#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dyf n PRO 2 N 0.00 -0.24 -0.18 0.03 -0.02 -1.26 -0.66 135.00 132.68 3dyf n PRO 2 Ca 0.00 1.41 -0.08 0.00 -2.02 0.00 0.00 63.50 62.81 3dyf n PRO 2 Cb 0.00 -2.09 0.02 0.00 -0.02 0.00 0.00 33.50 31.41 3dyf n PRO 2 CO 0.00 0.00 0.00 1.98 1.98 0.00 0.00 175.50 179.46 3dyf h MET 3 N 0.00 0.77 -0.47 -0.52 4.05 -2.00 -1.09 114.93 115.66 3dyf h MET 3 Ca 0.30 -0.13 -0.05 0.00 -0.28 0.00 0.00 59.70 59.54 3dyf h MET 3 Cb 0.53 -0.13 -0.02 0.00 -0.80 0.00 0.00 31.60 31.18 3dyf h MET 3 CO -0.91 0.66 0.07 1.96 0.23 0.00 0.00 176.91 178.93 3dyf h GLN 4 N 0.70 0.73 0.00 0.39 4.20 -1.34 0.11 115.11 119.91 3dyf h GLN 4 Ca 0.18 -0.16 -0.20 0.00 0.06 0.00 0.00 58.65 58.53 3dyf h GLN 4 Cb 0.16 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 3dyf h GLN 4 CO -0.02 0.69 -0.89 1.98 -0.67 0.00 0.00 178.83 179.93 3dyf h MET 5 N 0.70 0.24 -0.11 1.46 4.05 -0.71 -1.99 114.93 118.57 3dyf h MET 5 Ca 0.15 -0.26 -0.03 0.00 -0.28 0.00 0.00 59.70 59.28 3dyf h MET 5 Cb 0.32 0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 31.19 3dyf h MET 5 CO 0.00 0.98 -0.04 0.35 0.23 0.00 0.00 176.91 178.44 3dyf h PHE 6 N 0.14 0.24 0.00 1.39 3.57 -0.80 -2.47 116.94 119.01 3dyf h PHE 6 Ca -0.05 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.35 3dyf h PHE 6 Cb 1.52 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 40.19 3dyf h PHE 6 CO 0.04 0.54 -0.19 0.52 -2.23 0.00 0.00 178.31 176.99 3dyf h MET 7 N -0.13 0.00 0.19 1.11 2.86 -0.82 -1.86 114.93 116.29 3dyf h MET 7 Ca 0.03 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 3dyf h MET 7 Cb 0.47 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.14 3dyf h MET 7 CO 0.01 0.19 -0.09 0.37 1.06 0.00 0.00 176.91 178.45 3dyf h GLN 8 N 0.00 -0.25 -0.49 1.72 4.15 -1.11 -2.88 115.11 116.25 3dyf h GLN 8 Ca -0.00 0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.40 3dyf h GLN 8 Cb 0.39 0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 3dyf h GLN 8 CO 0.02 -0.07 0.14 0.28 -1.93 0.00 0.00 178.83 177.28 3dyf h VAL 9 N -0.38 1.20 -0.01 2.39 2.07 -1.04 -2.84 116.25 117.64 3dyf h VAL 9 Ca -0.03 -0.71 0.03 0.00 0.82 0.00 0.00 66.70 66.82 3dyf h VAL 9 Cb 0.30 0.68 -0.05 0.00 -1.52 0.00 0.00 31.29 30.69 3dyf h VAL 9 CO 0.04 0.26 -0.32 0.22 0.02 0.00 0.00 177.57 177.79 3dyf h TYR 10 N 0.71 -0.89 -0.57 1.57 3.20 -1.15 0.42 116.97 120.26 3dyf h TYR 10 Ca 0.16 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.09 3dyf h TYR 10 Cb 0.23 0.40 -0.03 0.00 1.54 0.00 0.00 36.73 38.87 3dyf h TYR 10 CO 0.01 -0.41 0.38 -0.44 -1.64 0.00 0.00 178.16 176.05 3dyf h ASP 11 N -0.47 0.58 -0.48 -2.11 3.32 -1.38 0.60 116.42 116.47 3dyf h ASP 11 Ca 0.06 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.00 3dyf h ASP 11 Cb 0.56 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 3dyf h ASP 11 CO -0.28 0.40 -0.13 -0.08 -1.72 0.00 0.00 179.24 177.44 3dyf h GLU 12 N 0.67 0.93 -0.32 3.56 4.81 -1.02 -0.68 114.58 122.55 3dyf h GLU 12 Ca 0.23 -0.36 -0.18 0.00 -0.13 0.00 0.00 59.36 58.91 3dyf h GLU 12 Cb 0.07 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.40 3dyf h GLU 12 CO -0.06 1.02 -0.51 0.82 -0.73 0.00 0.00 179.01 179.55 3dyf h ILE 13 N 0.78 1.27 0.00 2.32 2.04 0.13 -2.33 117.51 121.72 3dyf h ILE 13 Ca 0.12 -1.69 -0.04 0.00 1.00 0.00 0.00 64.86 64.25 3dyf h ILE 13 Cb 0.68 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.32 3dyf h ILE 13 CO 0.05 0.56 -0.21 -0.61 0.00 0.00 0.00 178.15 177.94 3dyf h GLN 14 N 0.70 0.00 0.00 2.37 4.15 0.25 -2.44 115.11 120.14 3dyf h GLN 14 Ca 0.03 0.00 -0.26 0.00 0.77 0.00 0.00 58.65 59.18 3dyf h GLN 14 Cb 1.11 0.00 0.02 0.00 0.21 0.00 0.00 27.48 28.82 3dyf h GLN 14 CO 0.12 0.21 -1.03 1.98 -1.93 0.00 0.00 178.83 178.17 3dyf h MET 15 N 0.00 0.65 0.11 1.69 4.05 -0.85 -2.57 114.93 118.01 3dyf h MET 15 Ca -0.00 -0.71 -0.01 0.00 -0.28 0.00 0.00 59.70 58.71 3dyf h MET 15 Cb 0.53 0.20 0.00 0.00 -0.80 0.00 0.00 31.60 31.54 3dyf h MET 15 CO 0.03 1.29 -0.05 0.35 0.23 0.00 0.00 176.91 178.76 3dyf h PHE 16 N 0.37 -0.13 0.65 1.39 3.57 -1.17 -2.54 116.94 119.08 3dyf h PHE 16 Ca -0.12 -0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.34 3dyf h PHE 16 Cb 1.68 0.04 0.00 0.00 2.79 0.00 0.00 35.95 40.47 3dyf h PHE 16 CO 0.10 0.27 -0.34 -0.07 -2.23 0.00 0.00 178.31 176.03 3dyf h LEU 17 N -0.57 -0.83 -2.07 0.59 3.38 -1.56 -0.12 115.31 114.12 3dyf h LEU 17 Ca -0.01 0.04 0.01 0.00 0.09 0.00 0.00 57.88 58.00 3dyf h LEU 17 Cb 0.46 0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.43 3dyf h LEU 17 CO 0.02 -0.56 0.03 -0.07 0.09 0.00 0.00 178.44 177.95 3dyf h LEU 18 N -0.92 0.00 0.15 1.67 3.38 -1.57 -2.15 115.31 115.87 3dyf h LEU 18 Ca -0.09 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.57 3dyf h LEU 18 Cb 0.72 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3dyf h LEU 18 CO 0.13 0.00 -1.51 -0.33 0.09 0.00 0.00 178.44 176.82 3dyf h GLU 19 N 0.00 0.32 -0.69 1.13 5.08 -1.30 -2.91 114.58 116.22 3dyf h GLU 19 Ca 0.02 -0.55 0.03 0.00 -1.00 0.00 0.00 59.36 57.86 3dyf h GLU 19 Cb 0.09 0.20 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 3dyf h GLU 19 CO -0.00 1.22 0.43 1.49 -1.00 0.00 0.00 179.01 181.14 3dyf h GLU 20 N 0.09 0.81 -0.42 2.33 4.81 -0.58 0.25 114.58 121.86 3dyf h GLU 20 Ca -0.24 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 3dyf h GLU 20 Cb 2.05 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 31.22 3dyf h GLU 20 CO 0.19 0.54 0.24 -0.07 -0.73 0.00 0.00 179.01 179.17 3dyf h LEU 21 N 0.84 0.53 0.24 1.64 3.38 -1.48 0.63 115.31 121.08 3dyf h LEU 21 Ca 0.28 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.16 3dyf h LEU 21 Cb 0.02 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3dyf h LEU 21 CO -0.11 0.46 -0.17 -0.08 0.09 0.00 0.00 178.44 178.63 3dyf h GLU 22 N 0.55 -0.39 0.04 1.13 4.57 -1.18 -0.16 114.58 119.14 3dyf h GLU 22 Ca 0.15 0.03 -0.10 0.00 -1.18 0.00 0.00 59.36 58.25 3dyf h GLU 22 Cb 0.05 0.09 0.01 0.00 -0.16 0.00 0.00 28.75 28.74 3dyf h GLU 22 CO -0.02 -0.26 -0.42 -0.07 -1.18 0.00 0.00 179.01 177.06 3dyf h LEU 23 N -0.40 0.30 0.00 1.64 4.07 -0.84 -3.30 115.31 116.77 3dyf h LEU 23 Ca -0.02 -0.86 0.00 0.00 0.08 0.00 0.00 57.88 57.08 3dyf h LEU 23 Cb 0.35 -0.10 0.00 0.00 1.08 0.00 0.00 40.66 41.99 3dyf h LEU 23 CO 0.00 1.13 -1.70 0.29 -1.08 0.00 0.00 178.44 177.09 3dyf n LYS 24 N -4.37 0.56 -0.65 1.13 5.02 0.22 -4.42 118.16 115.66 3dyf n LYS 24 Ca -0.11 -0.12 0.04 0.00 -2.02 0.00 0.00 58.31 56.10 3dyf n LYS 24 Cb 0.62 -1.56 0.27 0.00 -0.02 0.00 0.00 35.03 34.34 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 -2.22 1.34 -4.32 2.13 3.72 -0.10 -4.96 117.46 113.06 3dyf n PHE 25 Ca -0.02 -1.03 -0.36 0.00 -0.05 0.00 0.00 57.45 55.98 3dyf n PHE 25 Cb 0.53 -0.43 -0.06 0.00 -0.94 0.00 0.00 39.48 38.59 3dyf n PHE 25 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 3dyf n ASP 26 N -0.44 -1.74 -4.86 4.37 2.03 -1.14 -4.89 116.55 109.87 3dyf n ASP 26 Ca 0.27 -1.14 -0.35 0.00 0.52 0.00 0.00 54.79 54.10 3dyf n ASP 26 Cb 1.03 -2.20 -0.05 0.00 -0.72 0.00 0.00 41.12 39.18 3dyf n ASP 26 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 3dyf s MET 27 N -7.07 3.81 0.50 -0.67 1.75 -1.07 -5.04 119.30 111.51 3dyf s MET 27 Ca 0.57 0.25 -0.06 0.00 -1.25 0.00 0.00 55.69 55.20 3dyf s MET 27 Cb -0.32 -2.96 -0.03 0.00 2.84 0.00 0.00 34.83 34.36 3dyf s MET 27 CO 0.97 0.52 0.81 0.16 -0.65 0.00 0.00 175.02 176.84 3dyf s ASP 28 N -1.81 6.16 0.48 1.11 -4.77 -1.26 -4.62 116.67 111.96 3dyf s ASP 28 Ca 0.35 0.92 0.13 0.00 -3.30 0.00 0.00 52.55 50.65 3dyf s ASP 28 Cb -0.14 -2.18 1.11 0.00 -1.09 0.00 0.00 42.92 40.62 3dyf s ASP 28 CO 0.19 -0.66 2.11 -0.65 0.70 0.00 0.00 175.17 176.85 3dyf h PRO 29 N 0.14 0.18 0.02 2.11 0.11 -1.98 -2.22 132.00 130.36 3dyf h PRO 29 Ca -0.47 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 3dyf h PRO 29 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3dyf h PRO 29 CO 0.61 0.14 -0.01 -0.91 -0.21 0.00 0.00 178.00 177.62 3dyf h ASN 30 N 0.19 -0.03 0.94 -2.05 -0.26 -2.00 -1.20 115.58 111.18 3dyf h ASN 30 Ca 0.05 -0.25 0.00 0.00 -0.56 0.00 0.00 56.30 55.53 3dyf h ASN 30 Cb 0.01 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.27 3dyf h ASN 30 CO -0.01 0.24 0.00 0.54 -1.06 0.00 0.00 177.43 177.14 3dyf n ARG 31 N -4.98 0.22 0.07 0.81 1.74 -1.09 -2.18 116.66 111.26 3dyf n ARG 31 Ca -0.08 0.37 -0.14 0.00 -0.77 0.00 0.00 57.85 57.23 3dyf n ARG 31 Cb 0.16 -1.87 -0.14 0.00 -1.02 0.00 0.00 32.46 29.59 3dyf n ARG 31 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3dyf h VAL 32 N 0.00 1.38 -0.48 1.55 2.07 -1.15 -2.43 116.25 117.19 3dyf h VAL 32 Ca 0.00 -3.02 -0.10 0.00 0.82 0.00 0.00 66.70 64.40 3dyf h VAL 32 Cb 0.47 2.83 -0.02 0.00 -1.52 0.00 0.00 31.29 33.06 3dyf h VAL 32 CO 0.00 0.86 -0.09 -0.09 0.02 0.00 0.00 177.57 178.27 3dyf h ARG 33 N 0.05 0.87 0.38 1.57 2.43 -0.81 -1.75 114.38 117.12 3dyf h ARG 33 Ca -0.16 -0.29 -0.02 0.00 -0.81 0.00 0.00 59.98 58.71 3dyf h ARG 33 Cb 1.95 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 31.43 3dyf h ARG 33 CO 0.17 0.92 -0.18 -0.92 -1.51 0.00 0.00 179.97 178.45 3dyf h TYR 34 N 0.79 -0.48 -0.53 2.20 5.03 -1.46 -1.86 116.97 120.66 3dyf h TYR 34 Ca 0.13 -0.01 0.04 0.00 2.58 0.00 0.00 58.73 61.47 3dyf h TYR 34 Cb 0.59 0.16 -0.03 0.00 1.55 0.00 0.00 36.73 39.00 3dyf h TYR 34 CO 0.03 -0.17 0.35 -0.07 -1.32 0.00 0.00 178.16 176.99 3dyf h LEU 35 N -0.76 0.50 -0.45 2.82 3.38 -1.42 0.49 115.31 119.87 3dyf h LEU 35 Ca -0.05 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.85 3dyf h LEU 35 Cb 0.52 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 3dyf h LEU 35 CO 0.09 0.34 0.03 -0.09 0.09 0.00 0.00 178.44 178.89 3dyf h ARG 36 N 0.57 0.78 -0.52 1.13 2.43 -1.22 0.15 114.38 117.70 3dyf h ARG 36 Ca 0.22 -0.23 -0.09 0.00 -0.81 0.00 0.00 59.98 59.07 3dyf h ARG 36 Cb 0.16 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 3dyf h ARG 36 CO -0.06 0.82 -0.03 -0.22 -1.51 0.00 0.00 179.97 178.97 3dyf h LYS 37 N 0.63 0.93 -0.74 0.20 1.63 -0.34 -1.10 116.57 117.78 3dyf h LYS 37 Ca 0.13 -0.31 -0.06 0.00 -0.85 0.00 0.00 60.65 59.56 3dyf h LYS 37 Cb 0.45 -0.08 -0.03 0.00 -0.60 0.00 0.00 32.23 31.97 3dyf h LYS 37 CO 0.02 0.97 0.24 1.98 -3.45 0.00 0.00 179.45 179.20 3dyf h MET 38 N 0.80 1.14 0.04 1.90 4.05 0.14 -0.97 114.93 122.02 3dyf h MET 38 Ca 0.14 -0.24 -0.00 0.00 -0.28 0.00 0.00 59.70 59.32 3dyf h MET 38 Cb 0.57 -0.17 0.00 0.00 -0.80 0.00 0.00 31.60 31.20 3dyf h MET 38 CO 0.03 0.97 -0.02 1.98 0.23 0.00 0.00 176.91 180.10 3dyf h MET 39 N 1.10 -0.05 -0.51 0.39 1.85 -0.47 -0.83 114.93 116.41 3dyf h MET 39 Ca 0.24 0.00 -0.02 0.00 -0.61 0.00 0.00 59.70 59.31 3dyf h MET 39 Cb 0.30 0.01 -0.03 0.00 0.43 0.00 0.00 31.60 32.31 3dyf h MET 39 CO -0.01 0.25 0.24 -0.44 -0.40 0.00 0.00 176.91 176.55 3dyf h ASP 40 N -0.35 0.64 -0.02 1.39 3.32 -1.10 0.25 116.42 120.56 3dyf h ASP 40 Ca -0.00 -0.06 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 3dyf h ASP 40 Cb 0.32 -0.16 0.01 0.00 0.22 0.00 0.00 39.33 39.71 3dyf h ASP 40 CO 0.01 0.55 -0.29 0.74 -1.72 0.00 0.00 179.24 178.53 3dyf h THR 41 N 0.72 1.50 0.00 0.35 2.02 -1.11 -2.40 112.91 113.99 3dyf h THR 41 Ca 0.18 -1.88 -0.09 0.00 0.77 0.00 0.00 66.41 65.39 3dyf h THR 41 Cb 0.09 2.63 -0.01 0.00 -1.74 0.00 0.00 68.15 69.11 3dyf h THR 41 CO -0.02 0.52 -0.44 0.71 0.37 0.00 0.00 175.52 176.66 3dyf h THR 42 N -0.38 0.80 0.00 3.16 1.35 -1.09 -3.35 112.91 113.40 3dyf h THR 42 Ca -0.03 -1.96 0.00 0.00 -0.55 0.00 0.00 66.41 63.87 3dyf h THR 42 Cb 1.01 2.27 0.00 0.00 -1.73 0.00 0.00 68.15 69.70 3dyf h THR 42 CO 0.06 0.43 -1.71 0.00 -0.25 0.00 0.00 175.52 174.04 3dyf s LEU 44 N -4.10 3.38 0.00 0.00 1.43 -0.90 -4.64 118.68 113.85 3dyf s LEU 44 Ca -0.05 -0.74 0.00 0.00 -1.03 0.00 0.00 54.13 52.31 3dyf s LEU 44 Cb 0.12 -1.95 0.00 0.00 0.03 0.00 0.00 46.19 44.39 3dyf s LEU 44 CO 0.77 -0.50 0.00 0.61 0.23 0.00 0.00 176.35 177.46 3dyf n GLY 45 N -1.39 1.24 0.00 -3.19 0.00 -1.26 -4.81 105.19 95.78 3dyf n GLY 45 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.04 0.05 -0.02 0.00 -1.26 -4.91 105.19 96.01 3dyf n GLY 46 Ca 0.00 -1.66 0.12 0.00 0.00 0.00 0.00 46.02 44.48 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 -0.74 0.28 -1.85 1.61 5.02 -1.26 -4.96 118.16 116.27 3dyf n LYS 47 Ca 0.00 0.05 -0.19 0.00 -2.02 0.00 0.00 58.31 56.14 3dyf n LYS 47 Cb 0.00 -1.64 -0.06 0.00 -0.02 0.00 0.00 35.03 33.31 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 -2.04 -0.32 0.11 2.13 4.01 -1.26 -4.90 117.16 114.88 3dyf n TYR 48 Ca 0.03 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.63 3dyf n TYR 48 Cb 0.44 -3.45 -0.08 0.00 -0.31 0.00 0.00 39.34 35.94 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 -0.18 -0.36 7.72 -0.26 -1.98 -0.20 115.58 120.32 3dyf h ASN 49 Ca -0.42 -0.07 0.04 0.00 -0.56 0.00 0.00 56.30 55.29 3dyf h ASN 49 Cb 1.29 0.05 -0.04 0.00 -1.06 0.00 0.00 38.32 38.56 3dyf h ASN 49 CO 0.57 -0.05 0.13 0.03 -1.06 0.00 0.00 177.43 177.05 3dyf h ARG 50 N -0.30 0.28 0.45 0.81 3.08 -1.91 -0.97 114.38 115.82 3dyf h ARG 50 Ca -0.02 -0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.99 3dyf h ARG 50 Cb 0.23 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.23 3dyf h ARG 50 CO 0.04 0.18 -0.22 0.78 -1.07 0.00 0.00 179.97 179.68 3dyf h GLY 51 N 0.28 -0.64 2.00 0.04 0.00 -1.72 -3.00 103.07 100.04 3dyf h GLY 51 Ca 0.16 0.24 -0.00 0.00 0.00 0.00 0.00 47.33 47.72 3dyf h GLY 51 CO -0.16 -0.23 -0.01 1.41 0.00 0.00 0.00 176.54 177.55 3dyf h LEU 52 N -0.80 0.00 -0.61 3.11 3.38 -0.98 -1.78 115.31 117.62 3dyf h LEU 52 Ca -0.06 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.79 3dyf h LEU 52 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3dyf h LEU 52 CO 0.10 0.01 -0.21 0.74 0.09 0.00 0.00 178.44 179.17 3dyf h THR 53 N 0.00 1.27 0.08 0.22 2.02 -1.03 -0.39 112.91 115.09 3dyf h THR 53 Ca -0.00 -1.35 0.00 0.00 0.77 0.00 0.00 66.41 65.84 3dyf h THR 53 Cb 0.09 1.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 3dyf h THR 53 CO 0.00 0.46 -0.08 0.58 0.37 0.00 0.00 175.52 176.85 3dyf h VAL 54 N 0.76 0.83 0.26 3.16 2.07 -1.28 -0.82 116.25 121.23 3dyf h VAL 54 Ca 0.10 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.62 3dyf h VAL 54 Cb 0.75 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 3dyf h VAL 54 CO 0.06 0.00 -0.19 0.40 0.02 0.00 0.00 177.57 177.86 3dyf h ILE 55 N -0.17 0.60 -0.37 4.57 2.04 -1.53 0.37 117.51 123.02 3dyf h ILE 55 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 3dyf h ILE 55 Cb 0.17 0.60 -0.08 0.00 -0.74 0.00 0.00 36.82 36.76 3dyf h ILE 55 CO -0.02 0.00 -0.16 -0.78 0.00 0.00 0.00 178.15 177.19 3dyf h ASP 56 N -0.45 -0.55 0.46 1.72 3.58 -0.93 0.32 116.42 120.57 3dyf h ASP 56 Ca -0.02 0.14 -0.01 0.00 0.42 0.00 0.00 57.03 57.56 3dyf h ASP 56 Cb 0.39 0.31 -0.01 0.00 1.72 0.00 0.00 39.33 41.74 3dyf h ASP 56 CO 0.00 -0.20 -0.35 0.58 -2.88 0.00 0.00 179.24 176.40 3dyf h VAL 57 N -0.09 0.29 -0.85 2.25 2.07 -0.96 -0.33 116.25 118.64 3dyf h VAL 57 Ca 0.18 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.89 3dyf h VAL 57 Cb 0.37 0.29 -0.16 0.00 -1.52 0.00 0.00 31.29 30.28 3dyf h VAL 57 CO -0.43 0.00 -0.14 0.00 0.02 0.00 0.00 177.57 177.02 3dyf h ALA 58 N -0.37 0.68 0.30 1.67 0.00 -0.16 -1.72 119.26 119.66 3dyf h ALA 58 Ca -0.05 0.31 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 3dyf h ALA 58 Cb 0.68 0.59 0.00 0.00 0.00 0.00 0.00 17.79 19.06 3dyf h ALA 58 CO 0.01 -0.43 -0.14 1.49 0.00 0.00 0.00 179.25 180.18 3dyf h GLU 59 N 0.02 -0.38 -1.66 0.00 4.81 -0.58 -2.71 114.58 114.07 3dyf h GLU 59 Ca 0.43 0.03 0.50 0.00 -0.13 0.00 0.00 59.36 60.18 3dyf h GLU 59 Cb 0.72 0.09 -0.09 0.00 0.63 0.00 0.00 28.75 30.10 3dyf h GLU 59 CO -0.84 -0.07 1.17 0.77 -0.73 0.00 0.00 179.01 179.32 3dyf h SER 60 N -0.74 0.06 0.70 1.04 0.02 -0.18 1.49 113.55 115.95 3dyf h SER 60 Ca -0.04 0.03 -0.26 0.00 -0.84 0.00 0.00 61.79 60.68 3dyf h SER 60 Cb 0.50 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.05 3dyf h SER 60 CO 0.07 -0.04 -1.26 -0.07 -1.14 0.00 0.00 176.83 174.38 3dyf h LEU 61 N 0.02 0.25 -8.22 5.07 -0.00 -1.23 -3.44 115.31 107.76 3dyf h LEU 61 Ca 0.84 -0.29 -0.24 0.00 -0.00 0.00 0.00 57.88 58.19 3dyf h LEU 61 Cb 3.19 -0.08 -0.05 0.00 -0.00 0.00 0.00 40.66 43.72 3dyf h LEU 61 CO -0.11 1.23 1.10 0.18 -0.00 0.00 0.00 178.44 180.84 3dyf n LEU 62 N -3.42 0.59 0.00 1.67 4.32 0.51 -2.90 117.00 117.78 3dyf n LEU 62 Ca -0.08 -0.87 0.00 0.00 -0.02 0.00 0.00 56.01 55.04 3dyf n LEU 62 Cb 1.00 -1.19 0.00 0.00 -1.62 0.00 0.00 43.42 41.61 3dyf n LEU 62 CO 0.50 -1.89 0.00 -1.54 -1.22 0.00 0.00 177.39 173.24 3dyf n SER 63 N 13.00 0.00 0.00 -1.43 3.41 -1.26 -5.02 113.62 122.32 3dyf n SER 63 Ca 0.55 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 3dyf n SER 63 Cb 0.30 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 3dyf n SER 63 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3dyf n LEU 64 N 0.00 0.00 0.00 1.04 7.94 -1.14 -5.11 117.00 119.73 3dyf n LEU 64 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 3dyf n LEU 64 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 3dyf n LEU 64 CO 0.00 0.00 0.00 -0.90 -1.11 0.00 0.00 177.39 175.38 3dyf n ASP 74 N -1.21 0.00 0.14 1.96 5.75 -1.26 -5.23 116.55 116.69 3dyf n ASP 74 Ca 0.00 0.00 0.02 0.00 -0.01 0.00 0.00 54.79 54.80 3dyf n ASP 74 Cb 0.12 0.00 0.05 0.00 -1.03 0.00 0.00 41.12 40.27 3dyf n ASP 74 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 3dyf h GLY 75 N 0.00 0.00 0.74 6.12 0.00 -2.05 -2.16 103.07 105.72 3dyf h GLY 75 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 47.33 47.11 3dyf h GLY 75 CO 0.00 0.00 -0.97 0.00 0.00 0.00 0.00 176.54 175.57 3dyf h ALA 76 N 1.48 -0.07 0.33 3.60 0.00 -2.05 -3.03 119.26 119.52 3dyf h ALA 76 Ca -0.01 -0.76 -0.00 0.00 0.00 0.00 0.00 54.91 54.14 3dyf h ALA 76 Cb 1.35 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.27 3dyf h ALA 76 CO 0.07 0.47 -0.46 0.00 0.00 0.00 0.00 179.25 179.33 3dyf h ARG 77 N -0.30 -0.81 -0.93 0.00 2.47 -1.99 -0.46 114.38 112.37 3dyf h ARG 77 Ca -0.18 0.06 0.26 0.00 -1.26 0.00 0.00 59.98 58.86 3dyf h ARG 77 Cb 1.72 0.18 -0.14 0.00 -1.65 0.00 0.00 29.97 30.09 3dyf h ARG 77 CO 0.16 -0.54 0.39 -0.09 0.56 0.00 0.00 179.97 180.45 3dyf h ARG 78 N -0.84 0.30 0.00 0.04 2.43 -1.51 0.65 114.38 115.46 3dyf h ARG 78 Ca -0.03 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.05 3dyf h ARG 78 Cb 0.77 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 3dyf h ARG 78 CO -0.14 0.20 -0.38 -0.22 -1.51 0.00 0.00 179.97 177.92 3dyf h LYS 79 N 0.31 0.00 0.05 0.20 3.64 -1.15 -1.76 116.57 117.86 3dyf h LYS 79 Ca 0.61 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.78 3dyf h LYS 79 Cb 1.27 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.07 3dyf h LYS 79 CO -0.60 0.38 -1.11 -0.09 -2.27 0.00 0.00 179.45 175.77 3dyf h ARG 80 N 0.00 0.10 -0.66 1.90 1.12 0.16 -2.98 114.38 114.03 3dyf h ARG 80 Ca -0.00 -0.17 0.05 0.00 -1.11 0.00 0.00 59.98 58.75 3dyf h ARG 80 Cb 0.74 0.06 -0.05 0.00 -0.01 0.00 0.00 29.97 30.71 3dyf h ARG 80 CO 0.05 1.08 0.37 0.28 -3.11 0.00 0.00 179.97 178.64 3dyf h VAL 81 N -0.71 0.99 -0.22 0.20 2.07 -0.14 0.93 116.25 119.37 3dyf h VAL 81 Ca -0.27 -0.24 -0.05 0.00 0.82 0.00 0.00 66.70 66.96 3dyf h VAL 81 Cb 1.44 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.43 3dyf h VAL 81 CO -0.06 0.13 -0.10 -0.07 0.02 0.00 0.00 177.57 177.49 3dyf h LEU 82 N 0.70 0.34 -0.00 2.57 3.38 -1.46 -1.24 115.31 119.59 3dyf h LEU 82 Ca 0.29 -0.07 -0.27 0.00 0.09 0.00 0.00 57.88 57.92 3dyf h LEU 82 Cb 0.15 -0.09 0.02 0.00 0.09 0.00 0.00 40.66 40.83 3dyf h LEU 82 CO -0.16 0.48 -1.06 -0.74 0.09 0.00 0.00 178.44 177.04 3dyf h HIS 83 N 0.34 1.00 -0.34 1.13 2.76 -1.09 -2.78 115.15 116.18 3dyf h HIS 83 Ca 0.07 -0.56 -0.06 0.00 -2.20 0.00 0.00 60.37 57.63 3dyf h HIS 83 Cb 0.39 -0.11 -0.02 0.00 1.55 0.00 0.00 27.41 29.22 3dyf h HIS 83 CO 0.01 1.39 -0.03 -0.44 -1.30 0.00 0.00 177.93 177.56 3dyf h ASP 84 N 0.37 0.51 -0.40 3.26 3.32 -0.65 -1.71 116.42 121.11 3dyf h ASP 84 Ca -0.13 -0.10 -0.06 0.00 0.02 0.00 0.00 57.03 56.75 3dyf h ASP 84 Cb 1.72 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 41.11 3dyf h ASP 84 CO 0.21 0.60 0.04 0.00 -1.72 0.00 0.00 179.24 178.36 3dyf h ALA 85 N 1.47 1.17 -0.49 3.45 0.00 -1.19 -1.44 119.26 122.22 3dyf h ALA 85 Ca 0.11 -0.24 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 3dyf h ALA 85 Cb 0.37 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 3dyf h ALA 85 CO 0.02 0.55 -0.05 0.00 0.00 0.00 0.00 179.25 179.76 3dyf h VAL 87 N 0.76 1.08 0.00 0.00 2.07 -1.03 -1.88 116.25 117.24 3dyf h VAL 87 Ca 0.13 -0.51 -0.01 0.00 0.82 0.00 0.00 66.70 67.13 3dyf h VAL 87 Cb 0.58 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3dyf h VAL 87 CO 0.03 0.13 -0.06 0.00 0.02 0.00 0.00 177.57 177.69 3dyf h GLY 89 N 0.25 0.98 1.81 0.00 0.00 -0.10 -2.76 103.07 103.25 3dyf h GLY 89 Ca -0.00 -0.54 -0.21 0.00 0.00 0.00 0.00 47.33 46.58 3dyf h GLY 89 CO 0.01 0.50 -0.97 1.49 0.00 0.00 0.00 176.54 177.58 3dyf h TRP 90 N 0.85 0.25 -0.99 5.60 4.06 -0.52 -2.55 115.95 122.64 3dyf h TRP 90 Ca 0.20 -0.15 0.14 0.00 2.06 0.00 0.00 58.89 61.14 3dyf h TRP 90 Cb 0.21 -0.02 -0.09 0.00 -1.00 0.00 0.00 29.16 28.26 3dyf h TRP 90 CO 0.01 1.03 0.62 0.52 -3.56 0.00 0.00 178.44 177.06 3dyf h MET 91 N 0.07 0.89 -0.05 0.49 2.86 -0.98 0.98 114.93 119.19 3dyf h MET 91 Ca -0.05 -0.05 -0.25 0.00 -2.06 0.00 0.00 59.70 57.28 3dyf h MET 91 Cb 1.64 -0.20 0.02 0.00 0.06 0.00 0.00 31.60 33.12 3dyf h MET 91 CO 0.14 0.59 -0.95 0.82 1.06 0.00 0.00 176.91 178.57 3dyf h ILE 92 N 0.92 1.28 -0.68 -1.22 2.04 -1.44 -1.54 117.51 116.86 3dyf h ILE 92 Ca 0.51 -2.15 -0.07 0.00 1.00 0.00 0.00 64.86 64.15 3dyf h ILE 92 Cb 0.60 2.25 -0.03 0.00 -0.74 0.00 0.00 36.82 38.91 3dyf h ILE 92 CO -0.28 0.67 0.16 -0.33 0.00 0.00 0.00 178.15 178.37 3dyf h GLU 93 N 0.43 1.07 -0.01 2.37 4.39 -0.77 0.26 114.58 122.33 3dyf h GLU 93 Ca -0.10 -0.25 -0.11 0.00 0.34 0.00 0.00 59.36 59.23 3dyf h GLU 93 Cb 1.60 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 30.09 3dyf h GLU 93 CO 0.19 0.95 -0.52 0.74 -1.16 0.00 0.00 179.01 179.21 3dyf h PHE 94 N 1.02 0.04 0.01 4.33 0.04 0.95 0.77 116.94 124.11 3dyf h PHE 94 Ca 0.21 -0.01 -0.21 0.00 2.80 0.00 0.00 57.97 60.75 3dyf h PHE 94 Cb 0.36 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.50 3dyf h PHE 94 CO 0.03 0.54 -0.93 1.25 -0.60 0.00 0.00 178.31 178.60 3dyf h LEU 95 N 0.03 0.38 -0.66 1.54 5.85 -0.69 -0.98 115.31 120.79 3dyf h LEU 95 Ca -0.00 -0.32 -0.12 0.00 0.84 0.00 0.00 57.88 58.28 3dyf h LEU 95 Cb 0.92 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 3dyf h LEU 95 CO 0.07 1.13 -0.24 -0.61 -0.34 0.00 0.00 178.44 178.45 3dyf h GLN 96 N 0.16 0.79 -0.51 1.25 5.75 -0.20 -2.23 115.11 120.12 3dyf h GLN 96 Ca -0.06 -0.33 -0.11 0.00 -0.15 0.00 0.00 58.65 57.99 3dyf h GLN 96 Cb 1.57 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 30.07 3dyf h GLN 96 CO 0.15 0.95 -0.12 0.00 -2.65 0.00 0.00 178.83 177.16 3dyf h ALA 97 N 1.04 0.70 -0.45 3.38 0.00 -0.69 -1.23 119.26 122.01 3dyf h ALA 97 Ca 0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 3dyf h ALA 97 Cb 0.76 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3dyf h ALA 97 CO 0.06 0.63 0.25 1.25 0.00 0.00 0.00 179.25 181.43 3dyf h HIS 98 N 0.85 0.62 0.00 0.00 -0.00 -0.94 -1.96 115.15 113.72 3dyf h HIS 98 Ca 0.13 -0.02 -0.12 0.00 -0.00 0.00 0.00 60.37 60.36 3dyf h HIS 98 Cb 0.69 -0.20 -0.02 0.00 -0.00 0.00 0.00 27.41 27.88 3dyf h HIS 98 CO 0.05 0.47 -0.59 1.88 -0.00 0.00 0.00 177.93 179.74 3dyf h TYR 99 N 0.59 0.00 -0.15 5.26 0.05 -1.32 -2.80 116.97 118.59 3dyf h TYR 99 Ca 0.16 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.75 3dyf h TYR 99 Cb 0.05 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.79 3dyf h TYR 99 CO -0.02 0.59 -0.68 -0.07 -1.05 0.00 0.00 178.16 176.93 3dyf h LEU 100 N 0.00 0.72 0.28 3.88 4.07 -1.02 0.96 115.31 124.19 3dyf h LEU 100 Ca -0.01 -0.44 -0.01 0.00 0.08 0.00 0.00 57.88 57.50 3dyf h LEU 100 Cb 1.13 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 42.67 3dyf h LEU 100 CO 0.08 1.20 -0.13 0.58 -1.08 0.00 0.00 178.44 179.08 3dyf h VAL 101 N 0.44 0.77 -0.83 1.22 2.07 -1.33 -1.13 116.25 117.45 3dyf h VAL 101 Ca -0.02 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 3dyf h VAL 101 Cb 1.26 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 32.00 3dyf h VAL 101 CO 0.13 0.09 0.43 -0.33 0.02 0.00 0.00 177.57 177.91 3dyf h GLU 102 N -0.60 1.19 -0.36 1.57 4.39 -1.52 -3.01 114.58 116.24 3dyf h GLU 102 Ca -0.04 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.45 3dyf h GLU 102 Cb 0.43 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 3dyf h GLU 102 CO 0.06 0.89 0.03 0.22 -1.16 0.00 0.00 179.01 179.06 3dyf h ASP 103 N 1.18 0.59 -0.20 1.42 1.82 -0.77 -1.34 116.42 119.12 3dyf h ASP 103 Ca 0.29 -0.28 0.06 0.00 -0.39 0.00 0.00 57.03 56.70 3dyf h ASP 103 Cb 0.08 -0.16 -0.01 0.00 0.68 0.00 0.00 39.33 39.92 3dyf h ASP 103 CO -0.04 0.73 0.22 0.44 -1.61 0.00 0.00 179.24 178.97 3dyf h ASP 104 N 0.43 0.00 0.00 2.28 3.32 -1.08 0.56 116.42 121.93 3dyf h ASP 104 Ca 0.10 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 3dyf h ASP 104 Cb 0.41 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 3dyf h ASP 104 CO 0.01 0.00 -0.10 0.40 -1.72 0.00 0.00 179.24 177.83 3dyf h ILE 105 N 0.00 1.31 -0.77 0.35 2.04 -1.35 -1.51 117.51 117.58 3dyf h ILE 105 Ca 0.09 -2.02 0.08 0.00 1.00 0.00 0.00 64.86 64.01 3dyf h ILE 105 Cb 0.53 2.52 -0.05 0.00 -0.74 0.00 0.00 36.82 39.08 3dyf h ILE 105 CO -0.00 0.45 0.50 0.24 0.00 0.00 0.00 178.15 179.34 3dyf h MET 106 N -1.00 0.75 -0.01 2.37 2.86 -0.24 -1.64 114.93 118.01 3dyf h MET 106 Ca -0.03 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.57 3dyf h MET 106 Cb 0.80 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.29 3dyf h MET 106 CO -0.02 0.50 -0.14 -0.25 1.06 0.00 0.00 176.91 178.06 3dyf n ASP 107 N -4.49 1.58 -2.13 1.22 8.00 0.19 -4.95 116.55 115.96 3dyf n ASP 107 Ca 0.12 -1.35 -0.19 0.00 0.71 0.00 0.00 54.79 54.07 3dyf n ASP 107 Cb 0.26 0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 41.42 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 0.01 -5.44 -4.51 -2.24 5.15 -0.62 -4.95 115.26 102.66 3dyf n ASN 108 Ca 0.15 0.17 -0.28 0.00 -0.60 0.00 0.00 54.58 54.02 3dyf n ASN 108 Cb 0.39 -4.63 0.24 0.00 -0.53 0.00 0.00 39.78 35.25 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 -2.24 1.22 -0.04 1.20 0.01 -0.62 -5.02 113.70 108.22 3dyf s SER 109 Ca 0.00 1.37 0.02 0.00 1.31 0.00 0.00 55.95 58.65 3dyf s SER 109 Cb 0.00 -2.14 -0.03 0.00 0.21 0.00 0.00 66.02 64.06 3dyf s SER 109 CO 0.00 -4.03 -0.01 0.52 0.41 0.00 0.00 173.24 170.13 3dyf n VAL 110 N -4.79 0.23 -4.27 3.43 0.31 -1.26 -4.85 118.33 107.13 3dyf n VAL 110 Ca 0.03 -0.11 -0.15 0.00 -0.01 0.00 0.00 64.34 64.10 3dyf n VAL 110 Cb 0.55 -0.77 -0.10 0.00 -0.91 0.00 0.00 33.84 32.61 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 -2.08 1.25 -0.19 2.52 -4.23 -1.26 -1.16 115.64 110.49 3dyf s THR 111 Ca -0.04 -2.08 -0.09 0.00 -1.18 0.00 0.00 61.69 58.30 3dyf s THR 111 Cb 0.01 -1.89 0.07 0.00 1.34 0.00 0.00 72.50 72.04 3dyf s THR 111 CO 0.11 -0.72 0.43 -0.60 -0.54 0.00 0.00 174.62 173.30 3dyf s ARG 112 N -3.73 0.38 -1.47 3.99 6.06 0.45 -4.14 118.95 120.49 3dyf s ARG 112 Ca 0.18 0.90 -0.06 0.00 -2.50 0.00 0.00 55.73 54.25 3dyf s ARG 112 Cb 0.02 0.12 0.05 0.00 0.06 0.00 0.00 34.95 35.20 3dyf s ARG 112 CO 0.02 -0.19 0.63 0.54 -2.50 0.00 0.00 175.30 173.79 3dyf n ARG 113 N 4.69 -3.89 0.00 5.12 1.74 -0.74 -1.31 116.66 122.27 3dyf n ARG 113 Ca -0.18 0.46 0.00 0.00 -0.77 0.00 0.00 57.85 57.37 3dyf n ARG 113 Cb 0.53 -4.90 0.00 0.00 -1.02 0.00 0.00 32.46 27.07 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 -1.75 2.81 3.76 -0.13 0.00 -0.01 -5.00 105.19 104.86 3dyf n GLY 114 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 3dyf n GLY 114 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dyf s LYS 115 N -0.28 2.17 0.56 1.61 3.01 -0.43 -5.07 119.74 121.31 3dyf s LYS 115 Ca 0.00 -2.27 -0.17 0.00 -1.01 0.00 0.00 55.97 52.52 3dyf s LYS 115 Cb 0.00 -1.66 -0.05 0.00 -1.01 0.00 0.00 37.83 35.11 3dyf s LYS 115 CO 0.00 -0.34 1.06 -1.25 0.51 0.00 0.00 175.35 175.33 3dyf s PRO 116 N -3.91 3.46 0.68 -1.68 0.04 -1.26 0.17 135.00 132.49 3dyf s PRO 116 Ca 0.16 1.28 -0.17 0.00 0.04 0.00 0.00 61.00 62.31 3dyf s PRO 116 Cb 0.02 -2.05 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 3dyf s PRO 116 CO 0.09 -0.71 0.65 0.00 0.04 0.00 0.00 177.00 177.07 3dyf h TRP 118 N -0.15 -0.56 0.00 0.00 2.91 -1.92 0.20 115.95 116.43 3dyf h TRP 118 Ca -0.46 0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.60 3dyf h TRP 118 Cb 1.36 0.30 0.00 0.00 -0.51 0.00 0.00 29.16 30.31 3dyf h TRP 118 CO 0.35 -0.29 0.00 2.48 -1.03 0.00 0.00 178.44 179.95 3dyf n TYR 119 N -5.37 0.00 -0.08 2.65 4.11 -1.26 -1.35 117.16 115.86 3dyf n TYR 119 Ca 0.01 0.00 0.04 0.00 -0.00 0.00 0.00 57.90 57.95 3dyf n TYR 119 Cb 0.29 -0.10 0.11 0.00 -0.00 0.00 0.00 39.34 39.64 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 -1.10 2.57 -2.48 -3.48 1.74 0.69 -4.35 116.66 110.26 3dyf n ARG 120 Ca 0.05 -1.83 -0.36 0.00 -0.77 0.00 0.00 57.85 54.94 3dyf n ARG 120 Cb 0.04 -1.21 -0.03 0.00 -1.02 0.00 0.00 32.46 30.24 3dyf n ARG 120 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3dyf s HIS 121 N -0.97 3.10 0.21 -1.55 3.76 -0.46 -4.83 115.29 114.55 3dyf s HIS 121 Ca 0.18 1.60 -0.16 0.00 -0.15 0.00 0.00 55.06 56.52 3dyf s HIS 121 Cb 0.09 -3.16 0.20 0.00 1.11 0.00 0.00 32.58 30.83 3dyf s HIS 121 CO 0.13 -0.88 1.60 -1.35 -0.85 0.00 0.00 174.74 173.39 3dyf h PRO 122 N 2.12 -0.08 -0.64 8.40 0.11 -1.94 -2.09 132.00 137.89 3dyf h PRO 122 Ca -0.49 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3dyf h PRO 122 Cb 1.22 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.35 3dyf h PRO 122 CO 0.61 -0.05 0.00 -3.47 -0.21 0.00 0.00 178.00 174.88 3dyf n ASP 123 N -5.45 4.01 -4.28 -2.05 -0.08 -1.26 -4.80 116.55 102.63 3dyf n ASP 123 Ca 0.07 -2.29 -0.37 0.00 -1.51 0.00 0.00 54.79 50.69 3dyf n ASP 123 Cb 0.36 -0.51 -0.13 0.00 2.34 0.00 0.00 41.12 43.18 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 -1.65 3.71 0.43 5.18 1.01 -0.79 -5.08 120.40 123.21 3dyf s VAL 124 Ca 0.44 -1.01 -0.20 0.00 0.00 0.00 0.00 61.98 61.21 3dyf s VAL 124 Cb 0.27 -3.03 -0.10 0.00 0.00 0.00 0.00 36.38 33.52 3dyf s VAL 124 CO 0.23 -0.07 0.94 0.42 0.00 0.00 0.00 175.10 176.62 3dyf s THR 125 N 1.41 4.43 0.34 3.92 -4.23 -1.26 -4.37 115.64 115.87 3dyf s THR 125 Ca -0.01 1.42 0.07 0.00 -1.18 0.00 0.00 61.69 61.99 3dyf s THR 125 Cb -0.19 -3.62 0.31 0.00 1.34 0.00 0.00 72.50 70.35 3dyf s THR 125 CO 0.02 -0.36 1.87 1.62 -0.54 0.00 0.00 174.62 177.23 3dyf h VAL 126 N 1.78 0.87 -0.01 2.29 3.04 -1.96 -0.35 116.25 121.92 3dyf h VAL 126 Ca -0.49 -0.27 -0.17 0.00 -1.01 0.00 0.00 66.70 64.77 3dyf h VAL 126 Cb 1.18 0.03 -0.02 0.00 -2.01 0.00 0.00 31.29 30.47 3dyf h VAL 126 CO 0.61 0.14 -0.79 0.06 -1.01 0.00 0.00 177.57 176.59 3dyf h GLN 127 N 0.78 0.09 -0.17 4.17 -0.00 -1.95 -2.93 115.11 115.10 3dyf h GLN 127 Ca 0.45 -0.09 -0.18 0.00 -0.00 0.00 0.00 58.65 58.84 3dyf h GLN 127 Cb 0.62 0.02 0.01 0.00 -0.00 0.00 0.00 27.48 28.13 3dyf h GLN 127 CO -0.21 0.83 -0.58 0.00 -0.00 0.00 0.00 178.83 178.86 3dyf h ALA 129 N 0.55 1.73 -0.41 0.00 0.00 -1.09 0.46 119.26 120.50 3dyf h ALA 129 Ca -0.03 0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3dyf h ALA 129 Cb 1.21 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 3dyf h ALA 129 CO 0.12 -0.00 0.24 0.82 0.00 0.00 0.00 179.25 180.43 3dyf h ILE 130 N 0.78 1.03 -0.19 0.00 2.04 -1.37 -0.83 117.51 118.97 3dyf h ILE 130 Ca 0.49 -0.17 -0.21 0.00 1.00 0.00 0.00 64.86 65.97 3dyf h ILE 130 Cb 0.71 0.51 0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3dyf h ILE 130 CO -0.25 0.09 -0.72 -1.13 0.00 0.00 0.00 178.15 176.14 3dyf h ASN 131 N 0.48 0.95 -0.82 1.72 -1.24 -0.93 -2.75 115.58 112.99 3dyf h ASN 131 Ca 0.17 -0.59 0.15 0.00 0.71 0.00 0.00 56.30 56.73 3dyf h ASN 131 Cb 0.02 -0.28 -0.06 0.00 0.73 0.00 0.00 38.32 38.73 3dyf h ASN 131 CO -0.08 1.39 0.54 0.44 -1.29 0.00 0.00 177.43 178.43 3dyf h ASP 132 N 0.58 0.50 -0.73 1.15 3.32 0.08 0.66 116.42 121.98 3dyf h ASP 132 Ca -0.03 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 3dyf h ASP 132 Cb 1.34 -0.07 -0.03 0.00 0.22 0.00 0.00 39.33 40.79 3dyf h ASP 132 CO 0.15 0.25 0.25 1.23 -1.72 0.00 0.00 179.24 179.40 3dyf h GLY 133 N 0.53 1.21 0.99 2.75 0.00 -0.88 -1.69 103.07 105.98 3dyf h GLY 133 Ca 0.41 -0.70 -0.03 0.00 0.00 0.00 0.00 47.33 47.01 3dyf h GLY 133 CO -0.16 0.66 0.26 1.41 0.00 0.00 0.00 176.54 178.72 3dyf h LEU 134 N 1.07 0.80 -1.18 3.11 3.38 0.46 -2.08 115.31 120.88 3dyf h LEU 134 Ca 0.24 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.12 3dyf h LEU 134 Cb 0.28 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.77 3dyf h LEU 134 CO -0.01 0.73 0.57 -0.07 0.09 0.00 0.00 178.44 179.75 3dyf h LEU 135 N 0.82 0.87 -0.70 1.67 3.38 -0.43 -1.96 115.31 118.95 3dyf h LEU 135 Ca 0.20 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.22 3dyf h LEU 135 Cb 0.16 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.68 3dyf h LEU 135 CO -0.02 0.56 0.42 -0.07 0.09 0.00 0.00 178.44 179.42 3dyf h LEU 136 N 0.98 0.66 -0.46 1.67 3.38 -0.61 -1.43 115.31 119.51 3dyf h LEU 136 Ca 0.38 0.01 -0.17 0.00 0.09 0.00 0.00 57.88 58.19 3dyf h LEU 136 Cb 0.21 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3dyf h LEU 136 CO -0.14 0.44 -0.74 0.50 0.09 0.00 0.00 178.44 178.60 3dyf h LYS 137 N 0.80 0.23 -0.43 1.13 3.64 -1.19 -3.16 116.57 117.59 3dyf h LYS 137 Ca 0.30 -0.20 -0.04 0.00 -1.27 0.00 0.00 60.65 59.44 3dyf h LYS 137 Cb 0.10 0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 3dyf h LYS 137 CO -0.14 0.87 0.12 0.77 -2.27 0.00 0.00 179.45 178.80 3dyf h SER 138 N 0.15 0.63 -1.00 4.20 0.02 -0.94 -2.84 113.55 113.77 3dyf h SER 138 Ca -0.03 -0.22 0.16 0.00 -0.84 0.00 0.00 61.79 60.87 3dyf h SER 138 Cb 1.31 -0.17 -0.10 0.00 0.14 0.00 0.00 62.40 63.59 3dyf h SER 138 CO 0.11 0.68 0.62 -0.50 -1.14 0.00 0.00 176.83 176.61 3dyf h TRP 139 N 0.55 1.08 -0.77 3.45 6.55 -1.25 0.65 115.95 126.22 3dyf h TRP 139 Ca 0.14 0.03 0.12 0.00 0.95 0.00 0.00 58.89 60.13 3dyf h TRP 139 Cb 0.29 -0.33 -0.08 0.00 -0.86 0.00 0.00 29.16 28.17 3dyf h TRP 139 CO 0.01 0.33 0.37 1.79 -1.05 0.00 0.00 178.44 179.90 3dyf h THR 140 N 0.85 0.78 -0.19 1.49 1.35 -1.51 0.19 112.91 115.88 3dyf h THR 140 Ca 0.54 -0.20 -0.11 0.00 -0.55 0.00 0.00 66.41 66.08 3dyf h THR 140 Cb 0.73 0.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.29 3dyf h THR 140 CO -0.32 0.11 -0.33 0.45 -0.25 0.00 0.00 175.52 175.18 3dyf h HIS 141 N 0.59 0.69 -0.75 4.73 3.86 -0.98 -2.65 115.15 120.64 3dyf h HIS 141 Ca 0.40 -0.24 0.04 0.00 -1.16 0.00 0.00 60.37 59.40 3dyf h HIS 141 Cb 0.50 -0.13 -0.05 0.00 1.06 0.00 0.00 27.41 28.79 3dyf h HIS 141 CO -0.11 0.97 0.47 0.52 0.86 0.00 0.00 177.93 180.64 3dyf h MET 142 N 0.21 0.88 -0.32 2.45 2.07 -0.12 -0.83 114.93 119.28 3dyf h MET 142 Ca 0.01 -0.05 -0.15 0.00 -2.07 0.00 0.00 59.70 57.44 3dyf h MET 142 Cb 0.92 -0.20 -0.01 0.00 -1.87 0.00 0.00 31.60 30.44 3dyf h MET 142 CO 0.07 0.58 -0.39 0.00 1.07 0.00 0.00 176.91 178.24 3dyf h MET 143 N 0.91 0.76 -0.12 1.72 -0.00 -0.68 -2.19 114.93 115.32 3dyf h MET 143 Ca 0.31 -0.39 -0.02 0.00 -0.00 0.00 0.00 59.70 59.60 3dyf h MET 143 Cb 0.04 0.01 -0.00 0.00 -0.00 0.00 0.00 31.60 31.65 3dyf h MET 143 CO -0.12 1.02 0.01 0.00 -0.00 0.00 0.00 176.91 177.82 3dyf h ALA 144 N 0.93 0.17 -0.56 -3.00 0.00 -1.11 -1.74 119.26 113.95 3dyf h ALA 144 Ca 0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 3dyf h ALA 144 Cb 0.94 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.66 3dyf h ALA 144 CO 0.09 -0.16 0.29 1.98 0.00 0.00 0.00 179.25 181.45 3dyf h MET 145 N -0.04 0.77 0.06 0.00 -1.53 -1.16 0.39 114.93 113.43 3dyf h MET 145 Ca 0.04 -0.08 -0.24 0.00 -3.44 0.00 0.00 59.70 55.98 3dyf h MET 145 Cb 0.33 -0.16 -0.00 0.00 -0.55 0.00 0.00 31.60 31.22 3dyf h MET 145 CO 0.00 0.58 -1.06 1.25 0.14 0.00 0.00 176.91 177.82 3dyf h HIS 146 N 0.78 0.45 0.00 1.39 6.17 -1.30 -2.98 115.15 119.66 3dyf h HIS 146 Ca 0.20 -0.28 -0.22 0.00 0.71 0.00 0.00 60.37 60.78 3dyf h HIS 146 Cb 0.04 -0.03 -0.04 0.00 2.52 0.00 0.00 27.41 29.90 3dyf h HIS 146 CO 0.01 1.16 -1.87 1.19 0.71 0.00 0.00 177.93 179.12 3dyf n PHE 147 N -3.61 0.48 -0.72 5.26 3.72 -0.66 -4.41 117.46 117.52 3dyf n PHE 147 Ca -0.06 0.16 0.08 0.00 -0.05 0.00 0.00 57.45 57.58 3dyf n PHE 147 Cb 0.92 -0.96 0.24 0.00 -0.94 0.00 0.00 39.48 38.73 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 -2.74 0.88 -0.26 1.38 3.72 0.14 -4.71 117.46 115.86 3dyf n PHE 148 Ca -0.17 -0.74 0.07 0.00 -0.05 0.00 0.00 57.45 56.56 3dyf n PHE 148 Cb 0.92 -0.23 0.21 0.00 -0.94 0.00 0.00 39.48 39.43 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 2.10 1.07 -0.13 4.37 0.00 -1.66 -1.17 119.26 123.85 3dyf h ALA 149 Ca 0.00 0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.07 3dyf h ALA 149 Cb 1.26 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.24 3dyf h ALA 149 CO 0.17 -0.32 0.00 -0.25 0.00 0.00 0.00 179.25 178.85 3dyf n ASP 150 N -5.11 1.95 -4.71 0.00 8.00 -1.26 -4.90 116.55 110.51 3dyf n ASP 150 Ca 0.16 -1.70 -0.41 0.00 0.71 0.00 0.00 54.79 53.55 3dyf n ASP 150 Cb 0.49 -0.08 -0.04 0.00 -0.02 0.00 0.00 41.12 41.48 3dyf n ASP 150 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3dyf s ARG 151 N -1.85 4.52 0.45 -1.24 1.81 -0.44 -4.94 118.95 117.26 3dyf s ARG 151 Ca 0.34 1.24 0.15 0.00 -1.72 0.00 0.00 55.73 55.75 3dyf s ARG 151 Cb 0.19 -3.45 1.03 0.00 -0.45 0.00 0.00 34.95 32.27 3dyf s ARG 151 CO 0.30 -0.01 2.00 -1.35 -0.68 0.00 0.00 175.30 175.56 3dyf h PRO 152 N 6.77 0.00 0.00 3.54 0.11 -1.90 -2.43 132.00 138.08 3dyf h PRO 152 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 3dyf h PRO 152 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 3dyf h PRO 152 CO 0.75 0.18 0.00 1.97 -0.21 0.00 0.00 178.00 180.69 3dyf n PHE 153 N -4.29 0.00 -0.20 0.65 1.16 -1.26 -4.29 117.46 109.23 3dyf n PHE 153 Ca -0.02 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.45 3dyf n PHE 153 Cb 0.24 -0.25 -0.06 0.00 -1.61 0.00 0.00 39.48 37.80 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 -1.67 0.18 5.98 5.85 -1.70 0.62 115.31 124.57 3dyf h LEU 154 Ca 0.00 0.25 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 3dyf h LEU 154 Cb 0.19 0.73 -0.00 0.00 0.37 0.00 0.00 40.66 41.95 3dyf h LEU 154 CO 0.00 -0.35 -0.14 -0.61 -0.34 0.00 0.00 178.44 177.00 3dyf h GLN 155 N -0.27 -0.29 -0.98 1.25 4.15 -1.85 -0.71 115.11 116.40 3dyf h GLN 155 Ca 0.14 0.02 0.33 0.00 0.77 0.00 0.00 58.65 59.92 3dyf h GLN 155 Cb 0.56 0.07 -0.17 0.00 0.21 0.00 0.00 27.48 28.15 3dyf h GLN 155 CO -0.68 -0.20 0.31 0.22 -1.93 0.00 0.00 178.83 176.56 3dyf h ASP 156 N -0.31 -0.00 0.21 -0.69 3.58 -1.83 0.25 116.42 117.63 3dyf h ASP 156 Ca -0.02 0.25 -0.01 0.00 0.42 0.00 0.00 57.03 57.67 3dyf h ASP 156 Cb 0.25 0.34 0.00 0.00 1.72 0.00 0.00 39.33 41.65 3dyf h ASP 156 CO 0.01 -0.35 -0.10 0.25 -2.88 0.00 0.00 179.24 176.17 3dyf h LEU 157 N 0.06 -0.24 -0.61 2.28 5.85 -0.49 -1.07 115.31 121.08 3dyf h LEU 157 Ca 0.71 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 59.38 3dyf h LEU 157 Cb 1.68 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 42.75 3dyf h LEU 157 CO -0.80 -0.17 0.17 -0.07 -0.34 0.00 0.00 178.44 177.23 3dyf h LEU 158 N -0.28 0.91 -0.28 2.25 3.38 0.90 -1.36 115.31 120.84 3dyf h LEU 158 Ca -0.03 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 57.76 3dyf h LEU 158 Cb 0.21 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 3dyf h LEU 158 CO 0.05 0.90 0.06 0.00 0.09 0.00 0.00 178.44 179.53 3dyf h ARG 160 N 0.16 0.59 -0.19 0.00 3.08 -1.03 -2.46 114.38 114.53 3dyf h ARG 160 Ca 0.13 -0.15 0.04 0.00 0.07 0.00 0.00 59.98 60.07 3dyf h ARG 160 Cb 0.13 -0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.07 3dyf h ARG 160 CO -0.17 0.64 -0.07 0.35 -1.07 0.00 0.00 179.97 179.66 3dyf h PHE 161 N 0.44 -0.16 -0.41 3.04 3.57 -0.81 -2.23 116.94 120.37 3dyf h PHE 161 Ca 0.11 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.58 3dyf h PHE 161 Cb 0.32 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.14 3dyf h PHE 161 CO 0.02 -0.11 0.02 -0.91 -2.23 0.00 0.00 178.31 175.10 3dyf h ASN 162 N -0.04 0.61 -0.65 0.41 2.35 -0.91 0.80 115.58 118.15 3dyf h ASN 162 Ca 0.10 -0.12 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 3dyf h ASN 162 Cb 0.18 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 3dyf h ASN 162 CO -0.21 0.67 0.07 0.03 -1.65 0.00 0.00 177.43 176.33 3dyf h ARG 163 N 0.62 1.11 -0.07 0.81 3.08 -1.18 0.53 114.38 119.27 3dyf h ARG 163 Ca 0.13 -0.32 -0.11 0.00 0.07 0.00 0.00 59.98 59.75 3dyf h ARG 163 Cb 0.36 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 3dyf h ARG 163 CO 0.01 1.04 -0.44 0.28 -1.07 0.00 0.00 179.97 179.78 3dyf h VAL 164 N 1.03 1.32 -0.16 2.04 2.07 -0.95 0.27 116.25 121.87 3dyf h VAL 164 Ca 0.19 -1.58 -0.04 0.00 0.82 0.00 0.00 66.70 66.09 3dyf h VAL 164 Cb 0.49 1.76 -0.00 0.00 -1.52 0.00 0.00 31.29 32.02 3dyf h VAL 164 CO 0.02 0.47 -0.05 -0.78 0.02 0.00 0.00 177.57 177.24 3dyf h ASP 165 N 0.14 0.32 0.07 0.57 3.58 -0.20 -2.29 116.42 118.61 3dyf h ASP 165 Ca 0.01 -0.39 0.01 0.00 0.42 0.00 0.00 57.03 57.08 3dyf h ASP 165 Cb 0.84 -0.09 -0.01 0.00 1.72 0.00 0.00 39.33 41.79 3dyf h ASP 165 CO 0.07 0.64 -0.09 0.22 -2.88 0.00 0.00 179.24 177.19 3dyf h TYR 166 N 0.01 -0.23 -0.86 0.28 3.20 0.59 -2.54 116.97 117.42 3dyf h TYR 166 Ca 0.04 0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.98 3dyf h TYR 166 Cb 0.50 0.09 -0.06 0.00 1.54 0.00 0.00 36.73 38.80 3dyf h TYR 166 CO 0.06 -0.14 0.53 1.79 -1.64 0.00 0.00 178.16 178.76 3dyf h THR 167 N -0.19 1.03 -0.30 1.81 1.35 -0.47 -1.59 112.91 114.55 3dyf h THR 167 Ca 0.01 -0.33 0.02 0.00 -0.55 0.00 0.00 66.41 65.57 3dyf h THR 167 Cb 0.19 -0.01 -0.03 0.00 -1.73 0.00 0.00 68.15 66.58 3dyf h THR 167 CO -0.04 0.17 0.13 0.74 -0.25 0.00 0.00 175.52 176.28 3dyf h THR 168 N 0.96 0.96 -0.77 6.82 2.02 -1.17 0.27 112.91 122.01 3dyf h THR 168 Ca 0.38 -0.10 0.07 0.00 0.77 0.00 0.00 66.41 67.53 3dyf h THR 168 Cb 0.19 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 3dyf h THR 168 CO -0.18 0.05 0.50 0.00 0.37 0.00 0.00 175.52 176.27 3dyf h ALA 169 N 1.17 1.69 -0.55 6.16 0.00 -0.97 0.21 119.26 126.96 3dyf h ALA 169 Ca 0.13 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 3dyf h ALA 169 Cb 0.06 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3dyf h ALA 169 CO -0.10 0.18 0.10 0.28 0.00 0.00 0.00 179.25 179.71 3dyf h VAL 170 N 0.79 1.25 -0.33 0.00 2.07 -0.18 -1.96 116.25 117.90 3dyf h VAL 170 Ca 0.34 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.86 3dyf h VAL 170 Cb 0.29 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 30.85 3dyf h VAL 170 CO -0.12 0.34 -0.02 1.23 0.02 0.00 0.00 177.57 179.03 3dyf h GLY 171 N 0.80 0.55 1.68 2.17 0.00 0.18 -1.71 103.07 106.75 3dyf h GLY 171 Ca 0.17 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 3dyf h GLY 171 CO 0.01 0.31 0.01 1.46 0.00 0.00 0.00 176.54 178.33 3dyf h GLN 172 N 0.49 0.41 -0.36 4.80 1.08 -0.10 -1.65 115.11 119.79 3dyf h GLN 172 Ca 0.10 -0.07 -0.12 0.00 -1.45 0.00 0.00 58.65 57.11 3dyf h GLN 172 Cb 0.35 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.71 3dyf h GLN 172 CO 0.01 0.43 -0.24 1.25 -0.95 0.00 0.00 178.83 179.33 3dyf h LEU 173 N 0.40 0.83 -1.26 1.46 5.85 -0.60 -0.20 115.31 121.79 3dyf h LEU 173 Ca 0.09 -0.43 -0.06 0.00 0.84 0.00 0.00 57.88 58.32 3dyf h LEU 173 Cb 0.26 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.04 3dyf h LEU 173 CO 0.01 1.09 -0.13 1.88 -0.34 0.00 0.00 178.44 180.94 3dyf h TYR 174 N 0.59 0.36 0.04 1.25 0.05 -1.00 -2.77 116.97 115.49 3dyf h TYR 174 Ca 0.07 -0.05 -0.06 0.00 0.05 0.00 0.00 58.73 58.75 3dyf h TYR 174 Cb 0.81 -0.10 0.01 0.00 1.01 0.00 0.00 36.73 38.45 3dyf h TYR 174 CO 0.06 0.47 -0.24 0.22 -1.05 0.00 0.00 178.16 177.62 3dyf h ASP 175 N 0.32 0.15 0.47 3.88 1.82 -1.20 -2.95 116.42 118.91 3dyf h ASP 175 Ca 0.06 -0.94 -0.00 0.00 -0.39 0.00 0.00 57.03 55.76 3dyf h ASP 175 Cb 0.43 -0.05 -0.00 0.00 0.68 0.00 0.00 39.33 40.39 3dyf h ASP 175 CO 0.03 1.08 -0.00 1.62 -1.61 0.00 0.00 179.24 180.36 3dyf h VAL 176 N -0.75 0.01 0.00 2.25 3.04 -1.02 -2.79 116.25 116.99 3dyf h VAL 176 Ca -0.04 -0.24 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 3dyf h VAL 176 Cb 1.15 1.24 0.00 0.00 -2.01 0.00 0.00 31.29 31.67 3dyf h VAL 176 CO 0.05 0.00 -0.02 0.35 -1.01 0.00 0.00 177.57 176.94 3dyf n THR 177 N -3.10 1.69 0.35 3.17 -2.24 -1.05 -4.72 114.28 108.38 3dyf n THR 177 Ca -0.01 -2.00 0.14 0.00 -2.27 0.00 0.00 64.05 59.91 3dyf n THR 177 Cb 0.18 -0.11 0.56 0.00 -2.10 0.00 0.00 70.33 68.87 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 -0.54 3.42 4.64 -1.31 -3.03 113.55 116.74 3dyf h SER 178 Ca 0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 3dyf h SER 178 Cb 0.95 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.94 3dyf h SER 178 CO 0.00 0.00 0.14 1.15 -0.87 0.00 0.00 176.83 177.25 3dyf n MET 179 N -2.67 3.10 -4.87 4.77 0.00 -1.26 -4.77 117.12 111.41 3dyf n MET 179 Ca 0.02 -3.04 -0.26 0.00 0.00 0.00 0.00 57.70 54.41 3dyf n MET 179 Cb 0.29 -2.04 -0.16 0.00 0.00 0.00 0.00 33.22 31.32 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 -3.01 1.70 -0.67 3.17 0.08 -1.15 -1.24 117.98 116.87 3dyf s PHE 180 Ca 0.50 -0.42 -0.26 0.00 0.12 0.00 0.00 56.93 56.87 3dyf s PHE 180 Cb 0.41 -1.12 -0.09 0.00 -0.57 0.00 0.00 43.02 41.64 3dyf s PHE 180 CO 0.09 -0.10 2.32 0.34 -0.10 0.00 0.00 175.22 177.77 3dyf s ASP 181 N -0.18 4.33 0.48 1.36 -1.08 -1.26 -4.78 116.67 115.54 3dyf s ASP 181 Ca 0.01 0.42 0.20 0.00 -0.52 0.00 0.00 52.55 52.66 3dyf s ASP 181 Cb -0.10 -2.53 1.07 0.00 -1.46 0.00 0.00 42.92 39.90 3dyf s ASP 181 CO 0.01 -3.26 1.55 0.77 0.52 0.00 0.00 175.17 174.76 3dyf h SER 182 N 15.55 0.00 1.45 -0.34 4.64 -1.96 0.70 113.55 133.60 3dyf h SER 182 Ca -0.11 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.18 3dyf h SER 182 Cb 1.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3dyf h SER 182 CO 1.10 0.00 -0.14 0.78 -0.87 0.00 0.00 176.83 177.70 3dyf h ASN 183 N 0.00 0.00 0.40 4.97 4.21 -2.02 -2.62 115.58 120.51 3dyf h ASN 183 Ca 0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 3dyf h ASN 183 Cb 0.68 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.88 3dyf h ASN 183 CO 0.00 0.14 -0.43 0.29 -1.29 0.00 0.00 177.43 176.14 3dyf n LYS 184 N -3.18 0.29 -1.50 0.81 4.01 0.24 -4.88 118.16 113.96 3dyf n LYS 184 Ca 0.02 -0.17 -0.46 0.00 -0.51 0.00 0.00 58.31 57.19 3dyf n LYS 184 Cb 0.50 -1.50 -0.06 0.00 -0.51 0.00 0.00 35.03 33.46 3dyf n LYS 184 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 3dyf n LEU 185 N -1.20 2.22 -3.15 -0.35 4.77 -0.99 -4.84 117.00 113.46 3dyf n LEU 185 Ca 0.08 0.19 0.05 0.00 -0.03 0.00 0.00 56.01 56.29 3dyf n LEU 185 Cb 0.34 -1.35 -0.00 0.00 -2.33 0.00 0.00 43.42 40.08 3dyf n LEU 185 CO 0.32 -0.87 0.29 -0.62 -1.33 0.00 0.00 177.39 175.18 3dyf s ASP 186 N 8.51 -1.12 0.17 -1.43 2.15 -1.26 -5.05 116.67 118.64 3dyf s ASP 186 Ca 1.08 0.29 -0.02 0.00 0.43 0.00 0.00 52.55 54.33 3dyf s ASP 186 Cb -0.68 1.77 0.33 0.00 -0.30 0.00 0.00 42.92 44.05 3dyf s ASP 186 CO 0.42 -0.21 0.90 -2.65 -0.17 0.00 0.00 175.17 173.47 3dyf n PRO 187 N 5.35 -0.05 -0.03 4.34 -0.02 -1.26 -0.93 135.00 142.40 3dyf n PRO 187 Ca 0.04 0.89 -0.09 0.00 -2.02 0.00 0.00 63.50 62.31 3dyf n PRO 187 Cb 0.54 -1.36 -0.03 0.00 -0.02 0.00 0.00 33.50 32.63 3dyf n PRO 187 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3dyf h ASP 188 N 0.00 -0.00 -3.27 2.55 3.32 -1.97 -3.42 116.42 113.63 3dyf h ASP 188 Ca 0.30 0.03 -0.57 0.00 0.02 0.00 0.00 57.03 56.81 3dyf h ASP 188 Cb 0.53 0.04 -0.05 0.00 0.22 0.00 0.00 39.33 40.07 3dyf h ASP 188 CO -0.58 0.02 -0.02 -0.69 -1.72 0.00 0.00 179.24 176.26 3dyf s VAL 189 N -6.19 4.81 0.59 -1.35 1.01 -0.10 -5.08 120.40 114.09 3dyf s VAL 189 Ca -0.13 1.23 -0.06 0.00 0.00 0.00 0.00 61.98 63.02 3dyf s VAL 189 Cb 0.09 -3.92 -0.00 0.00 0.00 0.00 0.00 36.38 32.55 3dyf s VAL 189 CO 0.68 0.49 0.91 -0.94 0.00 0.00 0.00 175.10 176.24 3dyf s SER 190 N -0.68 5.71 0.06 3.32 1.04 -1.26 -4.63 113.70 117.27 3dyf s SER 190 Ca 0.30 0.81 -0.27 0.00 0.48 0.00 0.00 55.95 57.28 3dyf s SER 190 Cb -0.19 -1.84 0.07 0.00 0.10 0.00 0.00 66.02 64.16 3dyf s SER 190 CO 0.18 -1.01 0.65 -1.58 0.98 0.00 0.00 173.24 172.46 3dyf s GLN 191 N -4.99 1.16 0.69 4.02 2.00 -1.26 -5.09 119.66 116.19 3dyf s GLN 191 Ca 0.53 -0.13 0.03 0.00 -2.00 0.00 0.00 55.36 53.79 3dyf s GLN 191 Cb -0.11 0.54 0.12 0.00 0.80 0.00 0.00 33.01 34.37 3dyf s GLN 191 CO 0.46 -0.45 0.94 -1.25 -0.50 0.00 0.00 175.29 174.50 3dyf s PRO 192 N -2.56 1.81 0.44 1.67 0.04 -1.26 -5.07 135.00 130.08 3dyf s PRO 192 Ca -0.04 -1.34 -0.24 0.00 0.04 0.00 0.00 61.00 59.41 3dyf s PRO 192 Cb -0.01 -2.43 -0.08 0.00 0.04 0.00 0.00 34.50 32.03 3dyf s PRO 192 CO -0.02 -1.31 1.26 0.99 0.04 0.00 0.00 177.00 177.95 3dyf s THR 193 N -3.01 2.72 0.41 1.26 2.01 -1.26 -4.59 115.64 113.18 3dyf s THR 193 Ca 0.66 0.60 -0.25 0.00 0.31 0.00 0.00 61.69 63.01 3dyf s THR 193 Cb -0.05 -3.33 -0.11 0.00 0.01 0.00 0.00 72.50 69.03 3dyf s THR 193 CO 0.43 0.04 1.05 1.07 -0.69 0.00 0.00 174.62 176.52 3dyf n THR 194 N -0.24 2.43 -0.01 -0.82 5.66 -0.37 -4.92 114.28 116.01 3dyf n THR 194 Ca 0.06 -0.50 0.02 0.00 -3.05 0.00 0.00 64.05 60.58 3dyf n THR 194 Cb 0.45 -1.20 -0.07 0.00 -1.55 0.00 0.00 70.33 67.96 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 -0.41 0.15 0.02 1.09 -2.24 -1.26 -4.60 114.28 107.02 3dyf n THR 195 Ca 0.09 -0.24 0.02 0.00 -2.27 0.00 0.00 64.05 61.65 3dyf n THR 195 Cb 0.39 0.01 -0.09 0.00 -2.10 0.00 0.00 70.33 68.54 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 -1.94 0.61 -1.82 3.42 5.68 -1.26 -4.98 116.55 116.27 3dyf n ASP 196 Ca -0.05 0.26 -0.19 0.00 -0.50 0.00 0.00 54.79 54.32 3dyf n ASP 196 Cb 0.37 0.61 -0.04 0.00 -1.14 0.00 0.00 41.12 40.93 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 -2.73 -0.50 0.19 2.11 3.72 -1.26 -4.87 117.46 114.12 3dyf n PHE 197 Ca -0.10 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.41 3dyf n PHE 197 Cb 0.79 -3.44 0.59 0.00 -0.94 0.00 0.00 39.48 36.48 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 -0.48 1.11 0.83 4.37 0.00 -1.26 -2.19 120.51 122.89 3dyf n ALA 198 Ca -0.21 0.19 0.11 0.00 0.00 0.00 0.00 53.44 53.53 3dyf n ALA 198 Cb 0.64 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.73 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 -2.27 0.11 -0.68 0.00 1.02 -1.26 -4.59 120.64 112.97 3dyf n GLU 199 Ca -0.01 -0.02 -0.18 0.00 -0.02 0.00 0.00 57.16 56.93 3dyf n GLU 199 Cb 0.06 -1.52 -0.04 0.00 -0.02 0.00 0.00 31.44 29.92 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 -1.65 0.99 -3.68 -0.32 3.01 -0.93 -4.70 117.46 110.17 3dyf n PHE 200 Ca 0.03 -1.65 -0.24 0.00 1.01 0.00 0.00 57.45 56.61 3dyf n PHE 200 Cb 0.37 -1.50 -0.02 0.00 -0.01 0.00 0.00 39.48 38.33 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 3.03 5.19 0.43 4.37 -4.23 -1.26 -4.47 115.64 118.70 3dyf s THR 201 Ca 0.38 -0.62 0.18 0.00 -1.18 0.00 0.00 61.69 60.45 3dyf s THR 201 Cb 0.12 -3.82 0.20 0.00 1.34 0.00 0.00 72.50 70.34 3dyf s THR 201 CO -0.02 -0.36 1.99 0.25 -0.54 0.00 0.00 174.62 175.94 3dyf h LEU 202 N 1.30 0.00 -0.05 4.79 5.85 -1.88 0.64 115.31 125.95 3dyf h LEU 202 Ca -0.50 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 3dyf h LEU 202 Cb 1.21 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 3dyf h LEU 202 CO 0.63 0.19 -0.01 0.28 -0.34 0.00 0.00 178.44 179.20 3dyf h SER 203 N 0.00 0.10 -0.51 1.25 0.02 -1.94 0.93 113.55 113.39 3dyf h SER 203 Ca -0.00 -0.37 -0.03 0.00 -0.84 0.00 0.00 61.79 60.54 3dyf h SER 203 Cb 0.38 -0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 3dyf h SER 203 CO 0.03 0.45 0.22 0.78 -1.14 0.00 0.00 176.83 177.16 3dyf h ASN 204 N -0.25 0.73 -0.14 3.07 -0.26 -1.70 -1.62 115.58 115.41 3dyf h ASN 204 Ca 0.01 -0.09 -0.02 0.00 -0.56 0.00 0.00 56.30 55.64 3dyf h ASN 204 Cb 0.40 -0.19 -0.00 0.00 -1.06 0.00 0.00 38.32 37.47 3dyf h ASN 204 CO 0.01 0.66 -0.00 0.22 -1.06 0.00 0.00 177.43 177.26 3dyf h TYR 205 N 0.80 0.26 -0.44 1.19 3.20 -0.67 -2.63 116.97 118.67 3dyf h TYR 205 Ca 0.19 -0.05 0.05 0.00 3.14 0.00 0.00 58.73 62.06 3dyf h TYR 205 Cb 0.16 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 3dyf h TYR 205 CO 0.01 0.47 0.30 0.87 -1.64 0.00 0.00 178.16 178.17 3dyf h LYS 206 N -0.02 0.40 -0.14 1.82 1.57 -0.43 -2.34 116.57 117.42 3dyf h LYS 206 Ca 0.04 -0.02 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 3dyf h LYS 206 Cb 0.37 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 3dyf h LYS 206 CO 0.01 0.26 -0.24 -0.09 -0.57 0.00 0.00 179.45 178.82 3dyf h ARG 207 N 0.41 0.41 -0.09 3.15 2.43 -1.13 -1.98 114.38 117.58 3dyf h ARG 207 Ca 0.19 -0.25 0.04 0.00 -0.81 0.00 0.00 59.98 59.14 3dyf h ARG 207 Cb 0.23 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.76 3dyf h ARG 207 CO -0.05 0.85 -0.19 0.82 -1.51 0.00 0.00 179.97 179.89 3dyf h ILE 208 N 0.02 0.53 -0.35 1.20 2.04 -1.08 -2.67 117.51 117.19 3dyf h ILE 208 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 3dyf h ILE 208 Cb 0.82 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 37.41 3dyf h ILE 208 CO 0.05 0.00 0.17 0.58 0.00 0.00 0.00 178.15 178.96 3dyf h VAL 209 N -0.26 1.16 -0.12 1.67 2.07 -1.50 -0.02 116.25 119.25 3dyf h VAL 209 Ca 0.08 -0.45 0.05 0.00 0.82 0.00 0.00 66.70 67.20 3dyf h VAL 209 Cb 0.38 0.81 -0.06 0.00 -1.52 0.00 0.00 31.29 30.90 3dyf h VAL 209 CO -0.24 0.17 -0.31 0.50 0.02 0.00 0.00 177.57 177.71 3dyf h LYS 210 N 0.44 -0.38 -0.01 1.57 3.64 -1.20 -0.94 116.57 119.70 3dyf h LYS 210 Ca 0.12 0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.44 3dyf h LYS 210 Cb 0.11 0.09 0.01 0.00 -0.41 0.00 0.00 32.23 32.02 3dyf h LYS 210 CO -0.02 -0.25 -0.35 1.88 -2.27 0.00 0.00 179.45 178.45 3dyf h TYR 211 N -0.39 0.36 0.00 1.91 0.05 -1.44 -2.99 116.97 114.47 3dyf h TYR 211 Ca 0.09 -0.19 0.00 0.00 0.05 0.00 0.00 58.73 58.68 3dyf h TYR 211 Cb 0.54 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 38.23 3dyf h TYR 211 CO -0.39 0.99 0.00 1.57 -1.05 0.00 0.00 178.16 179.28 3dyf h LYS 212 N -0.37 0.00 0.00 4.88 2.10 -1.02 -3.24 116.57 118.92 3dyf h LYS 212 Ca -0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 3dyf h LYS 212 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 3dyf h LYS 212 CO 0.07 0.00 0.00 2.41 -2.00 0.00 0.00 179.45 179.93 3dyf n THR 213 N -2.68 0.45 -0.28 0.07 -1.04 -0.39 -4.86 114.28 105.55 3dyf n THR 213 Ca 0.03 0.15 0.04 0.00 -2.04 0.00 0.00 64.05 62.22 3dyf n THR 213 Cb 0.35 -0.89 0.10 0.00 -1.82 0.00 0.00 70.33 68.07 3dyf n THR 213 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dyf n ALA 214 N -3.41 0.15 0.20 2.41 0.00 -1.01 -1.17 120.51 117.66 3dyf n ALA 214 Ca 0.00 0.84 -0.15 0.00 0.00 0.00 0.00 53.44 54.13 3dyf n ALA 214 Cb 0.00 -0.49 -0.08 0.00 0.00 0.00 0.00 19.45 18.88 3dyf n ALA 214 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 3dyf h TYR 215 N 0.00 -0.43 0.00 0.00 0.05 -1.81 0.15 116.97 114.93 3dyf h TYR 215 Ca 0.36 -0.01 0.00 0.00 0.05 0.00 0.00 58.73 59.13 3dyf h TYR 215 Cb 0.55 0.14 0.00 0.00 1.01 0.00 0.00 36.73 38.43 3dyf h TYR 215 CO -0.60 -0.19 -0.20 2.48 -1.05 0.00 0.00 178.16 178.60 3dyf n TYR 216 N -5.23 0.64 -0.05 4.88 4.11 -0.93 0.01 117.16 120.59 3dyf n TYR 216 Ca -0.10 0.19 0.00 0.00 -0.00 0.00 0.00 57.90 57.99 3dyf n TYR 216 Cb 0.24 -0.76 -0.15 0.00 -0.00 0.00 0.00 39.34 38.67 3dyf n TYR 216 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 176.86 179.27 3dyf n THR 217 N -2.07 0.62 0.00 -3.48 -1.04 -0.32 -4.59 114.28 103.41 3dyf n THR 217 Ca 0.05 -0.60 0.00 0.00 -2.04 0.00 0.00 64.05 61.46 3dyf n THR 217 Cb 0.41 -0.23 0.00 0.00 -1.82 0.00 0.00 70.33 68.69 3dyf n THR 217 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 3dyf n TYR 218 N -2.42 0.00 -0.03 -1.42 4.02 0.47 -4.75 117.16 113.03 3dyf n TYR 218 Ca -0.16 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.58 3dyf n TYR 218 Cb 0.80 0.06 -0.09 0.00 -0.02 0.00 0.00 39.34 40.08 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 0.36 0.21 7.72 5.85 -1.01 -3.25 115.31 125.19 3dyf h LEU 219 Ca 0.00 -0.64 0.01 0.00 0.84 0.00 0.00 57.88 58.09 3dyf h LEU 219 Cb 0.83 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.73 3dyf h LEU 219 CO 0.00 0.94 -0.26 0.25 -0.34 0.00 0.00 178.44 179.03 3dyf h LEU 220 N -0.19 -0.72 -0.89 2.25 5.85 -0.69 -1.07 115.31 119.86 3dyf h LEU 220 Ca -0.02 0.07 0.15 0.00 0.84 0.00 0.00 57.88 58.93 3dyf h LEU 220 Cb 0.92 0.26 -0.10 0.00 0.37 0.00 0.00 40.66 42.11 3dyf h LEU 220 CO 0.06 -0.37 0.48 -0.65 -0.34 0.00 0.00 178.44 177.62 3dyf h PRO 221 N -0.52 0.66 -0.35 5.25 0.11 -1.81 0.20 132.00 135.53 3dyf h PRO 221 Ca 0.01 -0.04 -0.16 0.00 0.11 0.00 0.00 66.00 65.92 3dyf h PRO 221 Cb 0.51 -0.15 -0.00 0.00 0.11 0.00 0.00 31.00 31.46 3dyf h PRO 221 CO -0.09 0.44 -0.41 -0.07 -0.21 0.00 0.00 178.00 177.66 3dyf h LEU 222 N 0.68 0.97 -0.14 2.35 3.38 -1.54 -2.82 115.31 118.20 3dyf h LEU 222 Ca 0.49 -0.48 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 3dyf h LEU 222 Cb 0.69 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 3dyf h LEU 222 CO -0.36 1.26 -0.11 0.58 0.09 0.00 0.00 178.44 179.90 3dyf h VAL 223 N 0.71 1.34 -0.94 1.22 2.07 -0.19 -2.16 116.25 118.30 3dyf h VAL 223 Ca 0.05 -1.23 0.07 0.00 0.82 0.00 0.00 66.70 66.41 3dyf h VAL 223 Cb 1.00 1.85 -0.06 0.00 -1.52 0.00 0.00 31.29 32.56 3dyf h VAL 223 CO 0.10 0.36 0.61 0.24 0.02 0.00 0.00 177.57 178.89 3dyf h MET 224 N -0.05 1.01 -0.61 1.57 2.86 -0.70 0.90 114.93 119.91 3dyf h MET 224 Ca 0.03 -0.06 -0.05 0.00 -2.06 0.00 0.00 59.70 57.55 3dyf h MET 224 Cb 0.62 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 32.02 3dyf h MET 224 CO 0.03 0.67 0.19 0.78 1.06 0.00 0.00 176.91 179.63 3dyf h GLY 225 N 1.04 1.02 1.58 8.32 0.00 -1.41 -1.44 103.07 112.17 3dyf h GLY 225 Ca 0.41 -0.61 -0.09 0.00 0.00 0.00 0.00 47.33 47.04 3dyf h GLY 225 CO -0.17 0.57 -0.24 1.41 0.00 0.00 0.00 176.54 178.12 3dyf h LEU 226 N 0.87 0.50 0.30 3.11 3.38 -0.53 -2.00 115.31 120.94 3dyf h LEU 226 Ca 0.20 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 3dyf h LEU 226 Cb 0.30 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.92 3dyf h LEU 226 CO -0.01 0.73 -0.15 0.40 0.09 0.00 0.00 178.44 179.51 3dyf h ILE 227 N 0.44 0.71 0.00 1.22 2.04 -0.51 0.37 117.51 121.77 3dyf h ILE 227 Ca 0.07 -0.55 0.00 0.00 1.00 0.00 0.00 64.86 65.38 3dyf h ILE 227 Cb 0.65 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 3dyf h ILE 227 CO 0.05 0.11 0.00 -0.37 0.00 0.00 0.00 178.15 177.94 3dyf h VAL 228 N -0.72 0.00 0.00 1.67 -1.51 -1.27 0.33 116.25 114.75 3dyf h VAL 228 Ca -0.04 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.22 3dyf h VAL 228 Cb 0.49 1.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.67 3dyf h VAL 228 CO 0.07 0.00 -0.84 0.28 -1.23 0.00 0.00 177.57 175.84 3dyf h SER 229 N 0.00 0.00 -3.26 4.19 0.02 -1.13 -3.44 113.55 109.93 3dyf h SER 229 Ca 0.00 -0.04 -0.26 0.00 -0.84 0.00 0.00 61.79 60.64 3dyf h SER 229 Cb 0.25 0.00 0.05 0.00 0.14 0.00 0.00 62.40 62.84 3dyf h SER 229 CO 0.00 0.02 -0.40 -0.62 -1.14 0.00 0.00 176.83 174.69 3dyf n GLU 230 N -2.60 -3.55 -0.03 3.45 1.02 0.12 -4.91 120.64 114.13 3dyf n GLU 230 Ca 0.01 0.59 0.01 0.00 -0.02 0.00 0.00 57.16 57.75 3dyf n GLU 230 Cb 0.53 -4.78 0.03 0.00 -0.02 0.00 0.00 31.44 27.19 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 -3.15 2.13 -0.33 0.62 0.00 0.95 -4.82 120.51 115.91 3dyf n ALA 231 Ca -0.06 -0.92 0.04 0.00 0.00 0.00 0.00 53.44 52.50 3dyf n ALA 231 Cb 0.57 -0.08 0.11 0.00 0.00 0.00 0.00 19.45 20.05 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 0.40 -0.91 0.00 0.00 5.85 -1.82 0.37 115.31 119.20 3dyf h LEU 232 Ca 0.00 0.28 0.00 0.00 0.84 0.00 0.00 57.88 59.00 3dyf h LEU 232 Cb 0.45 0.59 0.00 0.00 0.37 0.00 0.00 40.66 42.06 3dyf h LEU 232 CO 0.00 -0.30 0.00 -0.81 -0.34 0.00 0.00 178.44 176.99 3dyf n PRO 233 N -5.58 0.05 0.04 5.25 -0.04 -1.26 -3.49 135.00 129.98 3dyf n PRO 233 Ca 0.14 0.18 0.13 0.00 -0.04 0.00 0.00 63.50 63.90 3dyf n PRO 233 Cb 0.46 -1.50 0.50 0.00 -0.04 0.00 0.00 33.50 32.92 3dyf n PRO 233 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 3dyf n THR 234 N -1.46 0.39 -4.30 0.52 -2.24 0.13 -4.86 114.28 102.46 3dyf n THR 234 Ca 0.05 -0.03 -0.27 0.00 -2.27 0.00 0.00 64.05 61.52 3dyf n THR 234 Cb 0.20 -0.65 -0.10 0.00 -2.10 0.00 0.00 70.33 67.68 3dyf n THR 234 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3dyf s VAL 235 N -3.06 3.09 -0.64 2.28 0.11 -1.23 -4.75 120.40 116.20 3dyf s VAL 235 Ca 0.11 -1.63 -0.27 0.00 -2.93 0.00 0.00 61.98 57.26 3dyf s VAL 235 Cb 0.15 -2.51 -0.01 0.00 -1.53 0.00 0.00 36.38 32.48 3dyf s VAL 235 CO 0.50 -0.06 1.76 -0.62 -3.33 0.00 0.00 175.10 173.35 3dyf s ASP 236 N -2.67 5.43 0.37 3.54 -1.08 -1.26 -4.82 116.67 116.19 3dyf s ASP 236 Ca 0.23 0.17 0.04 0.00 -0.52 0.00 0.00 52.55 52.48 3dyf s ASP 236 Cb -0.09 -2.54 0.72 0.00 -1.46 0.00 0.00 42.92 39.55 3dyf s ASP 236 CO 0.14 -2.28 2.02 -0.03 0.52 0.00 0.00 175.17 175.54 3dyf h MET 237 N 14.01 0.73 0.12 4.34 1.85 -1.95 -1.03 114.93 133.01 3dyf h MET 237 Ca -0.26 -0.04 0.01 0.00 -0.61 0.00 0.00 59.70 58.80 3dyf h MET 237 Cb 1.14 -0.17 -0.02 0.00 0.43 0.00 0.00 31.60 32.98 3dyf h MET 237 CO 1.23 0.48 -0.20 0.78 -0.40 0.00 0.00 176.91 178.81 3dyf h GLY 238 N 0.75 -0.37 0.96 1.39 0.00 -2.00 -0.05 103.07 103.75 3dyf h GLY 238 Ca 0.22 0.23 -0.03 0.00 0.00 0.00 0.00 47.33 47.75 3dyf h GLY 238 CO -0.05 -0.19 0.17 -2.08 0.00 0.00 0.00 176.54 174.40 3dyf h VAL 239 N -0.39 1.21 -0.90 4.60 2.07 -1.89 -2.31 116.25 118.64 3dyf h VAL 239 Ca 0.02 -0.66 0.15 0.00 0.82 0.00 0.00 66.70 67.03 3dyf h VAL 239 Cb 0.40 0.78 -0.07 0.00 -1.52 0.00 0.00 31.29 30.88 3dyf h VAL 239 CO -0.10 0.25 0.58 0.74 0.02 0.00 0.00 177.57 179.06 3dyf h THR 240 N 0.60 0.81 -0.14 2.57 2.02 -0.81 -0.82 112.91 117.15 3dyf h THR 240 Ca 0.15 -0.23 -0.22 0.00 0.77 0.00 0.00 66.41 66.88 3dyf h THR 240 Cb 0.21 0.08 0.01 0.00 -1.74 0.00 0.00 68.15 66.72 3dyf h THR 240 CO -0.01 0.12 -0.78 -0.33 0.37 0.00 0.00 175.52 174.89 3dyf h GLU 241 N 0.66 0.77 -0.35 6.66 5.08 -0.59 -2.15 114.58 124.66 3dyf h GLU 241 Ca 0.46 -0.64 0.03 0.00 -1.00 0.00 0.00 59.36 58.20 3dyf h GLU 241 Cb 0.79 0.14 -0.03 0.00 0.50 0.00 0.00 28.75 30.15 3dyf h GLU 241 CO -0.22 1.25 0.17 0.93 -1.00 0.00 0.00 179.01 180.14 3dyf h GLU 242 N 0.49 0.34 0.09 2.33 5.08 -0.73 0.66 114.58 122.83 3dyf h GLU 242 Ca -0.06 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.30 3dyf h GLU 242 Cb 1.41 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 30.56 3dyf h GLU 242 CO 0.16 0.22 -0.22 -0.07 -1.00 0.00 0.00 179.01 178.11 3dyf h LEU 243 N 0.35 -0.62 -0.43 1.33 3.38 -1.17 0.64 115.31 118.79 3dyf h LEU 243 Ca 0.15 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.24 3dyf h LEU 243 Cb 0.07 0.24 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 3dyf h LEU 243 CO -0.11 -0.30 0.18 0.00 0.09 0.00 0.00 178.44 178.30 3dyf h ALA 244 N 0.41 0.53 -0.75 1.53 0.00 -1.07 0.56 119.26 120.47 3dyf h ALA 244 Ca 0.03 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 3dyf h ALA 244 Cb 0.43 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 3dyf h ALA 244 CO -0.14 -0.19 0.32 0.52 0.00 0.00 0.00 179.25 179.77 3dyf h MET 245 N 0.38 1.10 -0.02 0.00 2.86 -0.61 0.53 114.93 119.17 3dyf h MET 245 Ca 0.19 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 3dyf h MET 245 Cb 0.14 -0.19 0.00 0.00 0.06 0.00 0.00 31.60 31.62 3dyf h MET 245 CO -0.17 0.88 -0.03 1.25 1.06 0.00 0.00 176.91 179.91 3dyf h LEU 246 N 1.07 0.06 -1.06 1.22 5.85 -0.35 -2.04 115.31 120.06 3dyf h LEU 246 Ca 0.25 -0.57 -0.06 0.00 0.84 0.00 0.00 57.88 58.34 3dyf h LEU 246 Cb 0.17 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 3dyf h LEU 246 CO -0.03 0.61 0.03 0.24 -0.34 0.00 0.00 178.44 178.96 3dyf h MET 247 N -0.50 0.70 -0.17 1.25 2.86 0.19 -2.59 114.93 116.67 3dyf h MET 247 Ca 0.00 -0.16 -0.01 0.00 -2.06 0.00 0.00 59.70 57.47 3dyf h MET 247 Cb 0.60 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 32.16 3dyf h MET 247 CO 0.01 0.70 0.07 0.78 1.06 0.00 0.00 176.91 179.52 3dyf h GLY 248 N 0.93 0.27 1.00 8.32 0.00 0.08 -0.95 103.07 112.72 3dyf h GLY 248 Ca 0.14 -0.15 0.01 0.00 0.00 0.00 0.00 47.33 47.33 3dyf h GLY 248 CO 0.01 0.14 0.33 -2.09 0.00 0.00 0.00 176.54 174.93 3dyf h GLU 249 N 0.12 0.66 -0.52 4.80 4.81 -1.28 -2.31 114.58 120.87 3dyf h GLU 249 Ca 0.06 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.27 3dyf h GLU 249 Cb 0.17 -0.15 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 3dyf h GLU 249 CO -0.00 0.43 0.31 -0.92 -0.73 0.00 0.00 179.01 178.10 3dyf h TYR 250 N 0.68 0.59 -0.86 0.92 3.20 -1.34 -0.50 116.97 119.65 3dyf h TYR 250 Ca 0.18 0.02 0.02 0.00 3.14 0.00 0.00 58.73 62.09 3dyf h TYR 250 Cb -0.07 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 37.96 3dyf h TYR 250 CO -0.04 0.34 0.57 0.35 -1.64 0.00 0.00 178.16 177.73 3dyf h PHE 251 N 0.62 1.06 -0.09 -3.82 3.57 -0.84 -0.42 116.94 117.01 3dyf h PHE 251 Ca 0.21 0.03 -0.13 0.00 3.53 0.00 0.00 57.97 61.60 3dyf h PHE 251 Cb 0.01 -0.36 0.01 0.00 2.79 0.00 0.00 35.95 38.40 3dyf h PHE 251 CO -0.06 0.64 -0.45 0.37 -2.23 0.00 0.00 178.31 176.58 3dyf h GLN 252 N 1.12 0.47 -0.82 1.11 5.75 -0.94 -1.23 115.11 120.56 3dyf h GLN 252 Ca 0.33 -0.38 0.09 0.00 -0.15 0.00 0.00 58.65 58.54 3dyf h GLN 252 Cb -0.05 0.08 -0.07 0.00 1.07 0.00 0.00 27.48 28.50 3dyf h GLN 252 CO -0.09 1.01 0.47 0.28 -2.65 0.00 0.00 178.83 177.86 3dyf h VAL 253 N 0.04 0.91 -0.59 2.39 2.07 -0.76 0.23 116.25 120.54 3dyf h VAL 253 Ca -0.03 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.22 3dyf h VAL 253 Cb 1.09 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 3dyf h VAL 253 CO 0.09 0.14 0.38 1.56 0.02 0.00 0.00 177.57 179.77 3dyf h GLN 254 N 0.79 0.78 -0.79 1.57 4.20 -0.95 -0.75 115.11 119.96 3dyf h GLN 254 Ca 0.40 -0.05 0.04 0.00 0.06 0.00 0.00 58.65 59.09 3dyf h GLN 254 Cb 0.36 -0.17 -0.05 0.00 0.30 0.00 0.00 27.48 27.92 3dyf h GLN 254 CO -0.25 0.52 0.50 0.22 -0.67 0.00 0.00 178.83 179.15 3dyf h ASP 255 N 0.80 0.81 -0.50 1.46 3.58 0.56 -1.22 116.42 121.91 3dyf h ASP 255 Ca 0.21 0.00 -0.12 0.00 0.42 0.00 0.00 57.03 57.55 3dyf h ASP 255 Cb -0.08 -0.17 -0.01 0.00 1.72 0.00 0.00 39.33 40.78 3dyf h ASP 255 CO -0.05 0.55 -0.15 0.44 -2.88 0.00 0.00 179.24 177.15 3dyf h ASP 256 N 0.95 0.99 -0.60 2.28 3.32 -0.13 -1.24 116.42 122.00 3dyf h ASP 256 Ca 0.32 -0.37 -0.07 0.00 0.02 0.00 0.00 57.03 56.92 3dyf h ASP 256 Cb 0.04 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.30 3dyf h ASP 256 CO -0.12 1.14 0.08 0.58 -1.72 0.00 0.00 179.24 179.20 3dyf h VAL 257 N 0.84 1.26 -0.32 -1.35 2.07 -0.80 -2.75 116.25 115.19 3dyf h VAL 257 Ca 0.12 -1.02 -0.11 0.00 0.82 0.00 0.00 66.70 66.51 3dyf h VAL 257 Cb 0.72 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 3dyf h VAL 257 CO 0.06 0.38 -0.26 0.24 0.02 0.00 0.00 177.57 178.00 3dyf h MET 258 N 0.91 0.65 -0.88 1.57 2.86 -1.14 -0.30 114.93 118.60 3dyf h MET 258 Ca 0.18 -0.27 0.19 0.00 -2.06 0.00 0.00 59.70 57.75 3dyf h MET 258 Cb 0.44 -0.03 -0.06 0.00 0.06 0.00 0.00 31.60 32.01 3dyf h MET 258 CO 0.01 0.85 0.58 0.22 1.06 0.00 0.00 176.91 179.63 3dyf h ASP 259 N 0.56 0.41 0.05 1.22 3.58 -0.92 0.56 116.42 121.88 3dyf h ASP 259 Ca 0.08 0.04 -0.37 0.00 0.42 0.00 0.00 57.03 57.19 3dyf h ASP 259 Cb 0.74 -0.04 -0.06 0.00 1.72 0.00 0.00 39.33 41.69 3dyf h ASP 259 CO 0.06 0.17 -2.34 0.00 -2.88 0.00 0.00 179.24 174.25 3dyf n PHE 261 N -3.12 0.00 -3.20 0.00 3.72 -0.15 -5.00 117.46 109.72 3dyf n PHE 261 Ca -0.38 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.63 3dyf n PHE 261 Cb 1.05 -0.02 -0.06 0.00 -0.94 0.00 0.00 39.48 39.51 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 -1.76 4.88 0.25 4.37 2.01 0.17 -5.01 115.64 120.55 3dyf s THR 262 Ca 0.02 1.27 -0.30 0.00 0.31 0.00 0.00 61.69 62.99 3dyf s THR 262 Cb 0.05 -3.94 -0.10 0.00 0.01 0.00 0.00 72.50 68.52 3dyf s THR 262 CO 0.28 0.43 1.38 -2.84 -0.69 0.00 0.00 174.62 173.18 3dyf s PRO 263 N -0.27 4.31 0.33 4.92 0.02 -1.26 -4.81 135.00 138.25 3dyf s PRO 263 Ca 0.31 2.22 0.11 0.00 0.02 0.00 0.00 61.00 63.66 3dyf s PRO 263 Cb -0.18 -3.13 0.90 0.00 0.02 0.00 0.00 34.50 32.11 3dyf s PRO 263 CO 0.18 -0.34 1.75 -1.35 -0.33 0.00 0.00 177.00 176.91 3dyf h PRO 264 N 4.88 0.56 -0.83 5.54 0.11 -1.95 0.17 132.00 140.49 3dyf h PRO 264 Ca -0.46 -0.03 0.20 0.00 0.11 0.00 0.00 66.00 65.82 3dyf h PRO 264 Cb 1.22 -0.13 -0.14 0.00 0.11 0.00 0.00 31.00 32.06 3dyf h PRO 264 CO 0.76 0.37 0.07 0.93 -0.21 0.00 0.00 178.00 179.92 3dyf h GLU 265 N 0.58 0.12 0.00 1.05 3.07 -1.90 0.57 114.58 118.07 3dyf h GLU 265 Ca 0.62 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 59.46 3dyf h GLU 265 Cb 1.21 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 29.09 3dyf h GLU 265 CO -0.41 0.08 -0.31 0.00 -1.40 0.00 0.00 179.01 176.97 3dyf h ARG 266 N 0.12 0.00 -1.00 2.33 3.08 -1.39 -3.37 114.38 114.15 3dyf h ARG 266 Ca 0.48 0.00 0.30 0.00 0.07 0.00 0.00 59.98 60.83 3dyf h ARG 266 Cb 0.91 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.82 3dyf h ARG 266 CO -0.71 0.06 0.57 1.25 -1.07 0.00 0.00 179.97 180.07 3dyf h LEU 267 N -1.00 0.55 0.00 3.04 5.85 -1.09 -3.45 115.31 119.21 3dyf h LEU 267 Ca -0.01 0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3dyf h LEU 267 Cb 0.33 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.47 3dyf h LEU 267 CO -0.01 -0.07 0.00 0.61 -0.34 0.00 0.00 178.44 178.63 3dyf n GLY 268 N -1.30 0.78 3.07 3.75 0.00 0.20 -4.77 105.19 106.92 3dyf n GLY 268 Ca 0.30 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.73 0.50 -0.10 1.61 -2.85 -1.25 -0.83 119.74 116.09 3dyf s LYS 269 Ca 0.00 -0.80 -0.15 0.00 -1.00 0.00 0.00 55.97 54.02 3dyf s LYS 269 Cb 0.00 0.19 -0.05 0.00 -2.06 0.00 0.00 37.83 35.91 3dyf s LYS 269 CO 0.00 -0.11 0.36 0.08 0.10 0.00 0.00 175.35 175.78 3dyf s VAL 270 N -2.51 5.21 0.57 1.79 1.01 -1.26 -4.39 120.40 120.82 3dyf s VAL 270 Ca -0.06 0.71 -0.19 0.00 0.00 0.00 0.00 61.98 62.43 3dyf s VAL 270 Cb -0.02 -3.68 -0.04 0.00 0.00 0.00 0.00 36.38 32.63 3dyf s VAL 270 CO -0.04 0.45 1.19 -0.83 0.00 0.00 0.00 175.10 175.86 3dyf s GLY 271 N -0.06 2.72 0.00 4.51 0.00 -1.25 -4.63 107.32 108.61 3dyf s GLY 271 Ca 0.21 0.97 0.00 0.00 0.00 0.00 0.00 44.72 45.90 3dyf s GLY 271 CO 0.08 1.36 0.26 -1.30 0.00 0.00 0.00 173.10 173.50 3dyf n THR 272 N -1.45 0.00 0.07 0.90 -2.24 -1.26 -4.95 114.28 105.34 3dyf n THR 272 Ca 0.13 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.78 3dyf n THR 272 Cb 0.50 1.00 -0.08 0.00 -2.10 0.00 0.00 70.33 69.65 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 -0.08 -0.07 3.42 3.32 -1.93 -0.33 116.42 120.75 3dyf h ASP 273 Ca 0.00 -0.09 0.02 0.00 0.02 0.00 0.00 57.03 56.98 3dyf h ASP 273 Cb 0.84 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.39 3dyf h ASP 273 CO 0.00 0.04 -0.06 0.40 -1.72 0.00 0.00 179.24 177.90 3dyf h ILE 274 N -0.20 0.82 0.00 0.35 2.04 -1.92 -0.89 117.51 117.70 3dyf h ILE 274 Ca -0.01 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 3dyf h ILE 274 Cb 0.17 0.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 3dyf h ILE 274 CO 0.02 0.00 -0.18 0.06 0.00 0.00 0.00 178.15 178.05 3dyf h GLN 275 N -0.08 0.00 -0.10 2.37 -0.00 -1.74 -1.88 115.11 113.68 3dyf h GLN 275 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.70 3dyf h GLN 275 Cb 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.63 3dyf h GLN 275 CO -0.12 0.18 0.00 -0.25 -0.00 0.00 0.00 178.83 178.64 3dyf n ASP 276 N -3.64 1.58 -2.81 0.06 9.92 -0.14 -3.72 116.55 117.80 3dyf n ASP 276 Ca -0.01 -1.62 -0.19 0.00 -0.53 0.00 0.00 54.79 52.44 3dyf n ASP 276 Cb 0.31 -0.06 0.00 0.00 -0.64 0.00 0.00 41.12 40.73 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 0.25 -0.87 -1.77 2.24 0.00 -0.42 -4.91 120.51 115.02 3dyf n ALA 277 Ca 0.17 0.15 -0.39 0.00 0.00 0.00 0.00 53.44 53.38 3dyf n ALA 277 Cb 0.34 -2.53 -0.01 0.00 0.00 0.00 0.00 19.45 17.25 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 -5.44 3.92 -1.38 0.00 -0.14 -0.71 -4.45 119.74 111.54 3dyf s LYS 278 Ca 0.17 2.03 -0.13 0.00 -1.36 0.00 0.00 55.97 56.68 3dyf s LYS 278 Cb -0.09 -2.67 0.08 0.00 -1.68 0.00 0.00 37.83 33.48 3dyf s LYS 278 CO 0.21 -0.49 2.03 0.00 -0.76 0.00 0.00 175.35 176.34 3dyf s SER 280 N 2.76 4.29 0.34 0.00 1.04 -1.26 -4.85 113.70 116.03 3dyf s SER 280 Ca 0.46 0.49 0.06 0.00 0.48 0.00 0.00 55.95 57.44 3dyf s SER 280 Cb 0.11 -0.93 0.63 0.00 0.10 0.00 0.00 66.02 65.93 3dyf s SER 280 CO -0.04 -1.99 1.86 -0.25 0.98 0.00 0.00 173.24 173.80 3dyf h TRP 281 N -1.00 0.41 -0.18 5.02 7.01 -1.92 -2.11 115.95 123.18 3dyf h TRP 281 Ca -0.45 -0.05 -0.07 0.00 2.11 0.00 0.00 58.89 60.43 3dyf h TRP 281 Cb 1.30 -0.11 -0.00 0.00 -2.10 0.00 0.00 29.16 28.24 3dyf h TRP 281 CO -0.04 0.50 -0.15 -0.07 -2.79 0.00 0.00 178.44 175.90 3dyf h LEU 282 N 0.37 0.45 -0.16 0.65 3.38 -1.93 -1.34 115.31 116.73 3dyf h LEU 282 Ca 0.07 -0.46 -0.00 0.00 0.09 0.00 0.00 57.88 57.58 3dyf h LEU 282 Cb 0.42 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 3dyf h LEU 282 CO 0.02 0.81 0.09 0.00 0.09 0.00 0.00 178.44 179.46 3dyf h ALA 283 N 0.65 0.20 -0.48 1.53 0.00 -1.85 0.19 119.26 119.51 3dyf h ALA 283 Ca 0.03 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 3dyf h ALA 283 Cb 0.67 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 3dyf h ALA 283 CO 0.04 -0.29 -0.16 -0.39 0.00 0.00 0.00 179.25 178.45 3dyf h VAL 284 N 0.18 1.27 -0.08 0.00 -1.51 -1.43 -0.77 116.25 113.90 3dyf h VAL 284 Ca 0.06 -1.29 -0.03 0.00 -1.23 0.00 0.00 66.70 64.21 3dyf h VAL 284 Cb 0.03 1.07 -0.00 0.00 -2.13 0.00 0.00 31.29 30.26 3dyf h VAL 284 CO -0.01 0.45 -0.05 0.74 -1.23 0.00 0.00 177.57 177.46 3dyf h THR 285 N 0.81 1.34 -0.02 7.19 2.02 -1.12 -1.75 112.91 121.37 3dyf h THR 285 Ca 0.12 -1.11 0.01 0.00 0.77 0.00 0.00 66.41 66.21 3dyf h THR 285 Cb 0.70 1.89 -0.01 0.00 -1.74 0.00 0.00 68.15 68.99 3dyf h THR 285 CO 0.05 0.31 -0.05 0.15 0.37 0.00 0.00 175.52 176.35 3dyf h PHE 286 N -0.20 -0.12 -0.63 3.16 3.57 -0.95 -2.31 116.94 119.46 3dyf h PHE 286 Ca 0.02 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.58 3dyf h PHE 286 Cb 0.52 0.06 -0.04 0.00 2.79 0.00 0.00 35.95 39.28 3dyf h PHE 286 CO 0.07 -0.08 0.42 -0.07 -2.23 0.00 0.00 178.31 176.42 3dyf h LEU 287 N -0.08 0.58 -1.23 0.59 3.38 -1.14 0.83 115.31 118.24 3dyf h LEU 287 Ca 0.03 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 3dyf h LEU 287 Cb 0.12 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 3dyf h LEU 287 CO -0.07 0.38 -0.35 0.00 0.09 0.00 0.00 178.44 178.49 3dyf h ALA 288 N 1.65 1.20 -0.01 1.53 0.00 -0.78 -3.23 119.26 119.62 3dyf h ALA 288 Ca 0.27 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3dyf h ALA 288 Cb 0.21 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3dyf h ALA 288 CO -0.08 0.43 -0.08 0.36 0.00 0.00 0.00 179.25 179.88 3dyf n LYS 289 N -3.80 1.43 -2.53 0.00 2.85 -0.63 -5.04 118.16 110.45 3dyf n LYS 289 Ca -0.01 -0.64 -0.39 0.00 -1.05 0.00 0.00 58.31 56.21 3dyf n LYS 289 Cb 0.43 -1.03 -0.04 0.00 -0.65 0.00 0.00 35.03 33.73 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 -0.87 3.31 0.65 0.58 0.00 0.28 -5.04 121.76 120.66 3dyf s ALA 290 Ca 0.06 0.80 -0.09 0.00 0.00 0.00 0.00 51.96 52.73 3dyf s ALA 290 Cb 0.05 -3.29 0.00 0.00 0.00 0.00 0.00 23.12 19.88 3dyf s ALA 290 CO 0.13 -0.12 1.01 -1.54 0.00 0.00 0.00 175.76 175.24 3dyf s SER 291 N -1.11 5.65 0.23 0.00 1.04 -1.26 -4.74 113.70 113.51 3dyf s SER 291 Ca 0.48 1.04 -0.08 0.00 0.48 0.00 0.00 55.95 57.87 3dyf s SER 291 Cb -0.28 -1.96 0.39 0.00 0.10 0.00 0.00 66.02 64.27 3dyf s SER 291 CO 0.36 -1.14 1.66 0.28 0.98 0.00 0.00 173.24 175.38 3dyf h SER 292 N -0.41 -0.20 -0.66 7.02 0.02 -1.98 0.15 113.55 117.48 3dyf h SER 292 Ca -0.45 0.16 0.09 0.00 -0.84 0.00 0.00 61.79 60.75 3dyf h SER 292 Cb 1.24 0.27 -0.07 0.00 0.14 0.00 0.00 62.40 63.98 3dyf h SER 292 CO 0.63 -0.11 0.30 0.00 -1.14 0.00 0.00 176.83 176.50 3dyf h ALA 293 N 1.62 0.89 -0.15 3.77 0.00 -2.00 -0.74 119.26 122.65 3dyf h ALA 293 Ca 0.38 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.28 3dyf h ALA 293 Cb 0.65 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 3dyf h ALA 293 CO -0.56 -0.11 -0.21 1.96 0.00 0.00 0.00 179.25 180.32 3dyf h GLN 294 N 0.52 0.41 -0.84 0.00 4.20 -1.36 -2.89 115.11 115.15 3dyf h GLN 294 Ca 0.33 -0.24 0.06 0.00 0.06 0.00 0.00 58.65 58.86 3dyf h GLN 294 Cb 0.37 0.02 -0.06 0.00 0.30 0.00 0.00 27.48 28.10 3dyf h GLN 294 CO -0.28 0.82 0.52 0.28 -0.67 0.00 0.00 178.83 179.50 3dyf h VAL 295 N 0.03 1.03 -0.46 -0.54 2.07 -0.38 -1.23 116.25 116.77 3dyf h VAL 295 Ca 0.02 -0.32 -0.05 0.00 0.82 0.00 0.00 66.70 67.17 3dyf h VAL 295 Cb 0.77 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.53 3dyf h VAL 295 CO 0.05 0.17 0.10 0.00 0.02 0.00 0.00 177.57 177.91 3dyf h ALA 296 N 1.40 0.61 0.00 1.67 0.00 -1.16 -1.66 119.26 120.12 3dyf h ALA 296 Ca 0.37 -0.21 -0.05 0.00 0.00 0.00 0.00 54.91 55.03 3dyf h ALA 296 Cb 0.18 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3dyf h ALA 296 CO -0.18 0.30 -0.22 1.49 0.00 0.00 0.00 179.25 180.65 3dyf h GLU 297 N 0.61 0.00 0.46 0.00 4.81 -1.25 -2.75 114.58 116.46 3dyf h GLU 297 Ca 0.14 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.35 3dyf h GLU 297 Cb 0.34 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 3dyf h GLU 297 CO 0.00 0.22 -0.22 0.35 -0.73 0.00 0.00 179.01 178.63 3dyf h PHE 298 N 0.00 -0.57 -0.75 0.92 3.57 -0.58 -2.87 116.94 116.66 3dyf h PHE 298 Ca -0.00 -0.01 0.22 0.00 3.53 0.00 0.00 57.97 61.70 3dyf h PHE 298 Cb 0.41 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.30 3dyf h PHE 298 CO 0.00 -0.35 0.80 0.87 -2.23 0.00 0.00 178.31 177.40 3dyf h LYS 299 N -0.70 0.00 -0.00 1.11 1.57 -1.21 0.58 116.57 117.91 3dyf h LYS 299 Ca -0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3dyf h LYS 299 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 3dyf h LYS 299 CO 0.10 0.00 -0.34 0.00 -0.57 0.00 0.00 179.45 178.65 3dyf n ALA 300 N -2.35 3.20 -0.33 3.86 0.00 -1.05 -4.19 120.51 119.65 3dyf n ALA 300 Ca 0.16 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3dyf n ALA 300 Cb 1.06 -1.19 0.00 0.00 0.00 0.00 0.00 19.45 19.32 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 -1.21 0.36 -4.71 0.00 3.02 0.18 -5.04 115.26 107.85 3dyf n ASN 301 Ca 0.08 -0.77 -0.36 0.00 -0.03 0.00 0.00 54.58 53.50 3dyf n ASN 301 Cb 0.33 0.16 -0.07 0.00 -0.61 0.00 0.00 39.78 39.59 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 -0.16 3.43 0.00 3.10 5.04 0.01 -4.23 117.35 124.53 3dyf s TYR 302 Ca 0.00 0.53 0.00 0.00 -2.44 0.00 0.00 57.07 55.16 3dyf s TYR 302 Cb 0.00 -2.34 0.00 0.00 0.35 0.00 0.00 41.96 39.97 3dyf s TYR 302 CO 0.00 0.19 0.00 0.41 -1.34 0.00 0.00 175.55 174.81 3dyf n GLY 303 N 3.57 1.92 3.04 8.97 0.00 -0.75 -4.92 105.19 117.02 3dyf n GLY 303 Ca -0.12 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.79 3dyf n GLY 303 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dyf s SER 304 N -2.01 0.13 0.00 1.61 1.04 -1.24 -4.86 113.70 108.36 3dyf s SER 304 Ca 0.00 -0.35 0.30 0.00 0.48 0.00 0.00 55.95 56.38 3dyf s SER 304 Cb 0.00 0.15 1.40 0.00 0.10 0.00 0.00 66.02 67.67 3dyf s SER 304 CO 0.00 -0.33 2.00 0.61 0.98 0.00 0.00 173.24 176.50 3dyf n GLY 305 N 1.56 -1.38 3.62 7.32 0.00 -1.26 -4.30 105.19 110.75 3dyf n GLY 305 Ca -0.23 -0.12 -0.49 0.00 0.00 0.00 0.00 46.02 45.17 3dyf n GLY 305 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3dyf n ASP 306 N -1.38 3.05 -0.30 1.61 -0.08 -1.26 -4.83 116.55 113.35 3dyf n ASP 306 Ca 0.11 0.77 0.05 0.00 -1.51 0.00 0.00 54.79 54.21 3dyf n ASP 306 Cb 0.29 -1.35 0.20 0.00 2.34 0.00 0.00 41.12 42.60 3dyf n ASP 306 CO 0.00 0.00 0.00 -1.28 0.12 0.00 0.00 177.20 176.04 3dyf h SER 307 N 10.46 0.66 -0.24 1.67 0.87 -2.00 -1.67 113.55 123.32 3dyf h SER 307 Ca -0.43 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.17 3dyf h SER 307 Cb 1.28 -0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 63.18 3dyf h SER 307 CO 0.97 0.34 0.04 -0.33 -0.53 0.00 0.00 176.83 177.32 3dyf h GLU 308 N 0.76 0.39 -0.52 2.24 5.08 -1.98 -1.93 114.58 118.62 3dyf h GLU 308 Ca 0.44 -0.10 0.02 0.00 -1.00 0.00 0.00 59.36 58.72 3dyf h GLU 308 Cb 0.50 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 3dyf h GLU 308 CO -0.29 0.52 0.31 0.87 -1.00 0.00 0.00 179.01 179.42 3dyf h LYS 309 N 0.20 0.60 -0.58 2.33 1.57 -1.76 -2.28 116.57 116.65 3dyf h LYS 309 Ca 0.07 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 3dyf h LYS 309 Cb 0.32 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 3dyf h LYS 309 CO 0.00 0.40 0.37 0.28 -0.57 0.00 0.00 179.45 179.94 3dyf h VAL 310 N 0.62 1.15 0.00 0.50 2.07 -1.18 -1.10 116.25 118.31 3dyf h VAL 310 Ca 0.21 -0.29 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 3dyf h VAL 310 Cb 0.02 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 3dyf h VAL 310 CO -0.09 0.15 -0.27 0.00 0.02 0.00 0.00 177.57 177.37 3dyf h ALA 311 N 1.63 1.09 0.05 1.67 0.00 -0.80 -2.69 119.26 120.20 3dyf h ALA 311 Ca 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 3dyf h ALA 311 Cb -0.08 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3dyf h ALA 311 CO -0.04 0.34 -0.02 1.15 0.00 0.00 0.00 179.25 180.67 3dyf h THR 312 N 0.00 1.28 -0.95 0.00 2.02 -0.75 -2.44 112.91 112.07 3dyf h THR 312 Ca -0.00 -1.17 0.13 0.00 0.77 0.00 0.00 66.41 66.14 3dyf h THR 312 Cb 0.71 2.04 -0.09 0.00 -1.74 0.00 0.00 68.15 69.08 3dyf h THR 312 CO 0.04 0.29 0.57 0.58 0.37 0.00 0.00 175.52 177.37 3dyf h VAL 313 N -0.59 0.87 -0.57 3.16 2.07 -1.38 0.22 116.25 120.03 3dyf h VAL 313 Ca -0.01 -0.30 0.03 0.00 0.82 0.00 0.00 66.70 67.24 3dyf h VAL 313 Cb 0.52 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 3dyf h VAL 313 CO 0.01 0.16 0.33 -0.09 0.02 0.00 0.00 177.57 178.01 3dyf h ARG 314 N 0.88 0.64 -0.26 1.57 9.65 -1.43 -1.56 114.38 123.87 3dyf h ARG 314 Ca 0.48 -0.04 -0.05 0.00 -1.10 0.00 0.00 59.98 59.28 3dyf h ARG 314 Cb 0.54 -0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 28.96 3dyf h ARG 314 CO -0.29 0.42 -0.02 -0.09 2.80 0.00 0.00 179.97 182.79 3dyf h ARG 315 N 0.65 0.46 -0.79 0.20 2.43 -0.41 -2.76 114.38 114.16 3dyf h ARG 315 Ca 0.23 -0.16 0.12 0.00 -0.81 0.00 0.00 59.98 59.37 3dyf h ARG 315 Cb 0.05 -0.04 -0.08 0.00 -0.42 0.00 0.00 29.97 29.48 3dyf h ARG 315 CO -0.11 0.65 0.40 -0.07 -1.51 0.00 0.00 179.97 179.33 3dyf h LEU 316 N 0.23 0.50 -0.74 3.80 3.38 -0.32 0.90 115.31 123.06 3dyf h LEU 316 Ca 0.07 0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 3dyf h LEU 316 Cb 0.45 -0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 3dyf h LEU 316 CO 0.02 0.25 0.45 1.88 0.09 0.00 0.00 178.44 181.12 3dyf h TYR 317 N 0.62 0.97 -0.16 1.13 0.05 -1.16 -1.75 116.97 116.67 3dyf h TYR 317 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.19 3dyf h TYR 317 Cb 0.52 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.93 3dyf h TYR 317 CO -0.10 0.64 0.10 0.93 -1.05 0.00 0.00 178.16 178.69 3dyf h GLU 318 N 1.01 0.21 -0.97 4.88 5.08 -0.71 -2.68 114.58 121.39 3dyf h GLU 318 Ca 0.27 -0.01 0.14 0.00 -1.00 0.00 0.00 59.36 58.75 3dyf h GLU 318 Cb -0.05 -0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.07 3dyf h GLU 318 CO -0.05 0.14 0.61 0.93 -1.00 0.00 0.00 179.01 179.64 3dyf h GLU 319 N 0.21 0.84 0.00 2.33 5.08 -0.44 0.65 114.58 123.26 3dyf h GLU 319 Ca 0.06 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 3dyf h GLU 319 Cb -0.02 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.04 3dyf h GLU 319 CO -0.01 0.56 0.00 0.00 -1.00 0.00 0.00 179.01 178.56 3dyf n ALA 320 N -2.37 2.54 -3.61 3.43 0.00 -0.70 -4.90 120.51 114.90 3dyf n ALA 320 Ca 0.19 -0.14 -0.23 0.00 0.00 0.00 0.00 53.44 53.26 3dyf n ALA 320 Cb 0.43 -1.36 0.04 0.00 0.00 0.00 0.00 19.45 18.56 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 -0.88 -3.51 -0.09 0.00 2.03 0.22 -4.90 116.55 109.43 3dyf n ASP 321 Ca 0.17 -0.87 -0.08 0.00 0.52 0.00 0.00 54.79 54.53 3dyf n ASP 321 Cb 0.08 -4.04 0.08 0.00 -0.72 0.00 0.00 41.12 36.52 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 -1.73 0.79 -1.55 -2.67 3.38 -1.73 -2.19 115.31 109.62 3dyf h LEU 322 Ca -0.63 -0.29 0.18 0.00 0.09 0.00 0.00 57.88 57.23 3dyf h LEU 322 Cb 1.35 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.82 3dyf h LEU 322 CO 0.51 1.00 0.56 1.56 0.09 0.00 0.00 178.44 182.16 3dyf h GLN 323 N 0.67 0.39 -0.56 1.13 1.08 -1.90 0.92 115.11 116.84 3dyf h GLN 323 Ca 0.09 -0.02 -0.07 0.00 -1.45 0.00 0.00 58.65 57.19 3dyf h GLN 323 Cb 0.75 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.07 3dyf h GLN 323 CO 0.06 0.26 0.06 0.78 -0.95 0.00 0.00 178.83 179.04 3dyf h GLY 324 N 0.40 1.02 1.17 3.46 0.00 -1.76 -0.16 103.07 107.21 3dyf h GLY 324 Ca 0.43 -0.70 -0.07 0.00 0.00 0.00 0.00 47.33 46.98 3dyf h GLY 324 CO -0.15 0.65 0.12 -0.55 0.00 0.00 0.00 176.54 176.61 3dyf h ASP 325 N 0.84 0.97 0.55 0.19 3.32 0.74 -2.94 116.42 120.08 3dyf h ASP 325 Ca 0.17 -0.21 -0.03 0.00 0.02 0.00 0.00 57.03 56.98 3dyf h ASP 325 Cb 0.45 -0.25 0.01 0.00 0.22 0.00 0.00 39.33 39.75 3dyf h ASP 325 CO 0.02 0.95 -0.26 0.22 -1.72 0.00 0.00 179.24 178.45 3dyf h TYR 326 N 0.96 -0.68 -0.96 4.55 3.20 0.46 -2.01 116.97 122.49 3dyf h TYR 326 Ca 0.20 -0.02 0.22 0.00 3.14 0.00 0.00 58.73 62.27 3dyf h TYR 326 Cb 0.39 0.23 -0.12 0.00 1.54 0.00 0.00 36.73 38.77 3dyf h TYR 326 CO 0.03 -0.37 0.54 0.28 -1.64 0.00 0.00 178.16 176.99 3dyf h VAL 327 N -0.88 0.58 0.41 1.81 2.07 -1.04 0.29 116.25 119.49 3dyf h VAL 327 Ca -0.08 -0.20 -0.02 0.00 0.82 0.00 0.00 66.70 67.22 3dyf h VAL 327 Cb 0.62 -0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 3dyf h VAL 327 CO 0.12 0.11 -0.20 0.00 0.02 0.00 0.00 177.57 177.62 3dyf h ALA 328 N 1.69 -0.56 -0.24 1.67 0.00 -1.39 -1.12 119.26 119.32 3dyf h ALA 328 Ca 0.59 -0.17 0.06 0.00 0.00 0.00 0.00 54.91 55.39 3dyf h ALA 328 Cb 1.06 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 3dyf h ALA 328 CO -0.46 -0.72 -0.16 -0.92 0.00 0.00 0.00 179.25 176.99 3dyf h TYR 329 N -0.75 -0.42 -0.77 0.00 3.20 -0.47 0.42 116.97 118.19 3dyf h TYR 329 Ca -0.06 0.03 0.13 0.00 3.14 0.00 0.00 58.73 61.97 3dyf h TYR 329 Cb 0.52 0.22 -0.09 0.00 1.54 0.00 0.00 36.73 38.93 3dyf h TYR 329 CO -0.01 -0.24 0.37 1.49 -1.64 0.00 0.00 178.16 178.13 3dyf h GLU 330 N -0.15 0.54 -0.19 1.82 4.81 -0.42 0.24 114.58 121.22 3dyf h GLU 330 Ca 0.13 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.32 3dyf h GLU 330 Cb 0.36 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.61 3dyf h GLU 330 CO -0.33 0.36 0.06 0.00 -0.73 0.00 0.00 179.01 178.37 3dyf h ALA 331 N 1.51 0.25 -0.80 2.92 0.00 0.15 0.19 119.26 123.48 3dyf h ALA 331 Ca 0.41 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 3dyf h ALA 331 Cb 0.55 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.22 3dyf h ALA 331 CO -0.34 -0.13 0.38 0.00 0.00 0.00 0.00 179.25 179.16 3dyf h ALA 332 N 0.88 1.17 -0.06 0.00 0.00 -0.24 -1.01 119.26 120.00 3dyf h ALA 332 Ca 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 3dyf h ALA 332 Cb 0.23 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3dyf h ALA 332 CO -0.00 0.63 -0.05 0.28 0.00 0.00 0.00 179.25 180.11 3dyf h VAL 333 N 1.14 1.37 -0.29 0.00 2.07 -0.82 -2.53 116.25 117.19 3dyf h VAL 333 Ca 0.28 -1.18 0.08 0.00 0.82 0.00 0.00 66.70 66.70 3dyf h VAL 333 Cb 0.11 2.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 3dyf h VAL 333 CO -0.04 0.32 0.29 0.00 0.02 0.00 0.00 177.57 178.17 3dyf h ALA 334 N 0.56 1.99 -0.69 1.67 0.00 -0.41 -0.71 119.26 121.67 3dyf h ALA 334 Ca 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dyf h ALA 334 Cb 0.55 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3dyf h ALA 334 CO 0.01 -0.43 0.00 -1.91 0.00 0.00 0.00 179.25 176.92 3dyf n GLU 335 N -3.88 0.00 -0.35 0.00 4.07 -0.40 -2.65 120.64 117.43 3dyf n GLU 335 Ca 0.04 0.38 0.10 0.00 -0.06 0.00 0.00 57.16 57.62 3dyf n GLU 335 Cb 0.44 -1.24 0.28 0.00 -0.06 0.00 0.00 31.44 30.86 3dyf n GLU 335 CO 0.00 0.00 0.00 1.96 -0.06 0.00 0.00 177.13 179.03 3dyf h GLN 336 N 0.00 0.86 -0.80 5.31 4.20 -1.14 0.44 115.11 123.98 3dyf h GLN 336 Ca 0.00 -0.05 0.08 0.00 0.06 0.00 0.00 58.65 58.74 3dyf h GLN 336 Cb 0.00 -0.19 -0.07 0.00 0.30 0.00 0.00 27.48 27.52 3dyf h GLN 336 CO 0.00 0.57 0.46 0.28 -0.67 0.00 0.00 178.83 179.47 3dyf h VAL 337 N 0.89 0.95 0.18 -0.54 2.07 -1.24 0.84 116.25 119.38 3dyf h VAL 337 Ca 0.52 -0.27 -0.01 0.00 0.82 0.00 0.00 66.70 67.76 3dyf h VAL 337 Cb 0.65 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 3dyf h VAL 337 CO -0.29 0.15 -0.08 0.50 0.02 0.00 0.00 177.57 177.86 3dyf h LYS 338 N 0.80 -0.23 0.53 1.57 1.63 -0.69 -1.99 116.57 118.19 3dyf h LYS 338 Ca 0.37 0.02 -0.02 0.00 -0.85 0.00 0.00 60.65 60.17 3dyf h LYS 338 Cb 0.29 0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.96 3dyf h LYS 338 CO -0.22 -0.13 -0.38 0.93 -3.45 0.00 0.00 179.45 176.20 3dyf h GLU 339 N -0.26 -0.83 -0.94 1.90 5.08 -0.79 -2.84 114.58 115.90 3dyf h GLU 339 Ca -0.02 0.06 0.24 0.00 -1.00 0.00 0.00 59.36 58.64 3dyf h GLU 339 Cb 0.20 0.19 -0.13 0.00 0.50 0.00 0.00 28.75 29.51 3dyf h GLU 339 CO 0.04 -0.55 0.46 -0.07 -1.00 0.00 0.00 179.01 177.88 3dyf h LEU 340 N -0.86 0.42 -1.33 1.33 4.07 -0.88 0.32 115.31 118.38 3dyf h LEU 340 Ca -0.07 0.16 0.01 0.00 0.08 0.00 0.00 57.88 58.06 3dyf h LEU 340 Cb 0.71 0.12 -0.04 0.00 1.08 0.00 0.00 40.66 42.53 3dyf h LEU 340 CO 0.04 -0.01 0.46 0.40 -1.08 0.00 0.00 178.44 178.25 3dyf h ILE 341 N 0.42 1.16 -0.11 1.22 2.04 -1.21 -1.22 117.51 119.81 3dyf h ILE 341 Ca 0.61 -0.31 -0.11 0.00 1.00 0.00 0.00 64.86 66.04 3dyf h ILE 341 Cb 1.20 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 3dyf h ILE 341 CO -0.54 0.17 -0.44 -0.33 0.00 0.00 0.00 178.15 177.01 3dyf h GLU 342 N 0.92 0.25 -0.69 2.37 4.39 -0.15 0.02 114.58 121.69 3dyf h GLU 342 Ca 0.26 -0.12 -0.04 0.00 0.34 0.00 0.00 59.36 59.79 3dyf h GLU 342 Cb -0.07 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 3dyf h GLU 342 CO -0.06 0.65 0.25 0.87 -1.16 0.00 0.00 179.01 179.56 3dyf h LYS 343 N 0.20 1.04 0.80 2.33 1.57 -0.59 -2.84 116.57 119.09 3dyf h LYS 343 Ca 0.02 -0.20 -0.04 0.00 -1.87 0.00 0.00 60.65 58.55 3dyf h LYS 343 Cb 0.86 -0.16 0.01 0.00 0.08 0.00 0.00 32.23 33.02 3dyf h LYS 343 CO 0.07 0.88 -0.39 -0.07 -0.57 0.00 0.00 179.45 179.37 3dyf h LEU 344 N 0.99 -0.91 -0.66 2.94 3.38 -0.95 -3.05 115.31 117.04 3dyf h LEU 344 Ca 0.23 0.03 0.24 0.00 0.09 0.00 0.00 57.88 58.47 3dyf h LEU 344 Cb 0.24 0.24 -0.12 0.00 0.09 0.00 0.00 40.66 41.11 3dyf h LEU 344 CO -0.01 -0.60 0.23 -1.14 0.09 0.00 0.00 178.44 177.01 3dyf n ARG 345 N -5.22 -0.04 -0.01 1.13 0.63 -0.04 0.42 116.66 113.53 3dyf n ARG 345 Ca -0.13 0.94 -0.10 0.00 -0.92 0.00 0.00 57.85 57.64 3dyf n ARG 345 Cb 0.43 -1.61 -0.06 0.00 0.45 0.00 0.00 32.46 31.66 3dyf n ARG 345 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 3dyf h LEU 346 N 0.00 -1.11 0.00 6.15 3.38 -1.38 -2.73 115.31 119.62 3dyf h LEU 346 Ca 0.50 0.13 0.00 0.00 0.09 0.00 0.00 57.88 58.60 3dyf h LEU 346 Cb 1.23 0.43 0.00 0.00 0.09 0.00 0.00 40.66 42.42 3dyf h LEU 346 CO -0.55 -0.31 -0.99 0.00 0.09 0.00 0.00 178.44 176.68 3dyf n SER 348 N -2.52 -0.11 -0.21 0.00 7.64 0.17 -4.96 113.62 113.62 3dyf n SER 348 Ca 0.00 -2.48 -0.08 0.00 1.01 0.00 0.00 58.87 57.32 3dyf n SER 348 Cb 0.52 -0.58 0.03 0.00 -1.01 0.00 0.00 64.21 63.17 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 5.41 0.97 -0.26 1.43 0.13 -1.69 0.25 132.00 138.24 3dyf h PRO 349 Ca 0.24 -0.24 -0.11 0.00 -0.87 0.00 0.00 66.00 65.01 3dyf h PRO 349 Cb 0.89 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.89 3dyf h PRO 349 CO 0.41 0.90 -0.31 0.78 -0.23 0.00 0.00 178.00 179.55 3dyf h GLY 350 N 0.88 0.58 0.95 1.56 0.00 -1.90 -1.85 103.07 103.30 3dyf h GLY 350 Ca 0.19 -0.51 -0.23 0.00 0.00 0.00 0.00 47.33 46.77 3dyf h GLY 350 CO 0.00 0.47 -0.96 -2.75 0.00 0.00 0.00 176.54 173.30 3dyf h PHE 351 N 0.46 0.77 -0.88 5.60 3.57 -1.84 -2.79 116.94 121.83 3dyf h PHE 351 Ca 0.06 -0.49 0.07 0.00 3.53 0.00 0.00 57.97 61.13 3dyf h PHE 351 Cb 0.77 -0.06 -0.06 0.00 2.79 0.00 0.00 35.95 39.39 3dyf h PHE 351 CO 0.03 1.35 0.57 0.00 -2.23 0.00 0.00 178.31 178.03 3dyf h ALA 352 N 0.23 1.56 -0.08 2.41 0.00 -0.92 0.73 119.26 123.18 3dyf h ALA 352 Ca -0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 3dyf h ALA 352 Cb 1.69 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.23 3dyf h ALA 352 CO 0.18 0.31 0.03 0.00 0.00 0.00 0.00 179.25 179.76 3dyf h ALA 353 N 1.53 0.11 -0.81 0.00 0.00 -1.35 -0.69 119.26 118.06 3dyf h ALA 353 Ca 0.38 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.18 3dyf h ALA 353 Cb 0.24 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3dyf h ALA 353 CO -0.14 -0.28 0.53 0.66 0.00 0.00 0.00 179.25 180.02 3dyf h SER 354 N -0.06 0.93 -0.41 0.00 4.64 -1.08 -1.42 113.55 116.15 3dyf h SER 354 Ca 0.03 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3dyf h SER 354 Cb 0.22 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.06 3dyf h SER 354 CO -0.00 0.67 0.23 0.58 -0.87 0.00 0.00 176.83 177.44 3dyf h VAL 355 N 1.09 1.15 -0.99 0.95 2.07 -0.52 -1.97 116.25 118.03 3dyf h VAL 355 Ca 0.29 -0.38 0.08 0.00 0.82 0.00 0.00 66.70 67.52 3dyf h VAL 355 Cb -0.12 0.66 -0.07 0.00 -1.52 0.00 0.00 31.29 30.23 3dyf h VAL 355 CO -0.06 0.15 0.64 -0.33 0.02 0.00 0.00 177.57 177.99 3dyf h GLU 356 N 0.53 1.08 -0.19 1.57 5.08 -0.18 0.53 114.58 123.00 3dyf h GLU 356 Ca 0.14 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 3dyf h GLU 356 Cb 0.05 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 3dyf h GLU 356 CO -0.02 0.71 0.10 1.15 -1.00 0.00 0.00 179.01 179.95 3dyf h THR 357 N 1.11 1.00 -0.87 1.13 2.02 -0.59 0.13 112.91 116.84 3dyf h THR 357 Ca 0.44 -0.07 0.00 0.00 0.77 0.00 0.00 66.41 67.56 3dyf h THR 357 Cb 0.25 0.77 -0.04 0.00 -1.74 0.00 0.00 68.15 67.39 3dyf h THR 357 CO -0.19 0.04 0.56 0.25 0.37 0.00 0.00 175.52 176.55 3dyf h LEU 358 N 0.21 1.02 -1.53 2.58 6.46 -0.59 0.34 115.31 123.79 3dyf h LEU 358 Ca 0.08 -0.04 -0.05 0.00 -0.12 0.00 0.00 57.88 57.75 3dyf h LEU 358 Cb 0.02 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.68 3dyf h LEU 358 CO -0.05 0.75 -0.24 -0.25 -0.62 0.00 0.00 178.44 178.03 3dyf h TRP 359 N 1.19 0.00 -0.35 1.25 -0.00 -0.41 -1.80 115.95 115.83 3dyf h TRP 359 Ca 0.32 0.00 -0.14 0.00 -0.00 0.00 0.00 58.89 59.07 3dyf h TRP 359 Cb -0.11 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.04 3dyf h TRP 359 CO -0.01 0.24 -0.34 0.78 -0.00 0.00 0.00 178.44 179.11 3dyf h GLY 360 N 1.07 0.85 2.00 2.65 0.00 0.13 0.28 103.07 110.05 3dyf h GLY 360 Ca -0.00 -0.81 0.00 0.00 0.00 0.00 0.00 47.33 46.51 3dyf h GLY 360 CO 0.03 0.74 0.00 0.50 0.00 0.00 0.00 176.54 177.81 3dyf h LYS 361 N 0.65 0.00 0.00 4.80 1.57 -0.45 -3.35 116.57 119.80 3dyf h LYS 361 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 3dyf h LYS 361 Cb 0.88 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.19 3dyf h LYS 361 CO 0.08 0.00 -0.85 2.41 -0.57 0.00 0.00 179.45 180.52 3dyf n THR 362 N -2.65 1.43 -1.63 -0.16 -1.04 -0.93 -4.71 114.28 104.58 3dyf n THR 362 Ca 0.02 0.17 -0.62 0.00 -2.04 0.00 0.00 64.05 61.57 3dyf n THR 362 Cb 0.29 -2.33 -0.09 0.00 -1.82 0.00 0.00 70.33 66.38 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 -4.43 1.30 -4.10 -1.42 9.36 0.04 -0.93 117.16 116.98 3dyf n TYR 363 Ca -0.12 1.03 -0.33 0.00 3.32 0.00 0.00 57.90 61.80 3dyf n TYR 363 Cb 0.44 -2.20 -0.01 0.00 -0.63 0.00 0.00 39.34 36.94 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 2.96 -3.75 -1.73 2.98 5.02 -1.26 -4.92 118.16 117.47 3dyf n LYS 364 Ca 0.25 0.43 -0.36 0.00 -2.02 0.00 0.00 58.31 56.62 3dyf n LYS 364 Cb 0.03 -5.08 0.07 0.00 -0.02 0.00 0.00 35.03 30.03 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 -6.78 2.55 0.11 1.97 1.70 -0.11 -4.94 118.95 113.46 3dyf s ARG 365 Ca 0.57 1.90 0.22 0.00 -0.47 0.00 0.00 55.73 57.96 3dyf s ARG 365 Cb -0.31 -1.87 -0.11 0.00 -0.57 0.00 0.00 34.95 32.10 3dyf s ARG 365 CO 0.90 -1.56 0.85 1.04 -1.08 0.00 0.00 175.30 175.45 3dyf n GLN 366 N -2.06 0.59 0.00 3.89 1.13 -1.26 -5.14 117.38 114.52 3dyf n GLN 366 Ca 0.14 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.21 3dyf n GLN 366 Cb 0.49 -1.70 0.00 0.00 0.11 0.00 0.00 30.24 29.14 3dyf n GLN 366 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98