAL 101 CO 0.14 0.00 0.44 -0.33 0.02 0.00 0.00 177.57 177.83 3dyf h GLU 102 N -0.88 1.20 -0.76 1.57 4.39 -1.59 -2.89 114.58 115.61 3dyf h GLU 102 Ca -0.04 -0.16 -0.04 0.00 0.34 0.00 0.00 59.36 59.47 3dyf h GLU 102 Cb 0.79 -0.23 -0.03 0.00 -0.10 0.00 0.00 28.75 29.18 3dyf h GLU 102 CO -0.09 0.90 0.33 0.22 -1.16 0.00 0.00 179.01 179.20 3dyf h ASP 103 N 1.20 1.03 0.44 1.42 3.58 -0.72 0.17 116.42 123.53 3dyf h ASP 103 Ca 0.30 -0.16 -0.06 0.00 0.42 0.00 0.00 57.03 57.53 3dyf h ASP 103 Cb 0.07 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 40.85 3dyf h ASP 103 CO -0.04 0.90 -0.28 0.44 -2.88 0.00 0.00 179.24 177.37 3dyf h ASP 104 N 1.09 0.00 0.01 2.28 3.32 -0.69 0.89 116.42 123.32 3dyf h ASP 104 Ca 0.26 0.00 -0.22 0.00 0.02 0.00 0.00 57.03 57.09 3dyf h ASP 104 Cb 0.17 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.74 3dyf h ASP 104 CO -0.03 0.28 -0.87 0.40 -1.72 0.00 0.00 179.24 177.31 3dyf h ILE 105 N 0.00 1.35 -0.11 0.35 2.04 -1.20 0.38 117.51 120.32 3dyf h ILE 105 Ca -0.00 -2.19 -0.09 0.00 1.00 0.00 0.00 64.86 63.57 3dyf h ILE 105 Cb 0.58 2.51 -0.01 0.00 -0.74 0.00 0.00 36.82 39.16 3dyf h ILE 105 CO 0.04 0.66 -0.35 0.24 0.00 0.00 0.00 178.15 178.73 3dyf h MET 106 N 0.16 0.22 -0.01 2.37 2.86 0.01 -3.07 114.93 117.48 3dyf h MET 106 Ca -0.11 -0.09 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 3dyf h MET 106 Cb 1.55 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 33.20 3dyf h MET 106 CO 0.17 0.55 -0.52 -0.25 1.06 0.00 0.00 176.91 177.93 3dyf n ASP 107 N -4.08 1.48 -2.42 1.22 8.00 0.30 -4.96 116.55 116.10 3dyf n ASP 107 Ca -0.01 -1.17 -0.20 0.00 0.71 0.00 0.00 54.79 54.11 3dyf n ASP 107 Cb 0.43 0.47 0.00 0.00 -0.02 0.00 0.00 41.12 42.00 3dyf n ASP 107 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3dyf n ASN 108 N -0.55 -5.73 -4.70 -2.24 5.15 0.03 -4.93 115.26 102.29 3dyf n ASN 108 Ca 0.09 -0.09 -0.30 0.00 -0.60 0.00 0.00 54.58 53.68 3dyf n ASN 108 Cb 0.40 -4.70 0.14 0.00 -0.53 0.00 0.00 39.78 35.10 3dyf n ASN 108 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 3dyf s SER 109 N -2.28 3.42 -0.23 1.20 0.01 -0.63 -5.03 113.70 110.16 3dyf s SER 109 Ca 0.08 1.74 -0.09 0.00 1.31 0.00 0.00 55.95 58.98 3dyf s SER 109 Cb -0.03 -2.37 -0.11 0.00 0.21 0.00 0.00 66.02 63.72 3dyf s SER 109 CO 0.10 -2.71 -0.28 0.52 0.41 0.00 0.00 173.24 171.28 3dyf n VAL 110 N -3.95 1.26 -4.32 3.43 0.31 -1.26 -4.83 118.33 108.97 3dyf n VAL 110 Ca 0.08 -0.35 -0.18 0.00 -0.01 0.00 0.00 64.34 63.89 3dyf n VAL 110 Cb 0.54 -1.72 -0.10 0.00 -0.91 0.00 0.00 33.84 31.65 3dyf n VAL 110 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3dyf s THR 111 N -2.42 1.60 -0.11 2.52 -4.23 -1.26 -1.76 115.64 109.97 3dyf s THR 111 Ca -0.32 -2.15 -0.05 0.00 -1.18 0.00 0.00 61.69 58.00 3dyf s THR 111 Cb 0.12 -1.97 0.06 0.00 1.34 0.00 0.00 72.50 72.04 3dyf s THR 111 CO 0.42 -0.61 0.24 -0.60 -0.54 0.00 0.00 174.62 173.53 3dyf s ARG 112 N -3.59 0.15 -1.28 3.99 6.06 0.62 -4.10 118.95 120.80 3dyf s ARG 112 Ca 0.20 0.64 -0.01 0.00 -2.50 0.00 0.00 55.73 54.06 3dyf s ARG 112 Cb -0.00 -0.10 -0.00 0.00 0.06 0.00 0.00 34.95 34.91 3dyf s ARG 112 CO 0.05 -0.24 0.74 0.54 -2.50 0.00 0.00 175.30 173.89 3dyf n ARG 113 N 4.90 -4.79 -3.31 5.12 1.74 0.07 -1.95 116.66 118.44 3dyf n ARG 113 Ca -0.14 0.64 -0.24 0.00 -0.77 0.00 0.00 57.85 57.35 3dyf n ARG 113 Cb 0.51 -5.22 0.04 0.00 -1.02 0.00 0.00 32.46 26.77 3dyf n ARG 113 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dyf n GLY 114 N -1.52 -0.52 3.38 -0.13 0.00 0.99 -4.97 105.19 102.42 3dyf n GLY 114 Ca -0.28 0.16 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 3dyf n GLY 114 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dyf s LYS 115 N -6.00 1.20 0.39 1.61 2.20 -0.82 -5.09 119.74 113.23 3dyf s LYS 115 Ca 0.43 -0.59 -0.27 0.00 -0.36 0.00 0.00 55.97 55.18 3dyf s LYS 115 Cb -0.20 0.54 -0.10 0.00 -1.51 0.00 0.00 37.83 36.56 3dyf s LYS 115 CO 0.53 -0.50 1.37 -2.14 -0.36 0.00 0.00 175.35 174.24 3dyf s PRO 116 N -3.78 4.07 0.34 4.03 0.02 -1.26 0.23 135.00 138.65 3dyf s PRO 116 Ca 0.02 2.31 -0.28 0.00 0.02 0.00 0.00 61.00 63.08 3dyf s PRO 116 Cb 0.00 -2.88 -0.12 0.00 0.02 0.00 0.00 34.50 31.52 3dyf s PRO 116 CO -0.12 -0.47 1.27 0.00 -0.33 0.00 0.00 177.00 177.35 3dyf n TRP 118 N 0.29 -0.02 0.41 0.00 -0.00 -1.26 0.19 117.44 117.05 3dyf n TRP 118 Ca 0.05 1.19 0.03 0.00 -0.00 0.00 0.00 57.50 58.76 3dyf n TRP 118 Cb 0.36 -0.83 0.17 0.00 -0.00 0.00 0.00 31.31 31.01 3dyf n TRP 118 CO 0.00 0.00 0.00 2.48 -0.00 0.00 0.00 177.69 180.17 3dyf n TYR 119 N -5.39 0.00 -0.03 5.87 4.11 -1.26 -1.50 117.16 118.96 3dyf n TYR 119 Ca 0.09 0.00 0.06 0.00 -0.00 0.00 0.00 57.90 58.05 3dyf n TYR 119 Cb 0.37 0.00 -0.16 0.00 -0.00 0.00 0.00 39.34 39.55 3dyf n TYR 119 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 3dyf n ARG 120 N -0.95 0.67 -1.71 -3.48 5.12 0.50 -4.60 116.66 112.22 3dyf n ARG 120 Ca 0.04 -0.15 -0.43 0.00 -1.93 0.00 0.00 57.85 55.38 3dyf n ARG 120 Cb 0.02 -1.51 -0.02 0.00 -1.16 0.00 0.00 32.46 29.79 3dyf n ARG 120 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 177.63 176.42 3dyf n HIS 121 N -2.36 2.53 -0.36 -1.55 8.25 -0.56 -4.90 115.22 116.27 3dyf n HIS 121 Ca -0.11 0.35 -0.09 0.00 -0.26 0.00 0.00 57.72 57.61 3dyf n HIS 121 Cb 0.69 -2.53 -0.09 0.00 1.12 0.00 0.00 29.99 29.19 3dyf n HIS 121 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 3dyf n PRO 122 N 2.03 -0.37 0.00 -0.41 -0.02 -1.26 -0.86 135.00 134.10 3dyf n PRO 122 Ca 0.10 1.42 0.08 0.00 -2.02 0.00 0.00 63.50 63.08 3dyf n PRO 122 Cb 0.34 -2.09 0.46 0.00 -0.02 0.00 0.00 33.50 32.19 3dyf n PRO 122 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 3dyf n ASP 123 N -4.93 0.00 -4.50 2.55 -0.08 -1.26 -4.66 116.55 103.68 3dyf n ASP 123 Ca 0.02 -0.97 -0.35 0.00 -1.51 0.00 0.00 54.79 51.98 3dyf n ASP 123 Cb 0.22 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.56 3dyf n ASP 123 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 3dyf s VAL 124 N -2.00 4.17 0.37 5.18 1.01 -0.04 -5.10 120.40 124.00 3dyf s VAL 124 Ca 0.23 -0.24 0.04 0.00 0.00 0.00 0.00 61.98 62.02 3dyf s VAL 124 Cb 0.11 -2.88 -0.01 0.00 0.00 0.00 0.00 36.38 33.60 3dyf s VAL 124 CO 0.18 0.44 0.54 0.42 0.00 0.00 0.00 175.10 176.68 3dyf s THR 125 N 0.80 4.05 0.09 3.92 -4.23 -1.26 -4.59 115.64 114.41 3dyf s THR 125 Ca 0.01 -0.83 -0.18 0.00 -1.18 0.00 0.00 61.69 59.51 3dyf s THR 125 Cb -0.14 -3.43 -0.08 0.00 1.34 0.00 0.00 72.50 70.19 3dyf s THR 125 CO 0.02 -0.21 1.53 0.58 -0.54 0.00 0.00 174.62 175.99 3dyf h VAL 126 N 0.72 1.25 -0.95 2.29 2.07 -1.97 -0.98 116.25 118.68 3dyf h VAL 126 Ca -0.46 -0.90 0.08 0.00 0.82 0.00 0.00 66.70 66.25 3dyf h VAL 126 Cb 1.26 1.34 -0.07 0.00 -1.52 0.00 0.00 31.29 32.29 3dyf h VAL 126 CO 0.54 0.28 0.60 0.06 0.02 0.00 0.00 177.57 179.07 3dyf h GLN 127 N 0.23 1.00 -0.04 1.57 -0.00 -1.98 -1.70 115.11 114.19 3dyf h GLN 127 Ca 0.07 -0.06 -0.19 0.00 -0.00 0.00 0.00 58.65 58.47 3dyf h GLN 127 Cb 0.41 -0.23 -0.00 0.00 -0.00 0.00 0.00 27.48 27.66 3dyf h GLN 127 CO 0.01 0.66 -0.81 0.00 -0.00 0.00 0.00 178.83 178.70 3dyf h ALA 129 N 0.91 1.15 -0.68 0.00 0.00 -0.52 0.38 119.26 120.51 3dyf h ALA 129 Ca -0.04 -0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.69 3dyf h ALA 129 Cb 1.40 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.91 3dyf h ALA 129 CO 0.13 0.57 0.41 0.82 0.00 0.00 0.00 179.25 181.19 3dyf h ILE 130 N 0.86 1.05 0.09 0.00 2.04 -1.32 0.11 117.51 120.33 3dyf h ILE 130 Ca 0.19 -0.27 -0.27 0.00 1.00 0.00 0.00 64.86 65.51 3dyf h ILE 130 Cb 0.32 0.19 0.01 0.00 -0.74 0.00 0.00 36.82 36.60 3dyf h ILE 130 CO -0.00 0.14 -1.16 -1.13 0.00 0.00 0.00 178.15 176.00 3dyf h ASN 131 N 0.78 0.64 -0.67 1.72 -1.24 -1.45 -2.65 115.58 112.72 3dyf h ASN 131 Ca 0.29 -0.59 0.09 0.00 0.71 0.00 0.00 56.30 56.79 3dyf h ASN 131 Cb 0.08 -0.20 -0.04 0.00 0.73 0.00 0.00 38.32 38.89 3dyf h ASN 131 CO -0.13 1.42 0.44 0.44 -1.29 0.00 0.00 177.43 178.31 3dyf h ASP 132 N 0.20 0.49 -0.42 1.15 3.32 0.18 0.25 116.42 121.59 3dyf h ASP 132 Ca -0.14 0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.86 3dyf h ASP 132 Cb 1.84 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 41.28 3dyf h ASP 132 CO 0.21 0.30 0.02 1.23 -1.72 0.00 0.00 179.24 179.28 3dyf h GLY 133 N 0.55 0.79 0.90 2.75 0.00 -0.84 -2.50 103.07 104.72 3dyf h GLY 133 Ca 0.30 -0.56 0.03 0.00 0.00 0.00 0.00 47.33 47.10 3dyf h GLY 133 CO -0.10 0.52 0.56 1.41 0.00 0.00 0.00 176.54 178.93 3dyf h LEU 134 N 0.57 0.93 -1.13 3.11 3.38 -0.28 -1.90 115.31 120.00 3dyf h LEU 134 Ca 0.12 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3dyf h LEU 134 Cb 0.45 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 3dyf h LEU 134 CO 0.02 0.65 0.55 -0.07 0.09 0.00 0.00 178.44 179.67 3dyf h LEU 135 N 1.09 1.00 -0.44 1.67 3.38 -0.57 -2.45 115.31 119.00 3dyf h LEU 135 Ca 0.34 -0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.31 3dyf h LEU 135 Cb -0.02 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 3dyf h LEU 135 CO -0.11 0.74 0.20 -0.07 0.09 0.00 0.00 178.44 179.29 3dyf h LEU 136 N 1.17 0.28 -1.25 1.67 3.38 -0.91 -1.12 115.31 118.53 3dyf h LEU 136 Ca 0.31 0.03 -0.06 0.00 0.09 0.00 0.00 57.88 58.25 3dyf h LEU 136 Cb -0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 3dyf h LEU 136 CO -0.06 0.20 -0.10 0.50 0.09 0.00 0.00 178.44 179.07 3dyf h LYS 137 N 0.41 0.40 -0.10 1.13 3.64 -1.25 -2.39 116.57 118.40 3dyf h LYS 137 Ca 0.19 -0.10 -0.17 0.00 -1.27 0.00 0.00 60.65 59.30 3dyf h LYS 137 Cb 0.12 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.88 3dyf h LYS 137 CO -0.15 0.50 -0.66 0.77 -2.27 0.00 0.00 179.45 177.64 3dyf h SER 138 N 0.37 0.47 0.04 4.20 0.02 -1.02 -3.02 113.55 114.62 3dyf h SER 138 Ca 0.08 -0.29 -0.01 0.00 -0.84 0.00 0.00 61.79 60.73 3dyf h SER 138 Cb 0.40 -0.14 -0.00 0.00 0.14 0.00 0.00 62.40 62.80 3dyf h SER 138 CO 0.02 1.00 -0.04 -0.50 -1.14 0.00 0.00 176.83 176.18 3dyf h TRP 139 N 0.29 0.00 -0.64 3.45 6.55 -0.70 0.37 115.95 125.27 3dyf h TRP 139 Ca -0.02 0.00 -0.03 0.00 0.95 0.00 0.00 58.89 59.80 3dyf h TRP 139 Cb 1.22 0.00 -0.03 0.00 -0.86 0.00 0.00 29.16 29.49 3dyf h TRP 139 CO 0.04 0.04 0.29 1.79 -1.05 0.00 0.00 178.44 179.55 3dyf h THR 140 N 0.00 1.21 0.01 1.49 1.35 -1.38 -1.27 112.91 114.33 3dyf h THR 140 Ca -0.00 -0.63 -0.00 0.00 -0.55 0.00 0.00 66.41 65.23 3dyf h THR 140 Cb 0.07 0.41 0.00 0.00 -1.73 0.00 0.00 68.15 66.90 3dyf h THR 140 CO 0.00 0.26 -0.01 0.45 -0.25 0.00 0.00 175.52 175.98 3dyf h HIS 141 N 0.91 -0.01 -1.01 4.73 3.86 -1.28 -2.91 115.15 119.43 3dyf h HIS 141 Ca 0.22 -0.00 0.26 0.00 -1.16 0.00 0.00 60.37 59.69 3dyf h HIS 141 Cb 0.12 0.00 -0.07 0.00 1.06 0.00 0.00 27.41 28.53 3dyf h HIS 141 CO 0.01 0.79 0.68 0.52 0.86 0.00 0.00 177.93 180.79 3dyf h MET 142 N -0.92 0.26 0.13 2.45 2.07 -0.88 0.67 114.93 118.71 3dyf h MET 142 Ca -0.00 -0.02 -0.29 0.00 -2.07 0.00 0.00 59.70 57.33 3dyf h MET 142 Cb 0.81 -0.06 0.00 0.00 -1.87 0.00 0.00 31.60 30.48 3dyf h MET 142 CO 0.00 0.17 -1.34 0.00 1.07 0.00 0.00 176.91 176.81 3dyf h MET 143 N 0.27 0.28 -0.35 1.72 -0.00 -1.31 -2.90 114.93 112.63 3dyf h MET 143 Ca 0.53 -0.47 -0.08 0.00 -0.00 0.00 0.00 59.70 59.68 3dyf h MET 143 Cb 1.59 0.18 -0.01 0.00 -0.00 0.00 0.00 31.60 33.36 3dyf h MET 143 CO -0.17 1.19 -0.10 0.00 -0.00 0.00 0.00 176.91 177.83 3dyf h ALA 144 N 0.54 0.48 -0.14 -3.00 0.00 -0.84 -2.03 119.26 114.27 3dyf h ALA 144 Ca -0.17 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 3dyf h ALA 144 Cb 2.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.66 3dyf h ALA 144 CO 0.19 0.35 0.05 1.98 0.00 0.00 0.00 179.25 181.82 3dyf h MET 145 N 0.47 0.22 -0.61 0.00 -1.53 -1.06 0.27 114.93 112.69 3dyf h MET 145 Ca 0.09 -0.05 -0.07 0.00 -3.44 0.00 0.00 59.70 56.23 3dyf h MET 145 Cb 0.61 -0.03 -0.03 0.00 -0.55 0.00 0.00 31.60 31.61 3dyf h MET 145 CO 0.04 0.34 0.10 1.25 0.14 0.00 0.00 176.91 178.78 3dyf h HIS 146 N 0.06 1.05 0.00 1.39 6.17 -1.54 -1.32 115.15 120.96 3dyf h HIS 146 Ca 0.05 -0.13 -0.13 0.00 0.71 0.00 0.00 60.37 60.87 3dyf h HIS 146 Cb 0.21 -0.29 -0.02 0.00 2.52 0.00 0.00 27.41 29.83 3dyf h HIS 146 CO -0.00 0.89 -1.39 1.19 0.71 0.00 0.00 177.93 179.32 3dyf n PHE 147 N -4.22 0.88 -0.56 5.26 3.72 -0.77 -4.27 117.46 117.51 3dyf n PHE 147 Ca 0.04 0.28 0.06 0.00 -0.05 0.00 0.00 57.45 57.79 3dyf n PHE 147 Cb 0.28 -1.02 0.16 0.00 -0.94 0.00 0.00 39.48 37.96 3dyf n PHE 147 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 3dyf n PHE 148 N -2.79 0.46 -0.31 1.38 3.72 0.94 -4.73 117.46 116.12 3dyf n PHE 148 Ca -0.08 -0.71 0.16 0.00 -0.05 0.00 0.00 57.45 56.78 3dyf n PHE 148 Cb 0.77 -0.15 0.34 0.00 -0.94 0.00 0.00 39.48 39.50 3dyf n PHE 148 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3dyf h ALA 149 N 1.24 1.43 0.00 4.37 0.00 -1.38 -0.31 119.26 124.61 3dyf h ALA 149 Ca 0.00 0.24 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 3dyf h ALA 149 Cb 0.97 0.33 -0.02 0.00 0.00 0.00 0.00 17.79 19.07 3dyf h ALA 149 CO 0.07 -0.54 -1.11 -0.44 0.00 0.00 0.00 179.25 177.24 3dyf h ASP 150 N 0.18 0.00 -2.51 0.00 3.32 -1.86 -3.47 116.42 112.08 3dyf h ASP 150 Ca 0.61 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 57.13 3dyf h ASP 150 Cb 1.30 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.88 3dyf h ASP 150 CO -0.70 0.51 1.13 -0.13 -1.72 0.00 0.00 179.24 178.34 3dyf s ARG 151 N -2.97 4.15 0.56 3.56 1.81 -0.13 -4.87 118.95 121.08 3dyf s ARG 151 Ca -0.01 2.50 0.29 0.00 -1.72 0.00 0.00 55.73 56.80 3dyf s ARG 151 Cb 0.08 -3.85 1.68 0.00 -0.45 0.00 0.00 34.95 32.42 3dyf s ARG 151 CO 0.79 -0.86 2.19 -1.00 -0.68 0.00 0.00 175.30 175.73 3dyf h PRO 152 N 9.38 0.00 0.00 3.54 0.13 -1.90 -1.49 132.00 141.66 3dyf h PRO 152 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 3dyf h PRO 152 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 3dyf h PRO 152 CO 0.94 0.05 0.00 1.97 -0.23 0.00 0.00 178.00 180.73 3dyf n PHE 153 N -3.77 0.00 0.04 1.56 1.16 -1.26 -4.23 117.46 110.96 3dyf n PHE 153 Ca -0.03 0.00 -0.11 0.00 -1.87 0.00 0.00 57.45 55.45 3dyf n PHE 153 Cb 0.14 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 37.97 3dyf n PHE 153 CO 0.00 0.00 0.00 1.25 -1.87 0.00 0.00 176.76 176.14 3dyf h LEU 154 N 0.00 -0.56 0.87 5.98 5.85 -1.54 -1.11 115.31 124.80 3dyf h LEU 154 Ca 0.00 0.09 -0.04 0.00 0.84 0.00 0.00 57.88 58.77 3dyf h LEU 154 Cb 0.00 0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3dyf h LEU 154 CO 0.00 -0.25 -0.49 -0.61 -0.34 0.00 0.00 178.44 176.75 3dyf h GLN 155 N -0.29 -1.21 -0.95 1.25 4.15 -1.83 -1.52 115.11 114.72 3dyf h GLN 155 Ca 0.07 0.08 0.19 0.00 0.77 0.00 0.00 58.65 59.77 3dyf h GLN 155 Cb 0.38 0.28 -0.11 0.00 0.21 0.00 0.00 27.48 28.23 3dyf h GLN 155 CO -0.20 -0.81 0.52 0.22 -1.93 0.00 0.00 178.83 176.63 3dyf h ASP 156 N -1.26 0.62 -0.07 -0.69 3.58 -1.84 0.11 116.42 116.86 3dyf h ASP 156 Ca -0.12 0.11 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 3dyf h ASP 156 Cb 0.99 0.02 -0.00 0.00 1.72 0.00 0.00 39.33 42.06 3dyf h ASP 156 CO 0.14 0.18 0.04 0.25 -2.88 0.00 0.00 179.24 176.98 3dyf h LEU 157 N 0.63 0.09 -0.54 2.28 7.12 -0.99 -1.73 115.31 122.17 3dyf h LEU 157 Ca 0.56 -0.04 -0.11 0.00 0.13 0.00 0.00 57.88 58.41 3dyf h LEU 157 Cb 0.93 -0.02 -0.02 0.00 -0.53 0.00 0.00 40.66 41.02 3dyf h LEU 157 CO -0.42 0.11 -0.09 -0.07 -0.13 0.00 0.00 178.44 177.83 3dyf h LEU 158 N 0.06 1.01 -0.07 2.25 3.38 -0.18 -1.60 115.31 120.16 3dyf h LEU 158 Ca 0.03 -0.35 0.03 0.00 0.09 0.00 0.00 57.88 57.68 3dyf h LEU 158 Cb 0.03 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 3dyf h LEU 158 CO -0.00 1.12 -0.17 0.00 0.09 0.00 0.00 178.44 179.47 3dyf h ARG 160 N -0.25 0.88 -0.16 0.00 3.08 -1.23 -2.02 114.38 114.69 3dyf h ARG 160 Ca 0.08 -0.09 0.04 0.00 0.07 0.00 0.00 59.98 60.08 3dyf h ARG 160 Cb 0.36 -0.18 -0.04 0.00 0.08 0.00 0.00 29.97 30.18 3dyf h ARG 160 CO -0.21 0.65 -0.11 0.35 -1.07 0.00 0.00 179.97 179.57 3dyf h PHE 161 N 0.87 -0.28 -0.24 3.04 3.57 -0.66 -0.86 116.94 122.39 3dyf h PHE 161 Ca 0.23 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.69 3dyf h PHE 161 Cb 0.01 0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 3dyf h PHE 161 CO -0.01 -0.17 -0.09 -0.91 -2.23 0.00 0.00 178.31 174.90 3dyf h ASN 162 N -0.12 0.36 0.48 0.41 4.21 -0.87 -0.14 115.58 119.91 3dyf h ASN 162 Ca 0.10 -0.08 -0.02 0.00 1.21 0.00 0.00 56.30 57.51 3dyf h ASN 162 Cb 0.26 -0.09 0.00 0.00 -1.12 0.00 0.00 38.32 37.37 3dyf h ASN 162 CO -0.23 0.49 -0.23 0.03 -1.29 0.00 0.00 177.43 176.20 3dyf h ARG 163 N 0.36 -0.62 -0.73 0.81 2.47 -0.59 0.19 114.38 116.28 3dyf h ARG 163 Ca 0.07 0.04 0.02 0.00 -1.26 0.00 0.00 59.98 58.86 3dyf h ARG 163 Cb 0.39 0.14 -0.04 0.00 -1.65 0.00 0.00 29.97 28.81 3dyf h ARG 163 CO 0.02 -0.37 0.47 0.28 0.56 0.00 0.00 179.97 180.92 3dyf h VAL 164 N -0.71 1.13 -0.06 2.04 2.07 -0.92 0.14 116.25 119.93 3dyf h VAL 164 Ca -0.07 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.15 3dyf h VAL 164 Cb 0.53 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 3dyf h VAL 164 CO 0.11 0.17 -0.03 -0.78 0.02 0.00 0.00 177.57 177.06 3dyf h ASP 165 N 0.93 -0.10 -0.88 0.57 3.58 -0.86 -1.39 116.42 118.26 3dyf h ASP 165 Ca 0.28 0.03 0.04 0.00 0.42 0.00 0.00 57.03 57.80 3dyf h ASP 165 Cb -0.03 0.06 -0.05 0.00 1.72 0.00 0.00 39.33 41.03 3dyf h ASP 165 CO -0.09 -0.04 0.58 0.22 -2.88 0.00 0.00 179.24 177.03 3dyf h TYR 166 N -0.02 1.06 -0.28 0.28 3.20 0.04 -2.09 116.97 119.15 3dyf h TYR 166 Ca 0.04 0.03 -0.12 0.00 3.14 0.00 0.00 58.73 61.82 3dyf h TYR 166 Cb 0.08 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 37.98 3dyf h TYR 166 CO -0.13 0.60 -0.31 1.79 -1.64 0.00 0.00 178.16 178.47 3dyf h THR 167 N 1.08 1.28 -0.54 1.81 1.35 -0.42 -2.52 112.91 114.96 3dyf h THR 167 Ca 0.36 -1.41 -0.05 0.00 -0.55 0.00 0.00 66.41 64.76 3dyf h THR 167 Cb 0.06 1.40 -0.02 0.00 -1.73 0.00 0.00 68.15 67.86 3dyf h THR 167 CO -0.11 0.45 0.16 0.74 -0.25 0.00 0.00 175.52 176.51 3dyf h THR 168 N 0.50 1.24 0.00 6.82 2.02 -0.68 -0.09 112.91 122.72 3dyf h THR 168 Ca 0.06 -0.82 -0.01 0.00 0.77 0.00 0.00 66.41 66.41 3dyf h THR 168 Cb 0.78 0.75 -0.00 0.00 -1.74 0.00 0.00 68.15 67.94 3dyf h THR 168 CO 0.06 0.30 -0.04 0.00 0.37 0.00 0.00 175.52 176.22 3dyf h ALA 169 N 1.02 1.09 0.15 6.16 0.00 -1.20 -0.40 119.26 126.07 3dyf h ALA 169 Ca 0.17 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.74 3dyf h ALA 169 Cb 0.30 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.09 3dyf h ALA 169 CO -0.00 0.05 -1.47 0.28 0.00 0.00 0.00 179.25 178.10 3dyf h VAL 170 N 0.00 1.24 -0.48 0.00 2.07 -0.84 -2.97 116.25 115.27 3dyf h VAL 170 Ca -0.00 -2.82 -0.11 0.00 0.82 0.00 0.00 66.70 64.59 3dyf h VAL 170 Cb 0.27 2.86 -0.02 0.00 -1.52 0.00 0.00 31.29 32.88 3dyf h VAL 170 CO 0.00 0.84 -0.14 1.23 0.02 0.00 0.00 177.57 179.53 3dyf h GLY 171 N 1.31 0.99 1.05 2.17 0.00 -0.21 -2.28 103.07 106.09 3dyf h GLY 171 Ca -0.23 -0.80 0.03 0.00 0.00 0.00 0.00 47.33 46.33 3dyf h GLY 171 CO 0.19 0.73 0.57 1.46 0.00 0.00 0.00 176.54 179.50 3dyf h GLN 172 N 0.81 1.06 -0.70 4.80 1.08 -1.16 0.19 115.11 121.20 3dyf h GLN 172 Ca 0.13 -0.06 -0.02 0.00 -1.45 0.00 0.00 58.65 57.24 3dyf h GLN 172 Cb 0.67 -0.24 -0.03 0.00 -0.05 0.00 0.00 27.48 27.83 3dyf h GLN 172 CO 0.05 0.70 0.35 1.25 -0.95 0.00 0.00 178.83 180.23 3dyf h LEU 173 N 1.09 0.90 -0.61 1.46 5.85 -1.27 0.43 115.31 123.16 3dyf h LEU 173 Ca 0.34 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.90 3dyf h LEU 173 Cb 0.00 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.77 3dyf h LEU 173 CO -0.10 0.77 0.22 1.88 -0.34 0.00 0.00 178.44 180.87 3dyf h TYR 174 N 0.97 0.96 0.85 1.25 0.05 -0.48 -2.92 116.97 117.65 3dyf h TYR 174 Ca 0.24 -0.08 -0.04 0.00 0.05 0.00 0.00 58.73 58.90 3dyf h TYR 174 Cb 0.09 -0.28 0.01 0.00 1.01 0.00 0.00 36.73 37.56 3dyf h TYR 174 CO 0.00 0.77 -0.41 0.22 -1.05 0.00 0.00 178.16 177.70 3dyf h ASP 175 N 0.86 -0.97 0.00 3.88 3.58 -0.16 -2.05 116.42 121.56 3dyf h ASP 175 Ca 0.20 0.03 0.00 0.00 0.42 0.00 0.00 57.03 57.68 3dyf h ASP 175 Cb 0.24 0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.54 3dyf h ASP 175 CO -0.01 -0.64 0.00 0.55 -2.88 0.00 0.00 179.24 176.25 3dyf n VAL 176 N -5.55 0.00 -0.82 2.25 3.14 0.09 -2.39 118.33 115.06 3dyf n VAL 176 Ca -0.15 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.23 3dyf n VAL 176 Cb 0.46 -0.28 0.00 0.00 -1.06 0.00 0.00 33.84 32.95 3dyf n VAL 176 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 3dyf n THR 177 N -0.54 0.07 0.28 1.55 -2.24 -1.11 -4.80 114.28 107.49 3dyf n THR 177 Ca 0.01 -0.13 0.16 0.00 -2.27 0.00 0.00 64.05 61.82 3dyf n THR 177 Cb 0.00 1.46 0.76 0.00 -2.10 0.00 0.00 70.33 70.46 3dyf n THR 177 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3dyf h SER 178 N 0.00 0.00 -0.43 3.42 4.64 -1.00 -2.45 113.55 117.74 3dyf h SER 178 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dyf h SER 178 Cb 0.60 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 3dyf h SER 178 CO 0.00 0.07 0.00 1.15 -0.87 0.00 0.00 176.83 177.18 3dyf n MET 179 N -3.30 2.46 -4.09 4.77 0.00 -1.26 -4.79 117.12 110.91 3dyf n MET 179 Ca -0.01 -1.73 -0.29 0.00 0.00 0.00 0.00 57.70 55.68 3dyf n MET 179 Cb 0.26 -1.54 -0.17 0.00 0.00 0.00 0.00 33.22 31.78 3dyf n MET 179 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 3dyf s PHE 180 N -1.60 1.90 -0.45 3.17 0.08 -0.92 -0.19 117.98 119.97 3dyf s PHE 180 Ca 0.31 -0.99 -0.31 0.00 0.12 0.00 0.00 56.93 56.06 3dyf s PHE 180 Cb 0.19 -1.43 -0.10 0.00 -0.57 0.00 0.00 43.02 41.10 3dyf s PHE 180 CO 0.17 -0.57 2.33 -3.47 -0.10 0.00 0.00 175.22 173.58 3dyf n ASP 181 N 4.68 2.16 0.23 1.36 -0.08 -1.26 -4.79 116.55 118.86 3dyf n ASP 181 Ca -0.16 0.06 0.18 0.00 -1.51 0.00 0.00 54.79 53.36 3dyf n ASP 181 Cb 0.50 -1.37 0.87 0.00 2.34 0.00 0.00 41.12 43.46 3dyf n ASP 181 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3dyf h SER 182 N 15.05 0.00 -0.86 1.67 4.64 -1.95 -1.22 113.55 130.88 3dyf h SER 182 Ca -0.26 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.05 3dyf h SER 182 Cb 1.29 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.34 3dyf h SER 182 CO 1.10 0.00 0.50 0.78 -0.87 0.00 0.00 176.83 178.34 3dyf h ASN 183 N 0.00 1.04 0.78 4.97 -0.26 -2.02 -2.41 115.58 117.68 3dyf h ASN 183 Ca 0.07 -0.07 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 3dyf h ASN 183 Cb 0.45 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.45 3dyf h ASN 183 CO -0.00 0.81 -0.73 0.11 -1.06 0.00 0.00 177.43 176.57 3dyf h LYS 184 N 1.19 0.00 -5.14 0.81 1.57 -1.62 -3.46 116.57 109.92 3dyf h LYS 184 Ca 0.31 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.76 3dyf h LYS 184 Cb -0.03 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.21 3dyf h LYS 184 CO -0.06 0.00 1.48 -0.11 -0.57 0.00 0.00 179.45 180.20 3dyf n LEU 185 N -2.10 0.08 -3.64 2.94 0.00 -0.91 -4.85 117.00 108.53 3dyf n LEU 185 Ca 0.03 -0.59 -0.28 0.00 0.00 0.00 0.00 56.01 55.16 3dyf n LEU 185 Cb 0.44 -0.99 -0.16 0.00 0.00 0.00 0.00 43.42 42.72 3dyf n LEU 185 CO 0.37 -1.56 -0.34 -0.62 0.00 0.00 0.00 177.39 175.24 3dyf s ASP 186 N 5.83 3.27 0.56 1.96 2.15 -1.26 -5.02 116.67 124.16 3dyf s ASP 186 Ca 1.20 -1.12 0.49 0.00 0.43 0.00 0.00 52.55 53.55 3dyf s ASP 186 Cb -0.71 -0.49 1.69 0.00 -0.30 0.00 0.00 42.92 43.12 3dyf s ASP 186 CO 0.41 -0.39 1.57 1.55 -0.17 0.00 0.00 175.17 178.14 3dyf h PRO 187 N 8.31 0.00 0.00 4.34 0.13 -2.02 0.79 132.00 143.55 3dyf h PRO 187 Ca -0.17 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.95 3dyf h PRO 187 Cb 1.06 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.19 3dyf h PRO 187 CO 0.39 0.00 -0.34 -0.44 -0.23 0.00 0.00 178.00 177.38 3dyf h ASP 188 N 0.00 0.00 -3.58 1.44 5.19 -1.97 -3.45 116.42 114.05 3dyf h ASP 188 Ca 0.89 0.00 -0.68 0.00 -0.62 0.00 0.00 57.03 56.63 3dyf h ASP 188 Cb 3.65 0.00 -0.31 0.00 0.18 0.00 0.00 39.33 42.86 3dyf h ASP 188 CO -0.01 0.03 -0.85 -0.69 -3.12 0.00 0.00 179.24 174.60 3dyf s VAL 189 N -3.24 2.33 0.43 -1.35 1.01 0.28 -5.12 120.40 114.73 3dyf s VAL 189 Ca 0.04 -0.94 -0.23 0.00 0.00 0.00 0.00 61.98 60.85 3dyf s VAL 189 Cb 0.06 -1.90 -0.08 0.00 0.00 0.00 0.00 36.38 34.46 3dyf s VAL 189 CO 0.71 0.56 1.10 -0.55 0.00 0.00 0.00 175.10 176.92 3dyf s SER 190 N 0.12 6.51 -0.05 3.32 0.15 -1.26 -4.39 113.70 118.10 3dyf s SER 190 Ca -0.11 2.15 -0.09 0.00 0.70 0.00 0.00 55.95 58.60 3dyf s SER 190 Cb -0.16 -2.59 0.02 0.00 -1.71 0.00 0.00 66.02 61.58 3dyf s SER 190 CO 0.06 -0.67 0.22 -1.10 1.20 0.00 0.00 173.24 172.95 3dyf s GLN 191 N -2.59 0.40 0.56 5.44 -1.52 -1.26 -5.06 119.66 115.62 3dyf s GLN 191 Ca 0.60 0.04 -0.06 0.00 -1.95 0.00 0.00 55.36 53.99 3dyf s GLN 191 Cb -0.25 0.18 -0.01 0.00 -0.22 0.00 0.00 33.01 32.71 3dyf s GLN 191 CO 0.30 -0.08 0.87 -1.25 -0.25 0.00 0.00 175.29 174.88 3dyf s PRO 192 N -0.53 3.18 0.47 2.91 0.04 -1.26 -5.02 135.00 134.78 3dyf s PRO 192 Ca -0.06 0.12 -0.22 0.00 0.04 0.00 0.00 61.00 60.87 3dyf s PRO 192 Cb -0.04 -2.29 -0.10 0.00 0.04 0.00 0.00 34.50 32.11 3dyf s PRO 192 CO 0.01 -0.52 0.87 2.41 0.04 0.00 0.00 177.00 179.81 3dyf n THR 193 N -2.49 2.51 -1.58 1.26 -1.04 -1.26 -4.73 114.28 106.96 3dyf n THR 193 Ca 0.03 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.13 3dyf n THR 193 Cb 0.56 -0.99 0.01 0.00 -1.82 0.00 0.00 70.33 68.10 3dyf n THR 193 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 3dyf n THR 194 N -0.90 2.40 -0.08 12.58 5.66 0.74 -4.92 114.28 129.78 3dyf n THR 194 Ca 0.11 -0.50 -0.08 0.00 -3.05 0.00 0.00 64.05 60.53 3dyf n THR 194 Cb 0.41 -1.02 -0.12 0.00 -1.55 0.00 0.00 70.33 68.05 3dyf n THR 194 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 175.07 172.37 3dyf n THR 195 N -0.67 1.06 0.24 1.09 -2.24 -1.26 -4.53 114.28 107.97 3dyf n THR 195 Ca 0.10 -0.65 0.11 0.00 -2.27 0.00 0.00 64.05 61.34 3dyf n THR 195 Cb 0.40 -0.60 -0.03 0.00 -2.10 0.00 0.00 70.33 68.00 3dyf n THR 195 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3dyf n ASP 196 N -2.58 0.56 -1.04 3.42 5.68 -1.26 -4.94 116.55 116.39 3dyf n ASP 196 Ca -0.25 0.07 -0.13 0.00 -0.50 0.00 0.00 54.79 53.98 3dyf n ASP 196 Cb 1.00 0.93 -0.06 0.00 -1.14 0.00 0.00 41.12 41.86 3dyf n ASP 196 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 3dyf n PHE 197 N -2.33 -0.04 0.00 2.11 3.72 -1.26 -4.78 117.46 114.87 3dyf n PHE 197 Ca -0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 3dyf n PHE 197 Cb 0.52 -2.86 0.00 0.00 -0.94 0.00 0.00 39.48 36.20 3dyf n PHE 197 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3dyf n ALA 198 N 1.14 0.61 0.68 4.37 0.00 -1.26 -0.29 120.51 125.75 3dyf n ALA 198 Ca -0.13 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.38 3dyf n ALA 198 Cb 0.59 -0.56 -0.07 0.00 0.00 0.00 0.00 19.45 19.42 3dyf n ALA 198 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3dyf n GLU 199 N -1.19 2.17 -1.01 0.00 1.02 -1.26 -4.74 120.64 115.63 3dyf n GLU 199 Ca 0.00 -0.15 -0.34 0.00 -0.02 0.00 0.00 57.16 56.66 3dyf n GLU 199 Cb 0.18 -1.19 -0.03 0.00 -0.02 0.00 0.00 31.44 30.38 3dyf n GLU 199 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3dyf n PHE 200 N -1.11 1.78 -4.11 -0.32 3.01 0.60 -4.67 117.46 112.64 3dyf n PHE 200 Ca 0.03 -2.00 -0.25 0.00 1.01 0.00 0.00 57.45 56.25 3dyf n PHE 200 Cb 0.24 -1.77 -0.05 0.00 -0.01 0.00 0.00 39.48 37.88 3dyf n PHE 200 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3dyf s THR 201 N 4.08 4.40 0.36 4.37 -4.23 -1.26 -4.48 115.64 118.88 3dyf s THR 201 Ca 0.49 -1.23 0.23 0.00 -1.18 0.00 0.00 61.69 60.00 3dyf s THR 201 Cb 0.13 -3.29 0.23 0.00 1.34 0.00 0.00 72.50 70.91 3dyf s THR 201 CO 0.03 -0.20 1.97 0.25 -0.54 0.00 0.00 174.62 176.14 3dyf h LEU 202 N 2.10 0.00 0.26 4.79 5.85 -1.89 0.79 115.31 127.20 3dyf h LEU 202 Ca -0.48 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.23 3dyf h LEU 202 Cb 1.21 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 3dyf h LEU 202 CO 0.62 0.20 -0.12 -1.28 -0.34 0.00 0.00 178.44 177.51 3dyf h SER 203 N 0.00 -0.29 -0.06 1.25 0.87 -1.94 0.49 113.55 113.87 3dyf h SER 203 Ca -0.00 -0.14 -0.07 0.00 -1.23 0.00 0.00 61.79 60.34 3dyf h SER 203 Cb 0.47 0.08 -0.01 0.00 -0.44 0.00 0.00 62.40 62.49 3dyf h SER 203 CO 0.03 -0.02 -0.16 0.78 -0.53 0.00 0.00 176.83 176.93 3dyf h ASN 204 N -0.57 0.41 -0.31 6.23 -0.26 -1.64 -2.45 115.58 116.98 3dyf h ASN 204 Ca -0.04 -0.11 -0.07 0.00 -0.56 0.00 0.00 56.30 55.53 3dyf h ASN 204 Cb 0.42 -0.11 -0.01 0.00 -1.06 0.00 0.00 38.32 37.56 3dyf h ASN 204 CO 0.06 0.59 -0.08 0.22 -1.06 0.00 0.00 177.43 177.16 3dyf h TYR 205 N 0.38 0.67 -0.53 1.19 3.20 0.81 -2.72 116.97 119.97 3dyf h TYR 205 Ca 0.07 -0.15 0.02 0.00 3.14 0.00 0.00 58.73 61.81 3dyf h TYR 205 Cb 0.51 -0.16 -0.03 0.00 1.54 0.00 0.00 36.73 38.59 3dyf h TYR 205 CO 0.01 0.79 0.35 0.87 -1.64 0.00 0.00 178.16 178.54 3dyf h LYS 206 N 0.36 0.64 -0.19 1.82 1.57 0.30 -2.57 116.57 118.49 3dyf h LYS 206 Ca 0.08 -0.04 -0.05 0.00 -1.87 0.00 0.00 60.65 58.77 3dyf h LYS 206 Cb 0.57 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 3dyf h LYS 206 CO 0.03 0.42 -0.08 -0.09 -0.57 0.00 0.00 179.45 179.16 3dyf h ARG 207 N 0.66 0.39 0.48 3.15 2.43 -1.25 -1.85 114.38 118.39 3dyf h ARG 207 Ca 0.20 -0.17 -0.01 0.00 -0.81 0.00 0.00 59.98 59.20 3dyf h ARG 207 Cb 0.01 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 3dyf h ARG 207 CO -0.05 0.68 -0.41 0.82 -1.51 0.00 0.00 179.97 179.51 3dyf h ILE 208 N 0.09 0.18 -0.35 1.20 2.04 -1.19 -2.82 117.51 116.66 3dyf h ILE 208 Ca 0.04 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.96 3dyf h ILE 208 Cb 0.56 0.18 -0.05 0.00 -0.74 0.00 0.00 36.82 36.77 3dyf h ILE 208 CO 0.03 0.00 0.06 0.58 0.00 0.00 0.00 178.15 178.82 3dyf h VAL 209 N -0.88 0.82 -0.10 1.67 2.07 -1.53 0.11 116.25 118.41 3dyf h VAL 209 Ca -0.05 -0.06 0.04 0.00 0.82 0.00 0.00 66.70 67.45 3dyf h VAL 209 Cb 0.76 0.62 -0.06 0.00 -1.52 0.00 0.00 31.29 31.09 3dyf h VAL 209 CO -0.02 0.03 -0.29 0.50 0.02 0.00 0.00 177.57 177.81 3dyf h LYS 210 N 0.18 -0.37 0.03 1.57 3.64 -1.28 -0.42 116.57 119.93 3dyf h LYS 210 Ca 0.17 0.02 -0.21 0.00 -1.27 0.00 0.00 60.65 59.36 3dyf h LYS 210 Cb 0.19 0.08 0.02 0.00 -0.41 0.00 0.00 32.23 32.11 3dyf h LYS 210 CO -0.22 -0.24 -0.85 1.88 -2.27 0.00 0.00 179.45 177.74 3dyf h TYR 211 N -0.38 0.79 0.00 1.91 0.05 -1.37 -2.69 116.97 115.28 3dyf h TYR 211 Ca 0.09 -0.46 0.00 0.00 0.05 0.00 0.00 58.73 58.41 3dyf h TYR 211 Cb 0.51 -0.08 0.00 0.00 1.01 0.00 0.00 36.73 38.17 3dyf h TYR 211 CO -0.36 1.29 0.00 1.57 -1.05 0.00 0.00 178.16 179.61 3dyf h LYS 212 N 0.07 0.00 0.00 4.88 2.10 -0.77 -3.23 116.57 119.62 3dyf h LYS 212 Ca -0.12 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.53 3dyf h LYS 212 Cb 1.55 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.88 3dyf h LYS 212 CO 0.17 0.00 -0.50 2.41 -2.00 0.00 0.00 179.45 179.53 3dyf n THR 213 N -2.86 0.00 -0.19 0.07 -1.04 -0.19 -4.87 114.28 105.20 3dyf n THR 213 Ca 0.03 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.01 3dyf n THR 213 Cb 0.43 -0.97 0.04 0.00 -1.82 0.00 0.00 70.33 68.01 3dyf n THR 213 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dyf h ALA 214 N 0.00 0.20 0.40 2.41 0.00 -1.20 -1.16 119.26 119.90 3dyf h ALA 214 Ca 0.00 0.20 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 3dyf h ALA 214 Cb 0.50 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 3dyf h ALA 214 CO 0.00 -0.54 -0.26 1.88 0.00 0.00 0.00 179.25 180.33 3dyf h TYR 215 N -0.09 -0.69 0.00 0.00 0.05 -1.81 0.26 116.97 114.68 3dyf h TYR 215 Ca 0.26 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.93 3dyf h TYR 215 Cb 0.50 0.25 -0.02 0.00 1.01 0.00 0.00 36.73 38.47 3dyf h TYR 215 CO -0.55 -0.38 -0.51 0.10 -1.05 0.00 0.00 178.16 175.78 3dyf h TYR 216 N -0.62 0.00 0.02 4.88 -0.00 -1.84 0.19 116.97 119.60 3dyf h TYR 216 Ca -0.05 0.00 -0.25 0.00 -0.00 0.00 0.00 58.73 58.43 3dyf h TYR 216 Cb 0.50 0.00 -0.03 0.00 -0.00 0.00 0.00 36.73 37.20 3dyf h TYR 216 CO -0.02 0.51 -1.28 1.15 -0.00 0.00 0.00 178.16 178.52 3dyf h THR 217 N 0.00 1.39 0.00 -0.90 2.02 -1.26 -3.40 112.91 110.77 3dyf h THR 217 Ca -0.01 -3.13 0.00 0.00 0.77 0.00 0.00 66.41 64.05 3dyf h THR 217 Cb 0.99 2.73 0.00 0.00 -1.74 0.00 0.00 68.15 70.13 3dyf h THR 217 CO 0.07 0.82 -0.77 -1.22 0.37 0.00 0.00 175.52 174.79 3dyf n TYR 218 N -3.29 -0.02 -0.14 3.16 4.02 0.86 -4.73 117.16 117.01 3dyf n TYR 218 Ca -0.07 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.73 3dyf n TYR 218 Cb 0.99 0.02 0.04 0.00 -0.02 0.00 0.00 39.34 40.37 3dyf n TYR 218 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 3dyf h LEU 219 N 0.00 0.95 0.00 7.72 5.85 -0.80 -3.23 115.31 125.81 3dyf h LEU 219 Ca 0.00 -0.34 -0.00 0.00 0.84 0.00 0.00 57.88 58.38 3dyf h LEU 219 Cb 0.77 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.54 3dyf h LEU 219 CO 0.00 1.11 -0.00 0.25 -0.34 0.00 0.00 178.44 179.45 3dyf h LEU 220 N 0.82 -0.00 -0.70 2.25 5.85 -0.90 -1.40 115.31 121.22 3dyf h LEU 220 Ca 0.12 -0.24 0.07 0.00 0.84 0.00 0.00 57.88 58.67 3dyf h LEU 220 Cb 0.73 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.70 3dyf h LEU 220 CO 0.06 0.23 0.39 -0.65 -0.34 0.00 0.00 178.44 178.13 3dyf h PRO 221 N -0.24 0.68 0.16 5.25 0.11 -1.77 0.86 132.00 137.06 3dyf h PRO 221 Ca -0.00 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 66.06 3dyf h PRO 221 Cb 0.24 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.20 3dyf h PRO 221 CO 0.00 0.45 -0.08 -0.07 -0.21 0.00 0.00 178.00 178.09 3dyf h LEU 222 N 0.70 -0.18 -0.23 2.35 3.38 -1.56 -2.72 115.31 117.05 3dyf h LEU 222 Ca 0.32 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.29 3dyf h LEU 222 Cb 0.23 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3dyf h LEU 222 CO -0.20 -0.10 0.10 0.58 0.09 0.00 0.00 178.44 178.91 3dyf h VAL 223 N -0.25 0.97 -0.07 1.22 2.07 -0.82 -2.13 116.25 117.23 3dyf h VAL 223 Ca -0.02 -0.07 0.02 0.00 0.82 0.00 0.00 66.70 67.44 3dyf h VAL 223 Cb 0.20 0.73 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 3dyf h VAL 223 CO 0.04 0.04 0.05 0.24 0.02 0.00 0.00 177.57 177.96 3dyf h MET 224 N 0.22 0.00 -0.30 1.57 2.86 -0.80 -0.45 114.93 118.03 3dyf h MET 224 Ca 0.10 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.57 3dyf h MET 224 Cb 0.04 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.70 3dyf h MET 224 CO -0.08 0.00 -0.48 0.78 1.06 0.00 0.00 176.91 178.19 3dyf h GLY 225 N 0.00 0.89 1.58 8.32 0.00 -1.07 -2.12 103.07 110.67 3dyf h GLY 225 Ca 0.03 -0.97 -0.15 0.00 0.00 0.00 0.00 47.33 46.24 3dyf h GLY 225 CO -0.00 0.88 -0.53 1.41 0.00 0.00 0.00 176.54 178.30 3dyf h LEU 226 N 0.64 0.49 -0.33 3.11 3.38 -0.82 -2.33 115.31 119.45 3dyf h LEU 226 Ca 0.03 -0.25 -0.12 0.00 0.09 0.00 0.00 57.88 57.63 3dyf h LEU 226 Cb 1.06 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 3dyf h LEU 226 CO 0.11 0.92 -0.24 0.40 0.09 0.00 0.00 178.44 179.72 3dyf h ILE 227 N 0.34 1.29 0.00 1.22 2.04 -1.05 0.49 117.51 121.85 3dyf h ILE 227 Ca 0.01 -1.39 -0.04 0.00 1.00 0.00 0.00 64.86 64.44 3dyf h ILE 227 Cb 1.04 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.57 3dyf h ILE 227 CO 0.09 0.45 -0.17 -0.37 0.00 0.00 0.00 178.15 178.15 3dyf h VAL 228 N 0.52 0.34 -0.01 1.67 -1.51 -1.40 -2.36 116.25 113.50 3dyf h VAL 228 Ca 0.06 -1.24 0.00 0.00 -1.23 0.00 0.00 66.70 64.30 3dyf h VAL 228 Cb 0.80 1.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.93 3dyf h VAL 228 CO 0.06 0.17 -0.25 -1.54 -1.23 0.00 0.00 177.57 174.79 3dyf n SER 229 N -3.20 1.60 -2.72 4.19 3.41 -0.88 -4.85 113.62 111.18 3dyf n SER 229 Ca 0.02 -1.29 -0.21 0.00 -0.26 0.00 0.00 58.87 57.13 3dyf n SER 229 Cb 0.52 0.20 0.01 0.00 -0.26 0.00 0.00 64.21 64.67 3dyf n SER 229 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3dyf n GLU 230 N -0.12 -3.25 -0.18 4.33 1.02 0.34 -4.87 120.64 117.91 3dyf n GLU 230 Ca 0.13 0.93 0.07 0.00 -0.02 0.00 0.00 57.16 58.27 3dyf n GLU 230 Cb 0.41 -5.69 0.15 0.00 -0.02 0.00 0.00 31.44 26.28 3dyf n GLU 230 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dyf n ALA 231 N -2.78 2.40 -0.08 0.62 0.00 0.15 -4.77 120.51 116.04 3dyf n ALA 231 Ca -0.18 -1.93 -0.06 0.00 0.00 0.00 0.00 53.44 51.27 3dyf n ALA 231 Cb 0.65 -0.40 -0.00 0.00 0.00 0.00 0.00 19.45 19.70 3dyf n ALA 231 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3dyf h LEU 232 N 0.86 -0.45 0.00 0.00 5.85 -1.80 -1.27 115.31 118.50 3dyf h LEU 232 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3dyf h LEU 232 Cb 0.97 0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.26 3dyf h LEU 232 CO 0.06 -0.17 0.00 -2.65 -0.34 0.00 0.00 178.44 175.35 3dyf n PRO 233 N -5.31 0.33 0.01 5.25 -0.02 -1.26 -2.97 135.00 131.03 3dyf n PRO 233 Ca 0.01 0.00 0.11 0.00 -2.02 0.00 0.00 63.50 61.60 3dyf n PRO 233 Cb 0.23 -1.48 0.03 0.00 -0.02 0.00 0.00 33.50 32.25 3dyf n PRO 233 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3dyf n THR 234 N -0.98 0.08 -4.23 3.45 -2.24 -0.48 -4.98 114.28 104.90 3dyf n THR 234 Ca 0.08 -0.13 -0.24 0.00 -2.27 0.00 0.00 64.05 61.49 3dyf n THR 234 Cb 0.03 0.43 -0.07 0.00 -2.10 0.00 0.00 70.33 68.62 3dyf n THR 234 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 3dyf s VAL 235 N -3.11 3.71 -1.26 2.28 -7.23 -1.16 -4.75 120.40 108.89 3dyf s VAL 235 Ca 0.06 -1.62 -0.20 0.00 -1.81 0.00 0.00 61.98 58.42 3dyf s VAL 235 Cb 0.16 -2.93 0.01 0.00 0.56 0.00 0.00 36.38 34.17 3dyf s VAL 235 CO 0.80 -0.25 1.82 -0.67 -0.31 0.00 0.00 175.10 176.50 3dyf n ASP 236 N -0.57 4.21 -0.29 4.85 -0.08 -1.26 -4.81 116.55 118.61 3dyf n ASP 236 Ca -0.08 -2.84 0.09 0.00 -1.51 0.00 0.00 54.79 50.46 3dyf n ASP 236 Cb 0.57 -1.74 0.22 0.00 2.34 0.00 0.00 41.12 42.52 3dyf n ASP 236 CO 0.00 0.00 0.00 -0.03 0.12 0.00 0.00 177.20 177.29 3dyf h MET 237 N 8.29 0.12 -1.01 -0.67 1.85 -1.96 0.21 114.93 121.77 3dyf h MET 237 Ca 0.37 -0.01 0.23 0.00 -0.61 0.00 0.00 59.70 59.68 3dyf h MET 237 Cb 0.88 -0.03 -0.11 0.00 0.43 0.00 0.00 31.60 32.78 3dyf h MET 237 CO 1.39 0.08 0.61 0.78 -0.40 0.00 0.00 176.91 179.37 3dyf h GLY 238 N 0.12 1.75 0.03 1.39 0.00 -2.00 0.24 103.07 104.60 3dyf h GLY 238 Ca 0.49 -0.31 -0.00 0.00 0.00 0.00 0.00 47.33 47.51 3dyf h GLY 238 CO -0.71 -0.16 -0.00 -2.08 0.00 0.00 0.00 176.54 173.59 3dyf h VAL 239 N 0.62 1.66 -1.09 4.60 2.07 -1.08 -2.97 116.25 120.07 3dyf h VAL 239 Ca 0.61 -2.20 0.32 0.00 0.82 0.00 0.00 66.70 66.25 3dyf h VAL 239 Cb 1.14 3.12 -0.12 0.00 -1.52 0.00 0.00 31.29 33.91 3dyf h VAL 239 CO -0.41 0.56 0.67 0.74 0.02 0.00 0.00 177.57 179.15 3dyf h THR 240 N -0.98 0.37 -0.00 2.57 2.02 -0.01 0.18 112.91 117.06 3dyf h THR 240 Ca -0.00 -0.11 -0.08 0.00 0.77 0.00 0.00 66.41 66.99 3dyf h THR 240 Cb 0.91 0.01 0.01 0.00 -1.74 0.00 0.00 68.15 67.34 3dyf h THR 240 CO 0.00 0.06 -0.31 -0.33 0.37 0.00 0.00 175.52 175.31 3dyf h GLU 241 N 0.32 0.21 -0.71 6.66 5.08 -0.67 -1.76 114.58 123.72 3dyf h GLU 241 Ca 0.69 -0.22 0.15 0.00 -1.00 0.00 0.00 59.36 58.98 3dyf h GLU 241 Cb 1.77 0.06 -0.13 0.00 0.50 0.00 0.00 28.75 30.95 3dyf h GLU 241 CO -0.44 0.95 -0.11 0.93 -1.00 0.00 0.00 179.01 179.35 3dyf h GLU 242 N -0.45 0.03 0.53 2.33 5.08 -0.58 0.33 114.58 121.86 3dyf h GLU 242 Ca -0.04 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 3dyf h GLU 242 Cb 1.06 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.29 3dyf h GLU 242 CO 0.06 0.02 -0.38 -0.07 -1.00 0.00 0.00 179.01 177.64 3dyf h LEU 243 N 0.04 -0.98 -0.87 1.33 3.38 -0.89 -0.95 115.31 116.37 3dyf h LEU 243 Ca 0.36 0.07 0.16 0.00 0.09 0.00 0.00 57.88 58.55 3dyf h LEU 243 Cb 0.58 0.30 -0.10 0.00 0.09 0.00 0.00 40.66 41.53 3dyf h LEU 243 CO -0.69 -0.57 0.45 0.00 0.09 0.00 0.00 178.44 177.72 3dyf h ALA 244 N -0.54 1.33 -0.38 1.53 0.00 -0.20 0.21 119.26 121.20 3dyf h ALA 244 Ca -0.06 0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.85 3dyf h ALA 244 Cb 0.74 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3dyf h ALA 244 CO 0.03 -0.11 -0.14 0.52 0.00 0.00 0.00 179.25 179.55 3dyf h MET 245 N 0.61 0.69 0.49 0.00 2.86 -0.17 -0.43 114.93 118.99 3dyf h MET 245 Ca 0.48 -0.23 -0.02 0.00 -2.06 0.00 0.00 59.70 57.87 3dyf h MET 245 Cb 0.72 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.33 3dyf h MET 245 CO -0.38 0.80 -0.23 1.25 1.06 0.00 0.00 176.91 179.40 3dyf h LEU 246 N 0.63 -0.55 -1.49 1.22 5.85 0.51 -2.26 115.31 119.22 3dyf h LEU 246 Ca 0.11 -0.01 0.05 0.00 0.84 0.00 0.00 57.88 58.86 3dyf h LEU 246 Cb 0.59 0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.73 3dyf h LEU 246 CO 0.04 -0.13 0.40 0.24 -0.34 0.00 0.00 178.44 178.65 3dyf h MET 247 N -1.15 0.63 -0.25 1.25 2.86 -0.75 -1.83 114.93 115.69 3dyf h MET 247 Ca -0.07 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.52 3dyf h MET 247 Cb 0.53 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.04 3dyf h MET 247 CO 0.11 0.42 0.11 0.78 1.06 0.00 0.00 176.91 179.38 3dyf h GLY 248 N 0.65 0.40 0.70 8.32 0.00 -1.11 0.63 103.07 112.66 3dyf h GLY 248 Ca 0.26 -0.22 0.03 0.00 0.00 0.00 0.00 47.33 47.40 3dyf h GLY 248 CO -0.07 0.20 0.02 -2.09 0.00 0.00 0.00 176.54 174.60 3dyf h GLU 249 N 0.26 0.10 0.33 4.80 4.81 -0.73 -1.65 114.58 122.49 3dyf h GLU 249 Ca 0.08 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3dyf h GLU 249 Cb 0.17 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 3dyf h GLU 249 CO -0.01 0.07 -0.45 -0.92 -0.73 0.00 0.00 179.01 176.97 3dyf h TYR 250 N 0.10 -1.26 -0.84 0.92 3.20 -1.15 -0.59 116.97 117.36 3dyf h TYR 250 Ca 0.11 0.02 0.21 0.00 3.14 0.00 0.00 58.73 62.20 3dyf h TYR 250 Cb 0.12 0.51 -0.13 0.00 1.54 0.00 0.00 36.73 38.76 3dyf h TYR 250 CO -0.17 -0.59 0.23 0.35 -1.64 0.00 0.00 178.16 176.35 3dyf h PHE 251 N -0.83 0.35 0.00 -3.82 3.57 -0.61 0.18 116.94 115.79 3dyf h PHE 251 Ca -0.02 0.05 -0.12 0.00 3.53 0.00 0.00 57.97 61.40 3dyf h PHE 251 Cb 0.77 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.47 3dyf h PHE 251 CO -0.29 -0.15 -0.59 0.37 -2.23 0.00 0.00 178.31 175.42 3dyf h GLN 252 N 0.25 0.00 -0.17 1.11 5.75 -0.89 -1.53 115.11 119.63 3dyf h GLN 252 Ca 0.51 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.90 3dyf h GLN 252 Cb 0.98 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.51 3dyf h GLN 252 CO -0.60 0.59 -0.39 0.28 -2.65 0.00 0.00 178.83 176.06 3dyf h VAL 253 N 0.00 1.30 -0.20 2.39 2.07 0.91 -1.87 116.25 120.84 3dyf h VAL 253 Ca -0.01 -1.50 -0.05 0.00 0.82 0.00 0.00 66.70 65.96 3dyf h VAL 253 Cb 1.11 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 32.47 3dyf h VAL 253 CO 0.08 0.46 -0.06 1.56 0.02 0.00 0.00 177.57 179.62 3dyf h GLN 254 N 0.32 0.40 -0.66 1.57 4.20 -0.79 -1.87 115.11 118.28 3dyf h GLN 254 Ca 0.03 -0.16 0.13 0.00 0.06 0.00 0.00 58.65 58.72 3dyf h GLN 254 Cb 0.83 -0.02 -0.10 0.00 0.30 0.00 0.00 27.48 28.49 3dyf h GLN 254 CO 0.07 0.66 0.12 0.22 -0.67 0.00 0.00 178.83 179.23 3dyf h ASP 255 N 0.11 -0.06 -0.15 1.46 3.58 -0.96 0.38 116.42 120.79 3dyf h ASP 255 Ca 0.05 0.13 -0.00 0.00 0.42 0.00 0.00 57.03 57.63 3dyf h ASP 255 Cb 0.52 0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.77 3dyf h ASP 255 CO 0.02 -0.04 0.08 0.44 -2.88 0.00 0.00 179.24 176.86 3dyf h ASP 256 N 0.23 0.19 -0.60 2.28 5.19 -1.15 -1.72 116.42 120.83 3dyf h ASP 256 Ca 0.35 -0.11 -0.00 0.00 -0.62 0.00 0.00 57.03 56.65 3dyf h ASP 256 Cb 0.57 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 40.00 3dyf h ASP 256 CO -0.47 0.25 0.37 0.58 -3.12 0.00 0.00 179.24 176.84 3dyf h VAL 257 N 0.12 1.17 -0.29 -1.35 2.07 -0.44 -2.74 116.25 114.80 3dyf h VAL 257 Ca 0.05 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 67.09 3dyf h VAL 257 Cb 0.10 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 3dyf h VAL 257 CO -0.01 0.18 -0.24 0.24 0.02 0.00 0.00 177.57 177.76 3dyf h MET 258 N 0.82 0.56 0.00 1.57 2.86 -0.89 0.45 114.93 120.30 3dyf h MET 258 Ca 0.22 -0.22 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3dyf h MET 258 Cb -0.03 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.60 3dyf h MET 258 CO -0.04 0.76 0.00 -3.47 1.06 0.00 0.00 176.91 175.22 3dyf n ASP 259 N -4.12 0.00 -0.00 1.22 2.03 -0.66 -0.32 116.55 114.70 3dyf n ASP 259 Ca -0.00 0.48 -0.00 0.00 0.52 0.00 0.00 54.79 55.79 3dyf n ASP 259 Cb 0.41 -0.49 -0.01 0.00 -0.72 0.00 0.00 41.12 40.32 3dyf n ASP 259 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3dyf n PHE 261 N -2.04 0.00 -3.58 0.00 3.72 0.08 -4.99 117.46 110.66 3dyf n PHE 261 Ca -0.01 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 56.99 3dyf n PHE 261 Cb 0.52 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.95 3dyf n PHE 261 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 3dyf s THR 262 N -0.23 4.82 0.05 4.37 2.01 0.56 -4.98 115.64 122.23 3dyf s THR 262 Ca 0.00 -0.59 -0.36 0.00 0.31 0.00 0.00 61.69 61.04 3dyf s THR 262 Cb 0.00 -3.59 -0.16 0.00 0.01 0.00 0.00 72.50 68.77 3dyf s THR 262 CO 0.00 -0.12 1.49 -0.81 -0.69 0.00 0.00 174.62 174.48 3dyf n PRO 263 N 5.04 1.46 -0.34 4.92 -0.04 -1.26 -4.51 135.00 140.27 3dyf n PRO 263 Ca -0.12 0.53 0.19 0.00 -0.04 0.00 0.00 63.50 64.06 3dyf n PRO 263 Cb 0.48 -2.22 0.41 0.00 -0.04 0.00 0.00 33.50 32.12 3dyf n PRO 263 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 3dyf h PRO 264 N 5.54 0.46 -0.76 0.54 0.13 -1.94 0.79 132.00 136.75 3dyf h PRO 264 Ca -0.47 -0.03 0.22 0.00 -0.87 0.00 0.00 66.00 64.85 3dyf h PRO 264 Cb 1.31 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 32.31 3dyf h PRO 264 CO 0.84 0.30 0.60 0.93 -0.23 0.00 0.00 178.00 180.45 3dyf h GLU 265 N 0.47 0.00 0.01 0.86 4.39 -1.90 1.59 114.58 120.01 3dyf h GLU 265 Ca 0.67 0.00 -0.40 0.00 0.34 0.00 0.00 59.36 59.96 3dyf h GLU 265 Cb 1.36 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.95 3dyf h GLU 265 CO -0.53 0.00 -2.35 -2.13 -1.16 0.00 0.00 179.01 172.84 3dyf n ARG 266 N -4.10 0.63 0.01 2.33 3.00 0.24 -4.57 116.66 114.20 3dyf n ARG 266 Ca 0.15 0.24 -0.14 0.00 -0.00 0.00 0.00 57.85 58.10 3dyf n ARG 266 Cb 0.88 -1.55 -0.03 0.00 0.00 0.00 0.00 32.46 31.76 3dyf n ARG 266 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 3dyf h LEU 267 N -0.43 0.77 0.00 6.15 5.85 0.43 -3.46 115.31 124.62 3dyf h LEU 267 Ca -0.59 -0.51 0.00 0.00 0.84 0.00 0.00 57.88 57.62 3dyf h LEU 267 Cb 1.77 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 42.57 3dyf h LEU 267 CO -0.20 1.28 0.00 0.61 -0.34 0.00 0.00 178.44 179.79 3dyf n GLY 268 N 0.66 0.65 3.42 3.75 0.00 0.54 -4.75 105.19 109.46 3dyf n GLY 268 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.81 3dyf n GLY 268 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dyf s LYS 269 N -0.79 0.72 0.13 1.61 -2.85 -1.25 -0.01 119.74 117.30 3dyf s LYS 269 Ca 0.00 0.51 -0.27 0.00 -1.00 0.00 0.00 55.97 55.21 3dyf s LYS 269 Cb 0.00 0.34 -0.07 0.00 -2.06 0.00 0.00 37.83 36.04 3dyf s LYS 269 CO 0.00 -0.14 0.85 0.08 0.10 0.00 0.00 175.35 176.24 3dyf s VAL 270 N -0.25 4.45 0.61 1.79 1.01 -1.26 -4.35 120.40 122.41 3dyf s VAL 270 Ca -0.04 1.84 -0.17 0.00 0.00 0.00 0.00 61.98 63.61 3dyf s VAL 270 Cb -0.03 -4.21 -0.02 0.00 0.00 0.00 0.00 36.38 32.11 3dyf s VAL 270 CO 0.03 0.42 1.12 -0.83 0.00 0.00 0.00 175.10 175.84 3dyf s GLY 271 N -0.56 2.35 0.00 4.51 0.00 -1.26 -4.61 107.32 107.75 3dyf s GLY 271 Ca 0.40 0.66 0.00 0.00 0.00 0.00 0.00 44.72 45.78 3dyf s GLY 271 CO 0.27 1.01 0.00 -1.30 0.00 0.00 0.00 173.10 173.08 3dyf n THR 272 N -1.96 0.00 0.20 0.90 -2.24 -1.26 -4.93 114.28 104.99 3dyf n THR 272 Ca 0.11 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.73 3dyf n THR 272 Cb 0.52 1.44 -0.08 0.00 -2.10 0.00 0.00 70.33 70.10 3dyf n THR 272 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3dyf h ASP 273 N 0.00 -1.19 -0.55 3.42 3.32 -1.94 1.00 116.42 120.49 3dyf h ASP 273 Ca 0.00 0.11 0.09 0.00 0.02 0.00 0.00 57.03 57.26 3dyf h ASP 273 Cb 0.29 0.42 -0.07 0.00 0.22 0.00 0.00 39.33 40.19 3dyf h ASP 273 CO 0.00 -0.54 0.14 0.40 -1.72 0.00 0.00 179.24 177.52 3dyf h ILE 274 N -0.77 0.72 -0.59 0.35 2.04 -1.92 0.40 117.51 117.73 3dyf h ILE 274 Ca -0.01 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.71 3dyf h ILE 274 Cb 0.73 0.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.19 3dyf h ILE 274 CO -0.14 0.05 0.24 1.56 0.00 0.00 0.00 178.15 179.86 3dyf h GLN 275 N 0.29 0.88 0.00 2.37 7.50 -1.64 0.45 115.11 124.96 3dyf h GLN 275 Ca 0.28 -0.16 0.00 0.00 0.50 0.00 0.00 58.65 59.27 3dyf h GLN 275 Cb 0.37 -0.14 0.00 0.00 0.05 0.00 0.00 27.48 27.76 3dyf h GLN 275 CO -0.34 0.76 0.00 -0.25 -1.50 0.00 0.00 178.83 177.50 3dyf n ASP 276 N -4.47 0.00 -2.88 1.46 9.92 0.34 -3.59 116.55 117.33 3dyf n ASP 276 Ca 0.03 -0.13 -0.20 0.00 -0.53 0.00 0.00 54.79 53.96 3dyf n ASP 276 Cb 0.16 -0.27 0.05 0.00 -0.64 0.00 0.00 41.12 40.42 3dyf n ASP 276 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3dyf n ALA 277 N -1.27 -0.97 -1.65 2.24 0.00 0.13 -4.94 120.51 114.04 3dyf n ALA 277 Ca 0.13 0.30 -0.33 0.00 0.00 0.00 0.00 53.44 53.54 3dyf n ALA 277 Cb 0.21 -4.05 0.01 0.00 0.00 0.00 0.00 19.45 15.62 3dyf n ALA 277 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3dyf s LYS 278 N -5.79 3.25 -1.25 0.00 -0.14 -0.70 -4.54 119.74 110.57 3dyf s LYS 278 Ca 0.36 1.30 -0.11 0.00 -1.36 0.00 0.00 55.97 56.17 3dyf s LYS 278 Cb -0.16 -2.02 0.18 0.00 -1.68 0.00 0.00 37.83 34.15 3dyf s LYS 278 CO 0.45 -0.88 1.71 0.00 -0.76 0.00 0.00 175.35 175.87 3dyf n SER 280 N 4.31 0.56 -0.09 0.00 3.41 -1.26 -4.89 113.62 115.66 3dyf n SER 280 Ca 0.38 -1.67 -0.13 0.00 -0.26 0.00 0.00 58.87 57.19 3dyf n SER 280 Cb 0.38 -0.77 -0.05 0.00 -0.26 0.00 0.00 64.21 63.51 3dyf n SER 280 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 3dyf h TRP 281 N -1.23 0.69 -0.86 7.33 7.01 -1.92 -2.60 115.95 124.38 3dyf h TRP 281 Ca -0.35 -0.19 0.02 0.00 2.11 0.00 0.00 58.89 60.48 3dyf h TRP 281 Cb 1.07 -0.15 -0.05 0.00 -2.10 0.00 0.00 29.16 27.93 3dyf h TRP 281 CO 0.00 0.88 0.56 -0.07 -2.79 0.00 0.00 178.44 177.02 3dyf h LEU 282 N 0.31 0.96 0.32 0.65 3.38 -1.92 -0.73 115.31 118.28 3dyf h LEU 282 Ca 0.05 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 3dyf h LEU 282 Cb 0.73 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.25 3dyf h LEU 282 CO 0.05 0.68 -0.16 0.00 0.09 0.00 0.00 178.44 179.11 3dyf h ALA 283 N 1.33 -0.44 -0.62 1.53 0.00 -1.88 -0.44 119.26 118.75 3dyf h ALA 283 Ca 0.33 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 3dyf h ALA 283 Cb -0.08 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3dyf h ALA 283 CO -0.09 -0.63 0.17 -0.39 0.00 0.00 0.00 179.25 178.32 3dyf h VAL 284 N -0.67 1.24 0.19 0.00 -1.51 -1.39 -0.55 116.25 113.55 3dyf h VAL 284 Ca -0.04 -0.85 -0.01 0.00 -1.23 0.00 0.00 66.70 64.57 3dyf h VAL 284 Cb 0.47 0.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.21 3dyf h VAL 284 CO 0.07 0.32 -0.09 0.74 -1.23 0.00 0.00 177.57 177.39 3dyf h THR 285 N 0.92 0.91 0.10 7.19 2.02 -1.14 -2.30 112.91 120.62 3dyf h THR 285 Ca 0.20 -0.76 0.01 0.00 0.77 0.00 0.00 66.41 66.63 3dyf h THR 285 Cb 0.30 1.35 -0.05 0.00 -1.74 0.00 0.00 68.15 68.01 3dyf h THR 285 CO -0.00 0.17 -0.53 0.15 0.37 0.00 0.00 175.52 175.67 3dyf h PHE 286 N -0.65 -1.53 -0.77 3.16 3.57 -0.97 -2.45 116.94 117.29 3dyf h PHE 286 Ca -0.03 0.04 0.17 0.00 3.53 0.00 0.00 57.97 61.69 3dyf h PHE 286 Cb 0.47 0.66 -0.11 0.00 2.79 0.00 0.00 35.95 39.75 3dyf h PHE 286 CO 0.04 -0.59 0.23 -0.07 -2.23 0.00 0.00 178.31 175.69 3dyf h LEU 287 N -0.74 0.09 -1.74 0.59 3.38 -1.15 0.67 115.31 116.42 3dyf h LEU 287 Ca -0.00 0.15 -0.03 0.00 0.09 0.00 0.00 57.88 58.08 3dyf h LEU 287 Cb 0.75 0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.67 3dyf h LEU 287 CO -0.30 -0.02 -0.16 0.00 0.09 0.00 0.00 178.44 178.05 3dyf h ALA 288 N 1.63 1.32 0.00 1.53 0.00 -1.03 -3.14 119.26 119.57 3dyf h ALA 288 Ca 0.45 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.21 3dyf h ALA 288 Cb 0.78 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3dyf h ALA 288 CO -0.51 0.20 -0.55 0.36 0.00 0.00 0.00 179.25 178.75 3dyf n LYS 289 N -3.75 3.35 -2.60 0.00 2.85 -0.18 -5.03 118.16 112.80 3dyf n LYS 289 Ca -0.02 -0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.92 3dyf n LYS 289 Cb 0.27 -1.01 -0.05 0.00 -0.65 0.00 0.00 35.03 33.59 3dyf n LYS 289 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3dyf s ALA 290 N -2.04 3.10 0.63 0.58 0.00 0.22 -5.07 121.76 119.18 3dyf s ALA 290 Ca 0.04 0.21 -0.10 0.00 0.00 0.00 0.00 51.96 52.11 3dyf s ALA 290 Cb 0.08 -3.07 -0.02 0.00 0.00 0.00 0.00 23.12 20.11 3dyf s ALA 290 CO 0.44 -0.08 1.00 -1.54 0.00 0.00 0.00 175.76 175.58 3dyf s SER 291 N -2.77 5.90 0.43 0.00 1.04 -1.26 -4.81 113.70 112.24 3dyf s SER 291 Ca 0.59 1.18 0.15 0.00 0.48 0.00 0.00 55.95 58.34 3dyf s SER 291 Cb -0.10 -2.17 1.04 0.00 0.10 0.00 0.00 66.02 64.90 3dyf s SER 291 CO 0.25 -1.01 1.95 0.28 0.98 0.00 0.00 173.24 175.69 3dyf h SER 292 N -0.34 0.38 -0.18 7.02 0.02 -1.98 0.28 113.55 118.76 3dyf h SER 292 Ca -0.45 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.47 3dyf h SER 292 Cb 1.22 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.69 3dyf h SER 292 CO 0.62 0.21 -0.06 0.00 -1.14 0.00 0.00 176.83 176.46 3dyf h ALA 293 N 1.67 0.24 -0.70 3.77 0.00 -1.99 -0.25 119.26 122.00 3dyf h ALA 293 Ca 0.33 -0.26 -0.06 0.00 0.00 0.00 0.00 54.91 54.92 3dyf h ALA 293 Cb 0.72 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 3dyf h ALA 293 CO -0.10 0.04 0.20 1.96 0.00 0.00 0.00 179.25 181.35 3dyf h GLN 294 N 0.05 1.10 -0.11 0.00 4.20 -1.52 -2.70 115.11 116.14 3dyf h GLN 294 Ca 0.04 -0.25 -0.13 0.00 0.06 0.00 0.00 58.65 58.37 3dyf h GLN 294 Cb 0.52 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 3dyf h GLN 294 CO 0.02 0.96 -0.51 0.28 -0.67 0.00 0.00 178.83 178.91 3dyf h VAL 295 N 1.04 1.34 -0.58 -0.54 2.07 -0.44 -1.64 116.25 117.50 3dyf h VAL 295 Ca 0.22 -1.75 -0.05 0.00 0.82 0.00 0.00 66.70 65.94 3dyf h VAL 295 Cb 0.33 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 3dyf h VAL 295 CO -0.00 0.53 0.16 0.00 0.02 0.00 0.00 177.57 178.28 3dyf h ALA 296 N 1.24 0.77 -0.64 1.67 0.00 -0.86 -0.61 119.26 120.82 3dyf h ALA 296 Ca 0.01 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 3dyf h ALA 296 Cb 0.98 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 3dyf h ALA 296 CO 0.08 0.45 0.16 1.49 0.00 0.00 0.00 179.25 181.43 3dyf h GLU 297 N 0.83 1.02 -0.04 0.00 4.81 -1.32 -2.61 114.58 117.27 3dyf h GLU 297 Ca 0.19 -0.24 0.02 0.00 -0.13 0.00 0.00 59.36 59.19 3dyf h GLU 297 Cb 0.31 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.54 3dyf h GLU 297 CO -0.00 0.92 -0.07 0.35 -0.73 0.00 0.00 179.01 179.48 3dyf h PHE 298 N 0.94 -0.18 0.00 0.92 3.57 -0.90 -0.38 116.94 120.92 3dyf h PHE 298 Ca 0.20 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.71 3dyf h PHE 298 Cb 0.36 0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.18 3dyf h PHE 298 CO 0.03 -0.11 0.00 1.63 -2.23 0.00 0.00 178.31 177.62 3dyf n LYS 299 N -5.20 0.14 0.01 1.11 5.02 -0.27 -1.10 118.16 117.88 3dyf n LYS 299 Ca -0.05 0.57 0.11 0.00 -2.02 0.00 0.00 58.31 56.92 3dyf n LYS 299 Cb 0.12 -1.90 0.06 0.00 -0.02 0.00 0.00 35.03 33.29 3dyf n LYS 299 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dyf n ALA 300 N -1.75 3.75 -0.52 7.82 0.00 -0.19 -4.47 120.51 125.15 3dyf n ALA 300 Ca -0.00 -0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.00 3dyf n ALA 300 Cb 0.08 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.56 3dyf n ALA 300 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3dyf n ASN 301 N -1.72 0.35 -4.82 0.00 3.02 -0.64 -5.07 115.26 106.38 3dyf n ASN 301 Ca 0.03 -0.90 -0.37 0.00 -0.03 0.00 0.00 54.58 53.32 3dyf n ASN 301 Cb 0.38 0.05 -0.06 0.00 -0.61 0.00 0.00 39.78 39.54 3dyf n ASN 301 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3dyf s TYR 302 N -0.05 3.69 -0.52 3.10 5.04 -0.26 -4.05 117.35 124.31 3dyf s TYR 302 Ca 0.00 1.29 -0.01 0.00 -2.44 0.00 0.00 57.07 55.91 3dyf s TYR 302 Cb 0.00 -2.54 0.00 0.00 0.35 0.00 0.00 41.96 39.77 3dyf s TYR 302 CO 0.00 0.43 0.13 0.41 -1.34 0.00 0.00 175.55 175.18 3dyf n GLY 303 N 1.01 0.23 3.20 8.97 0.00 0.15 -4.91 105.19 113.84 3dyf n GLY 303 Ca -0.05 -0.53 -0.27 0.00 0.00 0.00 0.00 46.02 45.17 3dyf n GLY 303 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dyf s SER 304 N -2.84 2.32 0.22 1.61 0.15 -1.24 -4.77 113.70 109.15 3dyf s SER 304 Ca 0.06 -0.36 0.02 0.00 0.70 0.00 0.00 55.95 56.38 3dyf s SER 304 Cb -0.03 -0.30 0.19 0.00 -1.71 0.00 0.00 66.02 64.18 3dyf s SER 304 CO 0.08 0.24 1.53 1.23 1.20 0.00 0.00 173.24 177.52 3dyf h GLY 305 N 5.70 0.34 -6.59 9.45 0.00 -1.92 -3.39 103.07 106.66 3dyf h GLY 305 Ca -0.38 -0.43 -0.77 0.00 0.00 0.00 0.00 47.33 45.75 3dyf h GLY 305 CO 0.48 0.38 0.90 1.34 0.00 0.00 0.00 176.54 179.65 3dyf n ASP 306 N -3.88 1.99 0.20 0.19 -0.08 -1.26 -4.84 116.55 108.87 3dyf n ASP 306 Ca -0.03 1.04 0.06 0.00 -1.51 0.00 0.00 54.79 54.35 3dyf n ASP 306 Cb 0.63 -1.07 0.40 0.00 2.34 0.00 0.00 41.12 43.43 3dyf n ASP 306 CO 0.00 0.00 0.00 0.77 0.12 0.00 0.00 177.20 178.09 3dyf h SER 307 N 7.06 0.00 1.39 1.67 4.64 -2.00 -2.71 113.55 123.59 3dyf h SER 307 Ca -0.43 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.88 3dyf h SER 307 Cb 1.34 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.42 3dyf h SER 307 CO 0.98 0.35 -0.08 1.05 -0.87 0.00 0.00 176.83 178.25 3dyf h GLU 308 N 0.00 0.00 0.24 4.77 4.11 -1.97 -1.86 114.58 119.86 3dyf h GLU 308 Ca -0.00 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.10 3dyf h GLU 308 Cb 0.74 0.00 0.04 0.00 0.50 0.00 0.00 28.75 30.03 3dyf h GLU 308 CO 0.04 0.08 -1.45 0.87 0.07 0.00 0.00 179.01 178.63 3dyf h LYS 309 N 0.00 0.52 -0.41 1.06 1.57 -1.82 -2.59 116.57 114.90 3dyf h LYS 309 Ca -0.00 -0.88 -0.02 0.00 -1.87 0.00 0.00 60.65 57.88 3dyf h LYS 309 Cb 0.80 0.33 -0.02 0.00 0.08 0.00 0.00 32.23 33.41 3dyf h LYS 309 CO 0.01 1.42 0.19 0.28 -0.57 0.00 0.00 179.45 180.78 3dyf h VAL 310 N 0.15 1.15 0.00 0.50 2.07 -1.32 0.14 116.25 118.94 3dyf h VAL 310 Ca -0.24 -0.42 -0.09 0.00 0.82 0.00 0.00 66.70 66.77 3dyf h VAL 310 Cb 2.14 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.53 3dyf h VAL 310 CO 0.27 0.17 -0.43 0.00 0.02 0.00 0.00 177.57 177.60 3dyf h ALA 311 N 1.64 1.15 0.03 1.67 0.00 -1.31 0.11 119.26 122.54 3dyf h ALA 311 Ca 0.15 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3dyf h ALA 311 Cb 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3dyf h ALA 311 CO -0.02 0.53 -0.01 1.15 0.00 0.00 0.00 179.25 180.90 3dyf h THR 312 N 0.00 1.31 0.65 0.00 2.02 -0.38 0.52 112.91 117.03 3dyf h THR 312 Ca -0.00 -1.08 -0.02 0.00 0.77 0.00 0.00 66.41 66.07 3dyf h THR 312 Cb 0.83 2.03 -0.01 0.00 -1.74 0.00 0.00 68.15 69.25 3dyf h THR 312 CO 0.06 0.27 -0.48 0.58 0.37 0.00 0.00 175.52 176.32 3dyf h VAL 313 N -0.51 0.05 -0.90 3.16 2.07 -0.90 0.33 116.25 119.56 3dyf h VAL 313 Ca -0.00 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.75 3dyf h VAL 313 Cb 0.48 0.05 -0.14 0.00 -1.52 0.00 0.00 31.29 30.16 3dyf h VAL 313 CO 0.01 0.00 0.33 -0.09 0.02 0.00 0.00 177.57 177.84 3dyf h ARG 314 N -1.09 0.29 -0.21 1.57 2.43 -0.81 0.36 114.38 116.92 3dyf h ARG 314 Ca -0.08 -0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 3dyf h ARG 314 Cb 0.90 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.38 3dyf h ARG 314 CO 0.03 0.19 0.09 -0.09 -1.51 0.00 0.00 179.97 178.69 3dyf h ARG 315 N 0.30 0.31 -0.43 0.20 1.12 -0.11 -2.92 114.38 112.85 3dyf h ARG 315 Ca 0.57 -0.05 0.06 0.00 -1.11 0.00 0.00 59.98 59.45 3dyf h ARG 315 Cb 1.15 -0.05 -0.05 0.00 -0.01 0.00 0.00 29.97 31.00 3dyf h ARG 315 CO -0.60 0.35 0.12 -0.07 -3.11 0.00 0.00 179.97 176.66 3dyf h LEU 316 N 0.20 0.08 -0.19 3.80 3.38 0.36 -2.20 115.31 120.74 3dyf h LEU 316 Ca 0.07 0.06 0.05 0.00 0.09 0.00 0.00 57.88 58.15 3dyf h LEU 316 Cb 0.15 0.07 -0.05 0.00 0.09 0.00 0.00 40.66 40.92 3dyf h LEU 316 CO -0.01 0.08 -0.10 1.88 0.09 0.00 0.00 178.44 180.38 3dyf h TYR 317 N 0.26 -0.24 -0.95 1.13 0.05 -1.03 -2.26 116.97 113.92 3dyf h TYR 317 Ca 0.21 0.02 0.10 0.00 0.05 0.00 0.00 58.73 59.11 3dyf h TYR 317 Cb 0.23 0.14 -0.08 0.00 1.01 0.00 0.00 36.73 38.03 3dyf h TYR 317 CO -0.18 -0.16 0.59 0.93 -1.05 0.00 0.00 178.16 178.29 3dyf h GLU 318 N -0.08 0.95 -0.19 4.88 5.08 -1.29 -1.65 114.58 122.27 3dyf h GLU 318 Ca 0.11 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 3dyf h GLU 318 Cb 0.24 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.28 3dyf h GLU 318 CO -0.25 0.63 0.00 0.39 -1.00 0.00 0.00 179.01 178.78 3dyf n GLU 319 N -4.63 0.93 0.00 2.33 1.02 -0.86 -2.54 120.64 116.90 3dyf n GLU 319 Ca 0.17 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 3dyf n GLU 319 Cb 0.30 -1.10 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 3dyf n GLU 319 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3dyf n ALA 320 N -0.39 1.76 -3.70 0.62 0.00 -0.62 -5.02 120.51 113.16 3dyf n ALA 320 Ca 0.00 -0.85 -0.23 0.00 0.00 0.00 0.00 53.44 52.35 3dyf n ALA 320 Cb 0.05 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.53 3dyf n ALA 320 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3dyf n ASP 321 N -0.36 -2.34 0.18 0.00 2.03 -1.05 -4.86 116.55 110.15 3dyf n ASP 321 Ca 0.00 -0.88 0.03 0.00 0.52 0.00 0.00 54.79 54.46 3dyf n ASP 321 Cb 0.30 -3.87 0.34 0.00 -0.72 0.00 0.00 41.12 37.17 3dyf n ASP 321 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 3dyf h LEU 322 N -1.80 0.00 -2.20 -2.67 -0.00 -1.79 -1.93 115.31 104.91 3dyf h LEU 322 Ca -0.63 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.25 3dyf h LEU 322 Cb 1.36 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 42.02 3dyf h LEU 322 CO 0.54 0.41 -0.04 1.56 -0.00 0.00 0.00 178.44 180.92 3dyf h GLN 323 N 0.00 0.00 0.26 1.13 1.08 -1.89 0.18 115.11 115.87 3dyf h GLN 323 Ca -0.00 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 3dyf h GLN 323 Cb 0.77 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.20 3dyf h GLN 323 CO 0.05 0.04 -0.12 0.78 -0.95 0.00 0.00 178.83 178.63 3dyf h GLY 324 N 0.19 -0.36 -0.09 3.46 0.00 -1.71 -2.49 103.07 102.07 3dyf h GLY 324 Ca -0.00 0.13 0.16 0.00 0.00 0.00 0.00 47.33 47.62 3dyf h GLY 324 CO 0.01 -0.13 0.15 -0.55 0.00 0.00 0.00 176.54 176.02 3dyf h ASP 325 N -0.99 -0.03 0.45 0.19 5.19 -1.31 -0.65 116.42 119.27 3dyf h ASP 325 Ca -0.04 0.15 -0.01 0.00 -0.62 0.00 0.00 57.03 56.52 3dyf h ASP 325 Cb 0.46 0.21 -0.02 0.00 0.18 0.00 0.00 39.33 40.16 3dyf h ASP 325 CO 0.06 -0.05 -0.42 0.22 -3.12 0.00 0.00 179.24 175.92 3dyf h TYR 326 N 0.25 -1.14 -0.84 4.55 3.20 -0.70 0.15 116.97 122.43 3dyf h TYR 326 Ca 0.41 0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.41 3dyf h TYR 326 Cb 0.70 0.44 -0.06 0.00 1.54 0.00 0.00 36.73 39.35 3dyf h TYR 326 CO -0.28 -0.58 0.55 0.28 -1.64 0.00 0.00 178.16 176.49 3dyf h VAL 327 N -0.88 0.88 -0.07 1.81 2.07 -0.88 0.18 116.25 119.37 3dyf h VAL 327 Ca -0.04 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 3dyf h VAL 327 Cb 0.77 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 30.66 3dyf h VAL 327 CO -0.05 0.13 -0.00 0.00 0.02 0.00 0.00 177.57 177.67 3dyf h ALA 328 N 1.60 0.09 0.19 1.67 0.00 -0.59 -2.44 119.26 119.78 3dyf h ALA 328 Ca 0.41 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3dyf h ALA 328 Cb 0.62 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 3dyf h ALA 328 CO -0.17 -0.23 -0.19 -0.92 0.00 0.00 0.00 179.25 177.74 3dyf h TYR 329 N -0.17 -0.50 -0.85 0.00 3.20 0.46 -2.00 116.97 117.12 3dyf h TYR 329 Ca 0.02 0.00 0.23 0.00 3.14 0.00 0.00 58.73 62.12 3dyf h TYR 329 Cb 0.34 0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.76 3dyf h TYR 329 CO 0.03 -0.29 0.59 1.49 -1.64 0.00 0.00 178.16 178.35 3dyf h GLU 330 N -0.41 0.13 -0.00 1.82 4.81 -0.69 -0.86 114.58 119.37 3dyf h GLU 330 Ca 0.00 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.13 3dyf h GLU 330 Cb 0.39 -0.03 0.01 0.00 0.63 0.00 0.00 28.75 29.75 3dyf h GLU 330 CO -0.05 0.09 -0.35 0.00 -0.73 0.00 0.00 179.01 177.97 3dyf h ALA 331 N 1.60 0.05 -0.63 2.92 0.00 -0.90 -2.05 119.26 120.24 3dyf h ALA 331 Ca 0.42 -0.49 0.02 0.00 0.00 0.00 0.00 54.91 54.85 3dyf h ALA 331 Cb 1.44 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 3dyf h ALA 331 CO -0.06 0.16 0.42 0.00 0.00 0.00 0.00 179.25 179.77 3dyf h ALA 332 N 0.28 1.59 0.07 0.00 0.00 -0.57 -1.43 119.26 119.21 3dyf h ALA 332 Ca -0.04 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 3dyf h ALA 332 Cb 1.09 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.64 3dyf h ALA 332 CO 0.07 0.37 -0.03 0.28 0.00 0.00 0.00 179.25 179.93 3dyf h VAL 333 N 0.81 1.17 -0.65 0.00 2.07 -1.23 -2.80 116.25 115.63 3dyf h VAL 333 Ca 0.24 -0.90 0.14 0.00 0.82 0.00 0.00 66.70 67.00 3dyf h VAL 333 Cb -0.04 1.75 -0.04 0.00 -1.52 0.00 0.00 31.29 31.45 3dyf h VAL 333 CO -0.06 0.22 0.44 0.00 0.02 0.00 0.00 177.57 178.20 3dyf h ALA 334 N 0.37 2.24 0.70 1.67 0.00 -0.97 0.47 119.26 123.74 3dyf h ALA 334 Ca -0.01 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 3dyf h ALA 334 Cb 0.44 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.21 3dyf h ALA 334 CO 0.02 -0.41 -0.34 1.49 0.00 0.00 0.00 179.25 180.01 3dyf h GLU 335 N 0.26 -0.91 -0.94 0.00 4.22 -1.13 -1.76 114.58 114.33 3dyf h GLU 335 Ca 0.31 0.06 -0.00 0.00 0.08 0.00 0.00 59.36 59.81 3dyf h GLU 335 Cb 0.86 0.21 -0.05 0.00 0.50 0.00 0.00 28.75 30.27 3dyf h GLU 335 CO -0.07 -0.58 0.58 1.96 -2.18 0.00 0.00 179.01 178.73 3dyf h GLN 336 N -1.16 1.26 -0.29 1.92 4.20 -1.12 -2.15 115.11 117.77 3dyf h GLN 336 Ca -0.10 -0.10 0.01 0.00 0.06 0.00 0.00 58.65 58.52 3dyf h GLN 336 Cb 0.75 -0.27 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 3dyf h GLN 336 CO 0.16 0.86 0.18 0.28 -0.67 0.00 0.00 178.83 179.64 3dyf h VAL 337 N 1.29 1.06 -0.41 -0.54 2.07 -0.95 -0.82 116.25 117.95 3dyf h VAL 337 Ca 0.34 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.81 3dyf h VAL 337 Cb -0.09 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 30.27 3dyf h VAL 337 CO -0.07 0.07 0.01 0.50 0.02 0.00 0.00 177.57 178.10 3dyf h LYS 338 N 0.37 0.11 0.61 1.57 1.63 -0.74 -1.62 116.57 118.50 3dyf h LYS 338 Ca 0.11 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.87 3dyf h LYS 338 Cb -0.03 -0.02 0.01 0.00 -0.60 0.00 0.00 32.23 31.58 3dyf h LYS 338 CO -0.03 0.07 -0.29 0.93 -3.45 0.00 0.00 179.45 176.68 3dyf h GLU 339 N 0.11 -0.79 -0.98 1.90 5.08 -1.07 -2.92 114.58 115.92 3dyf h GLU 339 Ca 0.20 0.05 0.18 0.00 -1.00 0.00 0.00 59.36 58.79 3dyf h GLU 339 Cb 0.28 0.18 -0.10 0.00 0.50 0.00 0.00 28.75 29.61 3dyf h GLU 339 CO -0.33 -0.48 0.58 -0.07 -1.00 0.00 0.00 179.01 177.71 3dyf h LEU 340 N -0.96 0.75 -0.97 1.33 3.38 -1.01 0.22 115.31 118.05 3dyf h LEU 340 Ca -0.08 0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 3dyf h LEU 340 Cb 0.67 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.35 3dyf h LEU 340 CO 0.14 0.28 0.35 0.40 0.09 0.00 0.00 178.44 179.69 3dyf h ILE 341 N 0.75 1.24 0.00 1.22 2.04 -1.27 0.17 117.51 121.67 3dyf h ILE 341 Ca 0.56 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 3dyf h ILE 341 Cb 0.83 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 3dyf h ILE 341 CO -0.37 0.29 -0.00 -0.33 0.00 0.00 0.00 178.15 177.74 3dyf h GLU 342 N 1.08 -0.00 -0.92 2.37 4.39 -0.79 0.50 114.58 121.21 3dyf h GLU 342 Ca 0.26 0.00 0.26 0.00 0.34 0.00 0.00 59.36 60.22 3dyf h GLU 342 Cb 0.13 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.74 3dyf h GLU 342 CO -0.03 0.47 0.66 -0.22 -1.16 0.00 0.00 179.01 178.72 3dyf h LYS 343 N -0.48 0.03 0.20 2.33 3.64 -0.31 0.14 116.57 122.12 3dyf h LYS 343 Ca -0.00 -0.00 -0.35 0.00 -1.27 0.00 0.00 60.65 59.03 3dyf h LYS 343 Cb 0.47 -0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.30 3dyf h LYS 343 CO 0.00 0.02 -1.70 1.25 -2.27 0.00 0.00 179.45 176.75 3dyf h LEU 344 N 0.03 0.65 -1.57 5.20 5.85 -0.21 -3.35 115.31 121.90 3dyf h LEU 344 Ca 0.44 -0.94 0.16 0.00 0.84 0.00 0.00 57.88 58.39 3dyf h LEU 344 Cb 1.72 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 42.48 3dyf h LEU 344 CO -0.02 1.77 0.53 -0.09 -0.34 0.00 0.00 178.44 180.29 3dyf h ARG 345 N 0.09 0.39 -0.50 1.25 2.43 0.28 -1.06 114.38 117.27 3dyf h ARG 345 Ca -0.33 -0.02 0.08 0.00 -0.81 0.00 0.00 59.98 58.89 3dyf h ARG 345 Cb 2.10 -0.09 -0.10 0.00 -0.42 0.00 0.00 29.97 31.46 3dyf h ARG 345 CO 0.19 0.26 -0.46 -0.07 -1.51 0.00 0.00 179.97 178.38 3dyf h LEU 346 N 0.40 -1.55 0.00 3.80 4.07 -1.56 -2.75 115.31 117.72 3dyf h LEU 346 Ca 0.39 0.24 0.00 0.00 0.08 0.00 0.00 57.88 58.59 3dyf h LEU 346 Cb 0.93 0.68 0.00 0.00 1.08 0.00 0.00 40.66 43.36 3dyf h LEU 346 CO -0.13 -0.36 -1.12 0.00 -1.08 0.00 0.00 178.44 175.76 3dyf n SER 348 N -1.60 0.25 0.12 0.00 7.64 -0.42 -4.95 113.62 114.67 3dyf n SER 348 Ca 0.03 -2.62 -0.13 0.00 1.01 0.00 0.00 58.87 57.16 3dyf n SER 348 Cb 0.35 -0.61 -0.06 0.00 -1.01 0.00 0.00 64.21 62.89 3dyf n SER 348 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 3dyf h PRO 349 N 4.84 -0.38 0.14 1.43 0.13 -1.72 -0.65 132.00 135.80 3dyf h PRO 349 Ca 0.17 0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 3dyf h PRO 349 Cb 0.87 0.09 -0.01 0.00 0.13 0.00 0.00 31.00 32.08 3dyf h PRO 349 CO 0.46 -0.26 -0.11 0.78 -0.23 0.00 0.00 178.00 178.64 3dyf h GLY 350 N -0.40 -0.26 0.82 1.56 0.00 -1.90 -1.85 103.07 101.04 3dyf h GLY 350 Ca 0.02 0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.46 3dyf h GLY 350 CO -0.09 -0.12 -0.32 -2.75 0.00 0.00 0.00 176.54 173.27 3dyf h PHE 351 N -0.27 -0.83 -1.00 5.60 3.57 -1.89 -1.83 116.94 120.30 3dyf h PHE 351 Ca -0.00 -0.01 0.33 0.00 3.53 0.00 0.00 57.97 61.82 3dyf h PHE 351 Cb 0.24 0.30 -0.15 0.00 2.79 0.00 0.00 35.95 39.13 3dyf h PHE 351 CO -0.11 -0.48 0.54 0.00 -2.23 0.00 0.00 178.31 176.04 3dyf h ALA 352 N -0.31 1.94 0.10 2.41 0.00 -1.05 0.29 119.26 122.64 3dyf h ALA 352 Ca -0.05 0.20 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 3dyf h ALA 352 Cb 0.63 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3dyf h ALA 352 CO 0.04 -0.62 -0.05 0.00 0.00 0.00 0.00 179.25 178.62 3dyf h ALA 353 N 1.87 -0.13 -0.90 0.00 0.00 -0.53 0.67 119.26 120.23 3dyf h ALA 353 Ca 0.74 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.55 3dyf h ALA 353 Cb 1.71 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 19.51 3dyf h ALA 353 CO -0.63 -0.51 0.50 0.66 0.00 0.00 0.00 179.25 179.26 3dyf h SER 354 N -0.26 1.13 -0.85 0.00 4.64 0.04 0.85 113.55 119.10 3dyf h SER 354 Ca -0.01 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.20 3dyf h SER 354 Cb 0.22 -0.29 -0.04 0.00 -0.31 0.00 0.00 62.40 61.98 3dyf h SER 354 CO 0.02 0.90 0.49 0.58 -0.87 0.00 0.00 176.83 177.95 3dyf h VAL 355 N 1.26 1.24 -0.47 0.95 2.07 -0.58 0.13 116.25 120.86 3dyf h VAL 355 Ca 0.32 -0.57 -0.06 0.00 0.82 0.00 0.00 66.70 67.21 3dyf h VAL 355 Cb 0.02 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 29.85 3dyf h VAL 355 CO -0.05 0.26 0.05 -0.08 0.02 0.00 0.00 177.57 177.78 3dyf h GLU 356 N 1.18 0.73 0.25 1.57 4.81 0.14 -1.75 114.58 121.52 3dyf h GLU 356 Ca 0.30 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3dyf h GLU 356 Cb -0.01 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.28 3dyf h GLU 356 CO -0.05 0.71 -0.12 1.15 -0.73 0.00 0.00 179.01 179.96 3dyf h THR 357 N 0.70 0.80 -1.02 0.32 2.02 0.36 -2.18 112.91 113.91 3dyf h THR 357 Ca 0.15 -0.53 0.28 0.00 0.77 0.00 0.00 66.41 67.07 3dyf h THR 357 Cb 0.35 1.09 -0.06 0.00 -1.74 0.00 0.00 68.15 67.80 3dyf h THR 357 CO 0.01 0.11 0.70 0.25 0.37 0.00 0.00 175.52 176.96 3dyf h LEU 358 N -0.62 0.18 -0.39 2.58 5.85 -0.53 0.60 115.31 122.98 3dyf h LEU 358 Ca -0.03 0.03 -0.14 0.00 0.84 0.00 0.00 57.88 58.57 3dyf h LEU 358 Cb 0.45 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 3dyf h LEU 358 CO 0.06 0.05 -0.31 -0.25 -0.34 0.00 0.00 178.44 177.65 3dyf h TRP 359 N 0.17 1.06 -0.24 1.25 -0.00 -0.92 -2.90 115.95 114.35 3dyf h TRP 359 Ca 0.52 -0.30 0.05 0.00 -0.00 0.00 0.00 58.89 59.16 3dyf h TRP 359 Cb 1.73 -0.23 -0.01 0.00 -0.00 0.00 0.00 29.16 30.65 3dyf h TRP 359 CO -0.00 1.11 0.17 0.78 -0.00 0.00 0.00 178.44 180.49 3dyf h GLY 360 N 0.71 0.13 2.00 2.65 0.00 0.82 0.42 103.07 109.79 3dyf h GLY 360 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3dyf h GLY 360 CO 0.08 0.03 0.00 0.28 0.00 0.00 0.00 176.54 176.93 3dyf n LYS 361 N -4.48 0.16 -0.09 4.80 5.02 -1.01 -4.26 118.16 118.30 3dyf n LYS 361 Ca 0.02 0.13 -0.11 0.00 -2.02 0.00 0.00 58.31 56.33 3dyf n LYS 361 Cb 0.25 -1.68 -0.04 0.00 -0.02 0.00 0.00 35.03 33.54 3dyf n LYS 361 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 3dyf n THR 362 N -1.96 1.49 -1.56 -0.18 -1.04 0.12 -4.74 114.28 106.41 3dyf n THR 362 Ca 0.06 0.09 -0.56 0.00 -2.04 0.00 0.00 64.05 61.61 3dyf n THR 362 Cb 0.39 -2.30 -0.08 0.00 -1.82 0.00 0.00 70.33 66.52 3dyf n THR 362 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dyf n TYR 363 N -4.46 1.79 -3.67 -1.42 9.36 0.28 -2.29 117.16 116.76 3dyf n TYR 363 Ca -0.18 0.48 -0.22 0.00 3.32 0.00 0.00 57.90 61.31 3dyf n TYR 363 Cb 0.53 -2.46 0.04 0.00 -0.63 0.00 0.00 39.34 36.81 3dyf n TYR 363 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 3dyf n LYS 364 N 6.60 -4.24 -2.52 2.98 5.02 -1.26 -4.97 118.16 119.77 3dyf n LYS 364 Ca 0.35 0.62 -0.32 0.00 -2.02 0.00 0.00 58.31 56.94 3dyf n LYS 364 Cb 0.14 -5.09 -0.04 0.00 -0.02 0.00 0.00 35.03 30.02 3dyf n LYS 364 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3dyf s ARG 365 N -5.86 3.95 -0.14 1.97 1.70 -0.97 -5.01 118.95 114.58 3dyf s ARG 365 Ca 0.09 0.88 -0.03 0.00 -0.47 0.00 0.00 55.73 56.21 3dyf s ARG 365 Cb -0.02 -2.19 -0.08 0.00 -0.57 0.00 0.00 34.95 32.09 3dyf s ARG 365 CO 0.81 -0.20 -0.15 1.04 -1.08 0.00 0.00 175.30 175.72 3dyf n GLN 366 N -1.43 0.33 -0.70 3.89 1.13 -1.26 -5.14 117.38 114.21 3dyf n GLN 366 Ca 0.06 0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.22 3dyf n GLN 366 Cb 0.54 -1.16 0.00 0.00 0.11 0.00 0.00 30.24 29.73 3dyf n GLN 366 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25