#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3exf s MET 0 N 0.00 3.65 0.22 1.57 -2.45 -1.26 -5.08 119.30 115.95 3exf s MET 0 Ca 0.00 0.06 0.09 0.00 -1.25 0.00 0.00 55.69 54.60 3exf s MET 0 Cb 0.00 -3.14 -0.04 0.00 1.25 0.00 0.00 34.83 32.90 3exf s MET 0 CO 0.00 0.69 -0.06 -0.06 1.05 0.00 0.00 175.02 176.64 3exf s PHE 1 N -1.18 2.65 0.35 4.11 0.08 -1.26 -5.08 117.98 117.64 3exf s PHE 1 Ca 0.24 -0.22 -0.28 0.00 0.12 0.00 0.00 56.93 56.79 3exf s PHE 1 Cb -0.14 -1.23 -0.10 0.00 -0.57 0.00 0.00 43.02 40.99 3exf s PHE 1 CO 0.12 0.58 1.26 0.00 -0.10 0.00 0.00 175.22 177.08 3exf s ALA 2 N -2.04 3.40 -0.04 5.36 0.00 0.03 -4.93 121.76 123.54 3exf s ALA 2 Ca 0.28 1.16 0.23 0.00 0.00 0.00 0.00 51.96 53.63 3exf s ALA 2 Cb -0.07 -3.44 0.67 0.00 0.00 0.00 0.00 23.12 20.28 3exf s ALA 2 CO 0.17 -0.58 1.72 -0.91 0.00 0.00 0.00 175.76 176.16 3exf h ASN 3 N 3.23 0.00 -2.54 0.00 2.35 -1.95 -3.43 115.58 113.24 3exf h ASN 3 Ca -0.49 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.28 3exf h ASN 3 Cb 1.23 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.60 3exf h ASN 3 CO 0.65 0.22 0.30 -0.90 -1.65 0.00 0.00 177.43 176.04 3exf n ASP 4 N -3.26 -1.80 -3.65 5.81 5.75 -1.26 -1.26 116.55 116.88 3exf n ASP 4 Ca 0.01 -2.18 -0.03 0.00 -0.01 0.00 0.00 54.79 52.58 3exf n ASP 4 Cb 0.50 2.98 -0.01 0.00 -1.03 0.00 0.00 41.12 43.56 3exf n ASP 4 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3exf s ALA 5 N -1.89 -1.90 -0.06 2.12 0.00 -0.96 -4.95 121.76 114.11 3exf s ALA 5 Ca 0.15 0.65 0.06 0.00 0.00 0.00 0.00 51.96 52.82 3exf s ALA 5 Cb -0.04 0.42 -0.01 0.00 0.00 0.00 0.00 23.12 23.49 3exf s ALA 5 CO 0.09 -0.92 -0.25 0.99 0.00 0.00 0.00 175.76 175.67 3exf s THR 6 N -2.90 2.05 -0.03 0.00 2.01 -1.26 0.14 115.64 115.64 3exf s THR 6 Ca 0.11 -1.06 0.02 0.00 0.31 0.00 0.00 61.69 61.07 3exf s THR 6 Cb 0.00 -1.73 0.01 0.00 0.01 0.00 0.00 72.50 70.79 3exf s THR 6 CO -0.03 0.57 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.05 3exf s PHE 7 N -0.12 0.80 0.35 4.92 0.40 -0.51 -4.98 117.98 118.84 3exf s PHE 7 Ca -0.05 -0.21 -0.25 0.00 -0.60 0.00 0.00 56.93 55.82 3exf s PHE 7 Cb -0.14 -0.63 -0.10 0.00 0.51 0.00 0.00 43.02 42.66 3exf s PHE 7 CO 0.04 -0.14 0.99 -1.21 0.70 0.00 0.00 175.22 175.60 3exf s GLU 8 N 0.53 4.42 0.14 0.44 2.02 -1.26 -2.59 118.70 122.40 3exf s GLU 8 Ca -0.07 1.40 0.06 0.00 0.02 0.00 0.00 54.97 56.37 3exf s GLU 8 Cb -0.11 -2.69 -0.04 0.00 0.10 0.00 0.00 34.13 31.39 3exf s GLU 8 CO 0.00 0.12 -0.13 0.96 0.02 0.00 0.00 175.26 176.23 3exf s ILE 9 N -1.65 1.35 0.29 -1.63 -4.36 -0.37 -4.97 121.20 109.87 3exf s ILE 9 Ca 0.53 -1.84 -0.28 0.00 -0.26 0.00 0.00 60.65 58.80 3exf s ILE 9 Cb -0.20 -1.65 -0.14 0.00 1.25 0.00 0.00 42.46 41.73 3exf s ILE 9 CO 0.25 -0.49 1.09 0.29 0.24 0.00 0.00 174.94 176.32 3exf n LYS 10 N 0.30 1.53 -2.60 0.37 4.76 -1.26 -4.77 118.16 116.49 3exf n LYS 10 Ca -0.14 0.54 -0.43 0.00 -2.87 0.00 0.00 58.31 55.41 3exf n LYS 10 Cb 0.58 -1.97 -0.02 0.00 -1.84 0.00 0.00 35.03 31.78 3exf n LYS 10 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 3exf s LYS 11 N -1.55 4.09 0.54 1.97 2.20 -1.26 -4.93 119.74 120.80 3exf s LYS 11 Ca 0.59 1.17 -0.22 0.00 -0.36 0.00 0.00 55.97 57.15 3exf s LYS 11 Cb -0.68 -3.74 -0.05 0.00 -1.51 0.00 0.00 37.83 31.85 3exf s LYS 11 CO 0.60 -0.87 1.29 0.00 -0.36 0.00 0.00 175.35 176.00 3exf s ASP 13 N -0.92 7.32 0.21 0.00 1.01 -1.21 -4.86 116.67 118.22 3exf s ASP 13 Ca 0.71 1.59 0.05 0.00 0.71 0.00 0.00 52.55 55.62 3exf s ASP 13 Cb -0.43 -2.54 -0.03 0.00 1.01 0.00 0.00 42.92 40.93 3exf s ASP 13 CO 0.50 -0.17 0.24 -0.76 0.21 0.00 0.00 175.17 175.19 3exf s LEU 14 N 0.65 4.04 -0.09 1.23 1.43 -1.26 -0.93 118.68 123.74 3exf s LEU 14 Ca 0.47 -0.07 -0.03 0.00 -1.03 0.00 0.00 54.13 53.47 3exf s LEU 14 Cb -0.21 -2.59 0.05 0.00 0.03 0.00 0.00 46.19 43.46 3exf s LEU 14 CO 0.26 -0.01 0.11 -2.28 0.23 0.00 0.00 176.35 174.66 3exf s HIS 15 N -1.94 -0.00 -1.41 0.29 5.65 0.94 -4.87 115.29 113.94 3exf s HIS 15 Ca 0.33 0.23 -0.03 0.00 0.25 0.00 0.00 55.06 55.84 3exf s HIS 15 Cb -0.09 -0.46 0.02 0.00 -1.18 0.00 0.00 32.58 30.87 3exf s HIS 15 CO 0.26 -0.31 0.58 0.54 -0.65 0.00 0.00 174.74 175.15 3exf n ARG 16 N 5.30 -3.96 -3.71 2.88 1.74 -1.26 0.31 116.66 117.95 3exf n ARG 16 Ca -0.04 0.48 -0.13 0.00 -0.77 0.00 0.00 57.85 57.39 3exf n ARG 16 Cb 0.50 -4.85 -0.10 0.00 -1.02 0.00 0.00 32.46 26.99 3exf n ARG 16 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3exf s LEU 17 N -6.93 0.19 -0.22 0.55 1.43 -1.26 -4.69 118.68 107.75 3exf s LEU 17 Ca 0.11 0.92 -0.17 0.00 -1.03 0.00 0.00 54.13 53.97 3exf s LEU 17 Cb -0.06 1.54 -0.12 0.00 0.03 0.00 0.00 46.19 47.57 3exf s LEU 17 CO 0.86 -0.16 -0.13 -0.62 0.23 0.00 0.00 176.35 176.52 3exf n GLU 18 N 3.09 0.55 -3.99 1.70 1.02 -1.26 -4.81 120.64 116.95 3exf n GLU 18 Ca -0.15 0.40 -0.35 0.00 -0.02 0.00 0.00 57.16 57.04 3exf n GLU 18 Cb 0.57 -1.60 -0.11 0.00 -0.02 0.00 0.00 31.44 30.28 3exf n GLU 18 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 3exf s GLU 19 N -2.48 3.84 0.00 3.49 2.12 -1.26 -5.09 118.70 119.32 3exf s GLU 19 Ca -0.31 -0.41 0.00 0.00 0.36 0.00 0.00 54.97 54.62 3exf s GLU 19 Cb 0.08 -3.21 0.00 0.00 0.26 0.00 0.00 34.13 31.26 3exf s GLU 19 CO 0.48 0.13 0.00 0.41 -0.54 0.00 0.00 175.26 175.74 3exf n GLY 20 N 3.96 1.87 3.58 -1.50 0.00 -1.26 -5.11 105.19 106.73 3exf n GLY 20 Ca -0.16 -2.11 -0.37 0.00 0.00 0.00 0.00 46.02 43.38 3exf n GLY 20 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3exf n PRO 21 N -0.83 0.64 -1.35 1.61 -0.01 -1.26 -4.98 135.00 128.81 3exf n PRO 21 Ca 0.00 0.26 -0.42 0.00 -0.01 0.00 0.00 63.50 63.33 3exf n PRO 21 Cb 0.00 -2.10 -0.00 0.00 -0.01 0.00 0.00 33.50 31.39 3exf n PRO 21 CO 0.00 0.00 0.00 -2.30 -0.01 0.00 0.00 175.50 173.19 3exf n PRO 22 N -1.21 0.18 -0.22 0.52 -0.01 -1.26 -4.90 135.00 128.10 3exf n PRO 22 Ca 0.13 0.06 0.11 0.00 -0.01 0.00 0.00 63.50 63.79 3exf n PRO 22 Cb 0.49 -1.16 0.27 0.00 -0.01 0.00 0.00 33.50 33.08 3exf n PRO 22 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 175.50 176.82 3exf n VAL 23 N -0.90 0.58 -3.79 -1.45 0.24 -1.26 -4.91 118.33 106.83 3exf n VAL 23 Ca 0.12 -0.70 -0.13 0.00 -2.04 0.00 0.00 64.34 61.60 3exf n VAL 23 Cb 0.39 0.62 -0.10 0.00 -1.47 0.00 0.00 33.84 33.28 3exf n VAL 23 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3exf s THR 24 N -1.42 0.04 -0.06 3.34 -1.32 -1.26 -1.24 115.64 113.71 3exf s THR 24 Ca 0.38 -0.34 -0.21 0.00 -1.21 0.00 0.00 61.69 60.32 3exf s THR 24 Cb 0.21 -0.49 0.04 0.00 -1.51 0.00 0.00 72.50 70.75 3exf s THR 24 CO 0.29 -0.19 0.47 0.28 -2.21 0.00 0.00 174.62 173.27 3exf s THR 25 N -0.76 0.03 0.22 5.08 -1.32 -1.07 -4.97 115.64 112.84 3exf s THR 25 Ca -0.09 -0.22 -0.12 0.00 -1.21 0.00 0.00 61.69 60.05 3exf s THR 25 Cb -0.04 -0.76 -0.07 0.00 -1.51 0.00 0.00 72.50 70.11 3exf s THR 25 CO 0.02 -0.12 0.58 -0.69 -2.21 0.00 0.00 174.62 172.20 3exf s VAL 26 N -0.95 4.86 -0.10 5.08 1.01 -1.26 -1.43 120.40 127.62 3exf s VAL 26 Ca -0.10 0.68 0.01 0.00 0.00 0.00 0.00 61.98 62.57 3exf s VAL 26 Cb -0.03 -3.66 0.02 0.00 0.00 0.00 0.00 36.38 32.70 3exf s VAL 26 CO 0.05 0.02 -0.11 -0.22 0.00 0.00 0.00 175.10 174.85 3exf s LEU 27 N -2.54 1.50 0.45 3.92 0.20 0.12 -4.96 118.68 117.37 3exf s LEU 27 Ca 0.45 -0.33 -0.03 0.00 0.69 0.00 0.00 54.13 54.91 3exf s LEU 27 Cb -0.12 -0.90 -0.03 0.00 -0.43 0.00 0.00 46.19 44.71 3exf s LEU 27 CO 0.20 -0.03 0.71 0.42 -0.29 0.00 0.00 176.35 177.36 3exf s THR 28 N 1.14 4.79 0.05 3.68 -4.23 -1.26 -2.27 115.64 117.54 3exf s THR 28 Ca -0.05 -0.08 -0.28 0.00 -1.18 0.00 0.00 61.69 60.10 3exf s THR 28 Cb -0.14 -3.80 -0.17 0.00 1.34 0.00 0.00 72.50 69.73 3exf s THR 28 CO -0.02 -0.69 1.47 -0.09 -0.54 0.00 0.00 174.62 174.75 3exf h ARG 29 N 0.37 -0.53 -0.68 3.99 2.43 -1.45 -0.48 114.38 118.02 3exf h ARG 29 Ca -0.48 0.04 0.06 0.00 -0.81 0.00 0.00 59.98 58.79 3exf h ARG 29 Cb 1.22 0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 30.81 3exf h ARG 29 CO 0.61 -0.27 -0.40 -1.91 -1.51 0.00 0.00 179.97 176.49 3exf n GLU 30 N -5.27 -0.30 0.19 0.20 2.13 -1.26 -2.02 120.64 114.31 3exf n GLU 30 Ca -0.11 1.30 -0.14 0.00 0.66 0.00 0.00 57.16 58.86 3exf n GLU 30 Cb 0.27 -1.91 -0.07 0.00 0.27 0.00 0.00 31.44 30.00 3exf n GLU 30 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 3exf h ASP 31 N 0.00 -0.65 -0.99 4.31 3.32 -1.93 -2.99 116.42 117.49 3exf h ASP 31 Ca 0.11 0.05 0.31 0.00 0.02 0.00 0.00 57.03 57.53 3exf h ASP 31 Cb 0.28 0.22 -0.18 0.00 0.22 0.00 0.00 39.33 39.86 3exf h ASP 31 CO -0.64 -0.37 0.17 1.23 -1.72 0.00 0.00 179.24 177.91 3exf h GLY 32 N -0.55 1.54 0.98 2.75 0.00 -0.63 0.32 103.07 107.48 3exf h GLY 32 Ca -0.02 0.07 -0.05 0.00 0.00 0.00 0.00 47.33 47.33 3exf h GLY 32 CO -0.03 -0.60 0.12 1.41 0.00 0.00 0.00 176.54 177.44 3exf h LEU 33 N 0.01 0.77 0.21 3.11 4.07 -1.31 -1.88 115.31 120.29 3exf h LEU 33 Ca 0.67 -0.24 -0.01 0.00 0.08 0.00 0.00 57.88 58.39 3exf h LEU 33 Cb 1.52 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 43.06 3exf h LEU 33 CO -0.88 0.80 -0.10 0.50 -1.08 0.00 0.00 178.44 177.68 3exf h LYS 34 N 0.70 -0.27 -0.62 1.13 3.64 -0.34 -0.10 116.57 120.71 3exf h LYS 34 Ca 0.16 0.02 0.08 0.00 -1.27 0.00 0.00 60.65 59.63 3exf h LYS 34 Cb 0.34 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 32.16 3exf h LYS 34 CO 0.00 -0.03 0.28 1.88 -2.27 0.00 0.00 179.45 179.32 3exf h TYR 35 N -0.49 0.51 0.23 1.91 0.05 -0.92 0.50 116.97 118.76 3exf h TYR 35 Ca -0.03 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 3exf h TYR 35 Cb 0.37 -0.14 -0.01 0.00 1.01 0.00 0.00 36.73 37.96 3exf h TYR 35 CO -0.00 0.19 -0.19 -0.92 -1.05 0.00 0.00 178.16 176.19 3exf h TYR 36 N 0.51 -0.50 -0.89 4.88 3.20 -1.33 -0.06 116.97 122.78 3exf h TYR 36 Ca 0.30 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.32 3exf h TYR 36 Cb 0.29 0.19 -0.07 0.00 1.54 0.00 0.00 36.73 38.68 3exf h TYR 36 CO -0.13 -0.29 0.58 -0.09 -1.64 0.00 0.00 178.16 176.59 3exf h ARG 37 N -0.44 0.64 0.23 1.82 2.43 0.39 -1.46 114.38 117.99 3exf h ARG 37 Ca -0.01 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3exf h ARG 37 Cb 0.39 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 3exf h ARG 37 CO -0.02 0.42 -0.11 0.52 -1.51 0.00 0.00 179.97 179.27 3exf h MET 38 N 0.66 -0.30 -0.86 0.20 2.86 0.25 -1.06 114.93 116.69 3exf h MET 38 Ca 0.45 0.02 0.16 0.00 -2.06 0.00 0.00 59.70 58.28 3exf h MET 38 Cb 0.78 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 32.44 3exf h MET 38 CO -0.21 0.02 0.56 0.52 1.06 0.00 0.00 176.91 178.86 3exf h MET 39 N -0.98 0.52 -0.41 1.72 2.86 -1.03 -0.21 114.93 117.40 3exf h MET 39 Ca -0.03 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.53 3exf h MET 39 Cb 0.45 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 3exf h MET 39 CO 0.05 0.34 0.08 1.96 1.06 0.00 0.00 176.91 180.40 3exf h GLN 40 N 0.53 0.67 0.11 1.72 1.08 -1.24 -1.75 115.11 116.24 3exf h GLN 40 Ca 0.44 -0.17 0.02 0.00 -1.45 0.00 0.00 58.65 57.48 3exf h GLN 40 Cb 0.89 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 28.21 3exf h GLN 40 CO -0.18 0.70 -0.23 1.15 -0.95 0.00 0.00 178.83 179.32 3exf h THR 41 N 0.52 0.48 -0.19 -0.54 2.02 0.31 -1.48 112.91 114.03 3exf h THR 41 Ca 0.13 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.36 3exf h THR 41 Cb 0.35 0.48 -0.07 0.00 -1.74 0.00 0.00 68.15 67.16 3exf h THR 41 CO 0.01 0.00 -0.36 0.58 0.37 0.00 0.00 175.52 176.12 3exf h VAL 42 N -0.43 0.22 -0.09 3.16 2.07 -1.27 -0.83 116.25 119.07 3exf h VAL 42 Ca 0.03 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.59 3exf h VAL 42 Cb 0.46 0.22 -0.06 0.00 -1.52 0.00 0.00 31.29 30.39 3exf h VAL 42 CO -0.14 0.00 -0.37 -0.09 0.02 0.00 0.00 177.57 177.00 3exf h ARG 43 N -0.40 -0.45 -0.97 1.57 9.65 -1.16 0.76 114.38 123.39 3exf h ARG 43 Ca 0.10 0.03 0.11 0.00 -1.10 0.00 0.00 59.98 59.13 3exf h ARG 43 Cb 0.57 0.10 -0.08 0.00 -1.39 0.00 0.00 29.97 29.17 3exf h ARG 43 CO -0.41 -0.30 0.60 0.00 2.80 0.00 0.00 179.97 182.66 3exf h ARG 44 N -0.46 0.94 0.52 0.20 2.47 -0.88 -1.89 114.38 115.27 3exf h ARG 44 Ca 0.08 -0.06 -0.03 0.00 -1.26 0.00 0.00 59.98 58.72 3exf h ARG 44 Cb 0.59 -0.21 0.01 0.00 -1.65 0.00 0.00 29.97 28.71 3exf h ARG 44 CO -0.35 0.62 -0.25 1.98 0.56 0.00 0.00 179.97 182.53 3exf h MET 45 N 0.97 -0.67 -0.65 0.04 4.05 -0.33 0.16 114.93 118.50 3exf h MET 45 Ca 0.47 0.05 0.19 0.00 -0.28 0.00 0.00 59.70 60.12 3exf h MET 45 Cb 0.43 0.15 -0.03 0.00 -0.80 0.00 0.00 31.60 31.36 3exf h MET 45 CO -0.25 -0.41 0.54 0.93 0.23 0.00 0.00 176.91 177.95 3exf h GLU 46 N -0.77 0.00 0.14 0.39 4.39 -0.38 0.33 114.58 118.69 3exf h GLU 46 Ca -0.07 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.30 3exf h GLU 46 Cb 0.56 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.21 3exf h GLU 46 CO 0.12 0.00 -1.68 -0.07 -1.16 0.00 0.00 179.01 176.21 3exf h LEU 47 N 0.00 0.47 -0.55 1.33 3.38 -0.54 -1.52 115.31 117.87 3exf h LEU 47 Ca 0.31 -0.90 0.05 0.00 0.09 0.00 0.00 57.88 57.43 3exf h LEU 47 Cb 1.39 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.94 3exf h LEU 47 CO -0.00 1.74 0.29 0.50 0.09 0.00 0.00 178.44 181.05 3exf h LYS 48 N -0.08 0.53 -0.56 1.13 1.63 -0.33 0.11 116.57 119.00 3exf h LYS 48 Ca -0.35 -0.03 0.06 0.00 -0.85 0.00 0.00 60.65 59.47 3exf h LYS 48 Cb 1.94 -0.12 -0.03 0.00 -0.60 0.00 0.00 32.23 33.42 3exf h LYS 48 CO 0.10 0.35 0.37 0.00 -3.45 0.00 0.00 179.45 176.82 3exf h ALA 49 N 1.30 1.84 -0.28 5.00 0.00 -0.31 0.24 119.26 127.05 3exf h ALA 49 Ca 0.25 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.06 3exf h ALA 49 Cb 0.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3exf h ALA 49 CO -0.17 0.07 -0.13 0.22 0.00 0.00 0.00 179.25 179.24 3exf h ASP 50 N 0.53 0.61 -0.18 0.00 3.58 -0.37 -2.61 116.42 117.98 3exf h ASP 50 Ca 0.24 -0.40 -0.06 0.00 0.42 0.00 0.00 57.03 57.23 3exf h ASP 50 Cb 0.27 -0.17 -0.00 0.00 1.72 0.00 0.00 39.33 41.15 3exf h ASP 50 CO -0.07 0.88 -0.11 -0.61 -2.88 0.00 0.00 179.24 176.46 3exf h GLN 51 N 0.34 0.38 -0.21 0.28 4.15 0.32 -2.20 115.11 118.17 3exf h GLN 51 Ca 0.06 -0.18 0.01 0.00 0.77 0.00 0.00 58.65 59.32 3exf h GLN 51 Cb 0.65 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.32 3exf h GLN 51 CO 0.04 0.70 0.14 -0.07 -1.93 0.00 0.00 178.83 177.72 3exf h LEU 52 N 0.06 0.20 -0.02 -2.39 3.38 -0.63 -2.91 115.31 112.99 3exf h LEU 52 Ca 0.04 -0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.80 3exf h LEU 52 Cb 0.60 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.27 3exf h LEU 52 CO 0.03 0.15 -0.95 0.22 0.09 0.00 0.00 178.44 177.98 3exf h TYR 53 N 0.24 0.00 0.00 1.13 5.03 -1.04 -2.08 116.97 120.25 3exf h TYR 53 Ca 0.08 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.38 3exf h TYR 53 Cb 0.04 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 38.32 3exf h TYR 53 CO -0.00 0.95 -0.05 0.87 -1.32 0.00 0.00 178.16 178.61 3exf h LYS 54 N 0.00 0.00 -0.47 1.82 1.57 -1.22 -2.41 116.57 115.86 3exf h LYS 54 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3exf h LYS 54 Cb 1.72 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.03 3exf h LYS 54 CO 0.12 0.05 0.00 1.04 -0.57 0.00 0.00 179.45 180.10 3exf n GLN 55 N -3.24 2.11 -1.85 3.15 6.02 -0.87 -4.93 117.38 117.78 3exf n GLN 55 Ca -0.01 -1.69 -0.15 0.00 -0.01 0.00 0.00 57.00 55.14 3exf n GLN 55 Cb 0.26 -1.37 -0.04 0.00 1.02 0.00 0.00 30.24 30.10 3exf n GLN 55 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3exf n LYS 56 N 0.86 -1.14 0.10 -1.09 4.76 -0.91 -4.90 118.16 115.85 3exf n LYS 56 Ca 0.16 0.90 0.12 0.00 -2.87 0.00 0.00 58.31 56.61 3exf n LYS 56 Cb 0.40 -5.14 0.03 0.00 -1.84 0.00 0.00 35.03 28.47 3exf n LYS 56 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 3exf h ILE 57 N 0.00 0.00 -3.14 -0.18 1.08 -1.62 -3.44 117.51 110.20 3exf h ILE 57 Ca -0.34 -0.93 -0.67 0.00 -0.39 0.00 0.00 64.86 62.53 3exf h ILE 57 Cb 1.13 1.45 -0.12 0.00 -3.07 0.00 0.00 36.82 36.20 3exf h ILE 57 CO 0.45 0.00 -0.59 -0.63 -0.69 0.00 0.00 178.15 176.69 3exf s ILE 58 N -3.33 4.62 0.20 -0.67 1.01 -1.22 -4.16 121.20 117.65 3exf s ILE 58 Ca 0.01 -0.18 0.01 0.00 0.00 0.00 0.00 60.65 60.48 3exf s ILE 58 Cb 0.10 -2.99 -0.00 0.00 0.01 0.00 0.00 42.46 39.58 3exf s ILE 58 CO 0.78 0.56 0.02 0.54 0.00 0.00 0.00 174.94 176.85 3exf n ARG 59 N 1.94 1.21 0.00 2.79 1.74 -1.26 -4.76 116.66 118.32 3exf n ARG 59 Ca -0.18 -1.50 0.00 0.00 -0.77 0.00 0.00 57.85 55.40 3exf n ARG 59 Cb 0.54 0.56 0.00 0.00 -1.02 0.00 0.00 32.46 32.54 3exf n ARG 59 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3exf n GLY 60 N 1.90 2.62 3.75 -0.13 0.00 -1.26 -4.57 105.19 107.50 3exf n GLY 60 Ca -0.06 0.19 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3exf n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3exf s PHE 61 N 0.00 3.80 -0.31 1.61 0.08 -1.26 -4.98 117.98 116.92 3exf s PHE 61 Ca 0.00 1.59 -0.00 0.00 0.12 0.00 0.00 56.93 58.64 3exf s PHE 61 Cb 0.00 -2.86 0.14 0.00 -0.57 0.00 0.00 43.02 39.73 3exf s PHE 61 CO 0.00 0.32 0.29 0.00 -0.10 0.00 0.00 175.22 175.73 3exf s HIS 63 N 2.09 3.39 0.13 0.00 3.76 -1.26 -2.72 115.29 120.67 3exf s HIS 63 Ca 0.11 0.37 0.04 0.00 -0.15 0.00 0.00 55.06 55.43 3exf s HIS 63 Cb -0.15 -2.25 -0.04 0.00 1.11 0.00 0.00 32.58 31.26 3exf s HIS 63 CO -0.26 0.20 0.15 -0.51 -0.85 0.00 0.00 174.74 173.47 3exf s LEU 64 N 0.64 3.95 -0.01 0.89 1.43 -1.26 -4.69 118.68 119.62 3exf s LEU 64 Ca 0.10 -0.01 0.06 0.00 -1.03 0.00 0.00 54.13 53.26 3exf s LEU 64 Cb -0.12 -2.57 0.17 0.00 0.03 0.00 0.00 46.19 43.70 3exf s LEU 64 CO 0.01 0.10 1.14 0.00 0.23 0.00 0.00 176.35 177.84 3exf s ASP 66 N -1.09 6.43 0.00 0.00 1.47 -1.26 -0.93 116.67 121.29 3exf s ASP 66 Ca 0.13 2.79 0.00 0.00 1.18 0.00 0.00 52.55 56.65 3exf s ASP 66 Cb 0.08 -2.59 0.00 0.00 -0.34 0.00 0.00 42.92 40.07 3exf s ASP 66 CO 0.08 -0.95 0.00 0.61 0.68 0.00 0.00 175.17 175.59 3exf n GLY 67 N 4.01 0.84 0.22 2.12 0.00 -1.26 -0.99 105.19 110.13 3exf n GLY 67 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.23 3exf n GLY 67 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3exf n GLN 68 N -0.86 0.86 0.31 1.61 6.02 -0.11 -3.98 117.38 121.23 3exf n GLN 68 Ca 0.00 -1.74 0.21 0.00 -0.01 0.00 0.00 57.00 55.46 3exf n GLN 68 Cb 0.00 -1.01 1.09 0.00 1.02 0.00 0.00 30.24 31.34 3exf n GLN 68 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 177.06 176.98 3exf h GLU 69 N 0.00 0.00 -0.23 -1.09 3.07 -1.89 0.11 114.58 114.55 3exf h GLU 69 Ca 0.00 0.00 -0.16 0.00 -0.50 0.00 0.00 59.36 58.70 3exf h GLU 69 Cb 1.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.02 3exf h GLU 69 CO 0.00 0.00 -0.47 0.00 -1.40 0.00 0.00 179.01 177.14 3exf h ALA 70 N 2.00 0.37 -0.14 3.43 0.00 -1.86 -2.97 119.26 120.10 3exf h ALA 70 Ca 0.00 -0.48 0.05 0.00 0.00 0.00 0.00 54.91 54.48 3exf h ALA 70 Cb 0.03 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 3exf h ALA 70 CO 0.00 0.52 -0.22 0.00 0.00 0.00 0.00 179.25 179.55 3exf h VAL 73 N 0.10 1.18 -0.21 0.00 2.07 -1.59 -2.20 116.25 115.59 3exf h VAL 73 Ca -0.36 -0.61 -0.08 0.00 0.82 0.00 0.00 66.70 66.47 3exf h VAL 73 Cb 2.08 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.52 3exf h VAL 73 CO 0.15 0.23 -0.23 1.23 0.02 0.00 0.00 177.57 178.97 3exf h GLY 74 N 0.82 0.42 0.13 2.17 0.00 -1.13 -1.10 103.07 104.40 3exf h GLY 74 Ca 0.15 -0.33 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 3exf h GLY 74 CO -0.01 0.30 -0.01 1.41 0.00 0.00 0.00 176.54 178.23 3exf h LEU 75 N 0.35 -0.02 -1.59 3.11 4.07 -1.17 -2.36 115.31 117.69 3exf h LEU 75 Ca 0.06 -0.75 0.23 0.00 0.08 0.00 0.00 57.88 57.50 3exf h LEU 75 Cb 0.60 0.01 -0.07 0.00 1.08 0.00 0.00 40.66 42.28 3exf h LEU 75 CO 0.04 0.79 0.63 -0.08 -1.08 0.00 0.00 178.44 178.75 3exf h GLU 76 N -0.89 0.30 0.00 1.13 4.57 -1.50 -1.84 114.58 116.35 3exf h GLU 76 Ca -0.00 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.14 3exf h GLU 76 Cb 0.77 -0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.29 3exf h GLU 76 CO 0.00 0.20 -0.08 0.00 -1.18 0.00 0.00 179.01 177.95 3exf h ALA 77 N 1.59 1.53 0.00 2.92 0.00 -0.65 -3.24 119.26 121.41 3exf h ALA 77 Ca 0.49 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.32 3exf h ALA 77 Cb 1.39 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 3exf h ALA 77 CO -0.16 0.10 -0.21 0.41 0.00 0.00 0.00 179.25 179.39 3exf n GLY 78 N -1.06 4.35 3.33 0.00 0.00 -0.70 -5.04 105.19 106.07 3exf n GLY 78 Ca -0.02 -1.05 -0.20 0.00 0.00 0.00 0.00 46.02 44.75 3exf n GLY 78 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3exf s ILE 79 N -2.56 0.16 0.41 -0.61 -4.36 -1.18 -3.79 121.20 109.28 3exf s ILE 79 Ca 0.30 -2.00 0.08 0.00 -0.26 0.00 0.00 60.65 58.77 3exf s ILE 79 Cb 0.28 -2.47 -0.02 0.00 1.25 0.00 0.00 42.46 41.50 3exf s ILE 79 CO -0.00 0.00 0.37 0.20 0.24 0.00 0.00 174.94 175.74 3exf s ASN 80 N -3.40 5.04 0.43 4.36 -0.87 -1.26 -4.91 114.94 114.32 3exf s ASN 80 Ca 0.36 -0.74 0.18 0.00 -1.57 0.00 0.00 52.86 51.09 3exf s ASN 80 Cb 0.03 -0.59 1.10 0.00 -0.02 0.00 0.00 41.25 41.77 3exf s ASN 80 CO 0.22 -0.64 1.87 1.55 -2.57 0.00 0.00 177.10 177.54 3exf h PRO 81 N 1.05 0.38 -0.00 -0.60 0.13 -2.00 -1.98 132.00 128.97 3exf h PRO 81 Ca -0.42 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 3exf h PRO 81 Cb 1.27 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.31 3exf h PRO 81 CO 0.58 0.25 -0.03 0.25 -0.23 0.00 0.00 178.00 178.82 3exf n THR 82 N -4.49 0.00 -2.19 1.56 -2.24 -1.26 -4.81 114.28 100.84 3exf n THR 82 Ca 0.18 -0.01 -0.27 0.00 -2.27 0.00 0.00 64.05 61.69 3exf n THR 82 Cb 0.67 -0.43 0.12 0.00 -2.10 0.00 0.00 70.33 68.59 3exf n THR 82 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 3exf s ASP 83 N -2.64 4.16 0.02 3.42 1.01 -0.75 -4.79 116.67 117.11 3exf s ASP 83 Ca 0.26 0.22 0.09 0.00 0.71 0.00 0.00 52.55 53.83 3exf s ASP 83 Cb 0.20 -0.61 -0.03 0.00 1.01 0.00 0.00 42.92 43.49 3exf s ASP 83 CO 0.48 -2.03 -0.26 -1.00 0.21 0.00 0.00 175.17 172.57 3exf s HIS 84 N -3.44 2.31 0.00 4.23 3.76 0.71 -4.88 115.29 117.98 3exf s HIS 84 Ca 0.66 -0.42 0.02 0.00 -0.15 0.00 0.00 55.06 55.16 3exf s HIS 84 Cb -0.07 -1.42 -0.01 0.00 1.11 0.00 0.00 32.58 32.19 3exf s HIS 84 CO 0.47 0.07 -0.05 -1.17 -0.85 0.00 0.00 174.74 173.21 3exf s LEU 85 N -1.03 2.05 -0.11 0.89 0.20 -0.93 0.42 118.68 120.16 3exf s LEU 85 Ca 0.11 -0.16 -0.27 0.00 0.69 0.00 0.00 54.13 54.50 3exf s LEU 85 Cb -0.10 -0.23 0.06 0.00 -0.43 0.00 0.00 46.19 45.50 3exf s LEU 85 CO 0.01 0.01 0.63 -0.51 -0.29 0.00 0.00 176.35 176.21 3exf s ILE 86 N -0.32 0.01 0.31 6.68 2.07 -0.71 -1.97 121.20 127.27 3exf s ILE 86 Ca -0.00 -0.05 -0.18 0.00 -1.41 0.00 0.00 60.65 59.01 3exf s ILE 86 Cb -0.03 -0.93 0.03 0.00 0.13 0.00 0.00 42.46 41.66 3exf s ILE 86 CO -0.00 -0.03 0.71 0.28 -1.91 0.00 0.00 174.94 173.99 3exf s THR 87 N -0.72 0.00 0.00 4.00 -1.32 -0.23 -1.33 115.64 116.04 3exf s THR 87 Ca -0.08 -1.06 0.00 0.00 -1.21 0.00 0.00 61.69 59.34 3exf s THR 87 Cb -0.02 -2.32 0.00 0.00 -1.51 0.00 0.00 72.50 68.65 3exf s THR 87 CO 0.06 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.47 3exf n ALA 88 N -0.48 0.00 -0.00 11.08 0.00 -1.26 -2.20 120.51 127.65 3exf n ALA 88 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.39 3exf n ALA 88 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.05 3exf n ALA 88 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3exf n TYR 89 N 0.00 0.00 -1.53 0.00 0.18 -1.23 -0.14 117.16 114.45 3exf n TYR 89 Ca 0.00 0.00 -0.39 0.00 1.88 0.00 0.00 57.90 59.39 3exf n TYR 89 Cb 0.00 0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 38.94 3exf n TYR 89 CO 0.00 0.00 0.00 -2.13 -2.08 0.00 0.00 176.86 172.65 3exf n ARG 90 N -0.90 3.90 0.09 -3.48 0.63 -1.26 -4.58 116.66 111.06 3exf n ARG 90 Ca 0.00 -2.57 0.12 0.00 -0.92 0.00 0.00 57.85 54.48 3exf n ARG 90 Cb 0.00 -2.78 0.25 0.00 0.45 0.00 0.00 32.46 30.38 3exf n ARG 90 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3exf h ALA 91 N 4.96 0.77 -0.72 5.13 0.00 -1.83 -3.42 119.26 124.15 3exf h ALA 91 Ca 0.81 0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.85 3exf h ALA 91 Cb 0.31 0.00 -0.09 0.00 0.00 0.00 0.00 17.79 18.01 3exf h ALA 91 CO 1.71 0.00 0.27 0.45 0.00 0.00 0.00 179.25 181.68 3exf h HIS 92 N 0.00 0.46 -0.16 0.00 3.86 -1.85 0.08 115.15 117.54 3exf h HIS 92 Ca 0.00 0.04 -0.00 0.00 -1.16 0.00 0.00 60.37 59.24 3exf h HIS 92 Cb 0.78 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.15 3exf h HIS 92 CO 0.00 0.06 0.09 0.78 0.86 0.00 0.00 177.93 179.72 3exf h GLY 93 N 0.42 0.23 0.97 2.45 0.00 -1.94 -2.74 103.07 102.47 3exf h GLY 93 Ca 0.39 -0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.61 3exf h GLY 93 CO -0.39 0.10 0.23 0.74 0.00 0.00 0.00 176.54 177.22 3exf h PHE 94 N 0.16 0.56 -0.50 5.60 0.04 -1.31 1.25 116.94 122.74 3exf h PHE 94 Ca 0.06 -0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.91 3exf h PHE 94 Cb 0.06 -0.18 -0.08 0.00 2.20 0.00 0.00 35.95 37.95 3exf h PHE 94 CO -0.04 0.42 0.02 1.15 -0.60 0.00 0.00 178.31 179.26 3exf h THR 95 N 0.53 0.63 0.61 -1.55 2.02 -1.39 -0.02 112.91 113.75 3exf h THR 95 Ca 0.14 -0.05 -0.03 0.00 0.77 0.00 0.00 66.41 67.25 3exf h THR 95 Cb 0.04 0.48 0.01 0.00 -1.74 0.00 0.00 68.15 66.94 3exf h THR 95 CO -0.02 0.02 -0.29 0.15 0.37 0.00 0.00 175.52 175.75 3exf h PHE 96 N 0.14 -0.76 0.00 3.16 3.57 -1.13 -1.68 116.94 120.23 3exf h PHE 96 Ca 0.25 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.73 3exf h PHE 96 Cb 0.37 0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.36 3exf h PHE 96 CO -0.30 -0.46 0.06 0.25 -2.23 0.00 0.00 178.31 175.64 3exf n THR 97 N -5.42 1.67 -1.22 4.41 -2.24 0.43 -2.50 114.28 109.40 3exf n THR 97 Ca -0.13 0.48 0.06 0.00 -2.27 0.00 0.00 64.05 62.19 3exf n THR 97 Cb 0.34 -1.48 0.19 0.00 -2.10 0.00 0.00 70.33 67.29 3exf n THR 97 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3exf n ARG 98 N -1.42 1.84 0.00 -0.78 5.12 -0.13 -4.93 116.66 116.36 3exf n ARG 98 Ca 0.00 -2.90 0.00 0.00 -1.93 0.00 0.00 57.85 53.02 3exf n ARG 98 Cb 0.06 -1.67 0.00 0.00 -1.16 0.00 0.00 32.46 29.69 3exf n ARG 98 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3exf n GLY 99 N -1.10 0.39 3.78 -0.13 0.00 -1.04 -4.81 105.19 102.29 3exf n GLY 99 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 3exf n GLY 99 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3exf s LEU 100 N 0.00 4.53 0.49 0.99 1.02 -0.64 -5.04 118.68 120.02 3exf s LEU 100 Ca 0.00 1.64 -0.02 0.00 0.02 0.00 0.00 54.13 55.77 3exf s LEU 100 Cb 0.00 -3.44 -0.01 0.00 0.02 0.00 0.00 46.19 42.76 3exf s LEU 100 CO 0.00 0.15 0.75 -0.94 0.02 0.00 0.00 176.35 176.32 3exf s SER 101 N -1.29 5.89 0.21 2.29 1.04 -1.26 -4.13 113.70 116.45 3exf s SER 101 Ca 0.39 0.55 -0.02 0.00 0.48 0.00 0.00 55.95 57.34 3exf s SER 101 Cb -0.22 -1.77 0.18 0.00 0.10 0.00 0.00 66.02 64.32 3exf s SER 101 CO 0.25 -0.74 1.57 0.58 0.98 0.00 0.00 173.24 175.88 3exf h VAL 102 N 0.24 1.30 -0.63 5.02 2.07 -1.98 -2.55 116.25 119.72 3exf h VAL 102 Ca -0.46 -1.61 0.18 0.00 0.82 0.00 0.00 66.70 65.63 3exf h VAL 102 Cb 1.24 1.58 -0.03 0.00 -1.52 0.00 0.00 31.29 32.56 3exf h VAL 102 CO 0.59 0.51 0.49 0.03 0.02 0.00 0.00 177.57 179.22 3exf h ARG 103 N 0.48 0.00 0.00 1.57 3.08 -1.95 -2.14 114.38 115.42 3exf h ARG 103 Ca 0.04 0.00 -0.34 0.00 0.07 0.00 0.00 59.98 59.75 3exf h ARG 103 Cb 0.94 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.93 3exf h ARG 103 CO 0.08 0.00 -2.30 0.39 -1.07 0.00 0.00 179.97 177.07 3exf n GLU 104 N -4.16 0.68 0.32 0.04 1.02 -1.02 -2.28 120.64 115.25 3exf n GLU 104 Ca 0.12 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 57.10 3exf n GLU 104 Cb 0.74 -1.54 -0.09 0.00 -0.02 0.00 0.00 31.44 30.53 3exf n GLU 104 CO 0.00 0.00 0.00 0.82 1.18 0.00 0.00 177.13 179.13 3exf h ILE 105 N 0.00 0.41 -0.18 -3.67 2.04 -1.39 -1.62 117.51 113.10 3exf h ILE 105 Ca -0.49 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.25 3exf h ILE 105 Cb 2.14 0.44 -0.01 0.00 -0.74 0.00 0.00 36.82 38.65 3exf h ILE 105 CO 0.03 0.01 -0.08 -0.07 0.00 0.00 0.00 178.15 178.05 3exf h LEU 106 N -0.84 0.26 -0.19 1.44 3.38 -1.55 -2.55 115.31 115.26 3exf h LEU 106 Ca -0.08 -0.05 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 3exf h LEU 106 Cb 0.63 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 3exf h LEU 106 CO 0.13 0.37 -0.37 0.00 0.09 0.00 0.00 178.44 178.66 3exf h ALA 107 N 1.66 0.79 0.17 1.53 0.00 -1.46 -2.56 119.26 119.38 3exf h ALA 107 Ca 0.06 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3exf h ALA 107 Cb 0.31 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.04 3exf h ALA 107 CO 0.01 0.47 -0.08 1.49 0.00 0.00 0.00 179.25 181.14 3exf h GLU 108 N 0.00 -0.22 -0.52 0.00 4.57 -0.89 -1.68 114.58 115.85 3exf h GLU 108 Ca -0.00 0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.14 3exf h GLU 108 Cb 1.22 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.83 3exf h GLU 108 CO 0.05 -0.11 0.12 -0.07 -1.18 0.00 0.00 179.01 177.81 3exf h LEU 109 N -0.27 0.73 -0.33 1.64 4.07 -1.42 0.18 115.31 119.92 3exf h LEU 109 Ca -0.02 -0.13 0.00 0.00 0.08 0.00 0.00 57.88 57.81 3exf h LEU 109 Cb 0.21 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 41.75 3exf h LEU 109 CO 0.04 0.73 0.00 0.35 -1.08 0.00 0.00 178.44 178.47 3exf n THR 110 N -4.28 0.02 -3.00 0.22 -2.24 -0.97 -4.32 114.28 99.70 3exf n THR 110 Ca 0.04 -0.09 -0.05 0.00 -2.27 0.00 0.00 64.05 61.67 3exf n THR 110 Cb 0.22 -0.14 0.02 0.00 -2.10 0.00 0.00 70.33 68.33 3exf n THR 110 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3exf n GLY 111 N 1.02 -1.11 3.32 3.38 0.00 0.64 -4.96 105.19 107.47 3exf n GLY 111 Ca 0.20 0.46 -0.17 0.00 0.00 0.00 0.00 46.02 46.50 3exf n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3exf s ARG 112 N -3.46 1.25 0.60 1.61 1.81 -0.70 -4.36 118.95 115.69 3exf s ARG 112 Ca 0.15 -1.54 0.29 0.00 -1.72 0.00 0.00 55.73 52.91 3exf s ARG 112 Cb -0.02 -0.99 1.57 0.00 -0.45 0.00 0.00 34.95 35.06 3exf s ARG 112 CO 0.69 0.16 1.98 1.57 -0.68 0.00 0.00 175.30 179.02 3exf h LYS 113 N 2.64 0.00 -0.65 3.54 2.10 -1.17 -0.52 116.57 122.52 3exf h LYS 113 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 3exf h LYS 113 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 3exf h LYS 113 CO 0.62 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.48 3exf n GLY 114 N -1.44 2.75 3.80 0.07 0.00 -1.26 -4.68 105.19 104.42 3exf n GLY 114 Ca 0.05 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 44.90 3exf n GLY 114 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3exf s GLY 115 N -0.96 2.20 0.11 -0.02 0.00 -0.20 -4.69 107.32 103.75 3exf s GLY 115 Ca 0.50 0.46 -0.23 0.00 0.00 0.00 0.00 44.72 45.44 3exf s GLY 115 CO 0.26 0.78 1.70 0.00 0.00 0.00 0.00 173.10 175.84 3exf n ALA 117 N -2.33 2.52 -0.60 0.00 0.00 -1.26 -4.86 120.51 113.98 3exf n ALA 117 Ca -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3exf n ALA 117 Cb 0.14 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.59 3exf n ALA 117 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3exf n LYS 118 N 0.10 0.00 0.00 0.00 5.02 0.38 -0.92 118.16 122.74 3exf n LYS 118 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 3exf n LYS 118 Cb 0.31 -3.37 0.00 0.00 -0.02 0.00 0.00 35.03 31.96 3exf n LYS 118 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3exf n GLY 119 N -2.00 0.56 0.12 0.72 0.00 -1.25 -4.48 105.19 98.85 3exf n GLY 119 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 3exf n GLY 119 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3exf h LYS 120 N 3.77 0.27 0.00 1.61 1.79 -1.39 -3.44 116.57 119.18 3exf h LYS 120 Ca 0.00 -0.46 0.00 0.00 -2.18 0.00 0.00 60.65 58.01 3exf h LYS 120 Cb 0.00 0.17 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 3exf h LYS 120 CO 0.00 1.14 0.00 0.41 -1.08 0.00 0.00 179.45 179.92 3exf n GLY 121 N 1.67 0.27 0.00 3.86 0.00 -1.22 -5.08 105.19 104.68 3exf n GLY 121 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 3exf n GLY 121 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3exf n GLY 122 N 2.16 -0.63 0.07 -0.02 0.00 -1.26 -4.58 105.19 100.92 3exf n GLY 122 Ca 0.00 -2.06 -0.11 0.00 0.00 0.00 0.00 46.02 43.85 3exf n GLY 122 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 3exf h SER 123 N 0.00 0.08 0.86 1.61 0.87 -1.88 -3.22 113.55 111.88 3exf h SER 123 Ca 0.00 -0.05 -0.09 0.00 -1.23 0.00 0.00 61.79 60.43 3exf h SER 123 Cb 0.00 -0.02 -0.01 0.00 -0.44 0.00 0.00 62.40 61.93 3exf h SER 123 CO 0.00 0.11 -0.41 0.24 -0.53 0.00 0.00 176.83 176.23 3exf h MET 124 N 0.06 0.00 -3.95 2.24 2.86 -1.84 -3.42 114.93 110.87 3exf h MET 124 Ca 0.03 0.00 -0.65 0.00 -2.06 0.00 0.00 59.70 57.02 3exf h MET 124 Cb 0.04 0.00 -0.40 0.00 0.06 0.00 0.00 31.60 31.29 3exf h MET 124 CO -0.00 0.41 -0.68 -1.01 1.06 0.00 0.00 176.91 176.69 3exf s HIS 125 N -3.57 3.34 0.02 -0.22 4.02 -1.22 -2.58 115.29 115.10 3exf s HIS 125 Ca 0.00 -3.02 0.02 0.00 1.02 0.00 0.00 55.06 53.08 3exf s HIS 125 Cb 0.11 -2.79 -0.02 0.00 -1.02 0.00 0.00 32.58 28.86 3exf s HIS 125 CO 0.70 -0.84 -0.07 -1.64 1.02 0.00 0.00 174.74 173.91 3exf s MET 126 N 0.33 0.49 0.01 1.40 1.00 -1.26 -4.28 119.30 116.98 3exf s MET 126 Ca 0.14 -0.52 0.01 0.00 0.00 0.00 0.00 55.69 55.31 3exf s MET 126 Cb -0.23 -0.34 -0.01 0.00 0.00 0.00 0.00 34.83 34.26 3exf s MET 126 CO -0.04 0.08 -0.02 0.71 0.00 0.00 0.00 175.02 175.74 3exf s TYR 127 N -0.87 0.20 0.07 -0.03 1.51 -1.26 -3.33 117.35 113.64 3exf s TYR 127 Ca -0.05 -0.16 -0.02 0.00 -1.01 0.00 0.00 57.07 55.82 3exf s TYR 127 Cb -0.07 -0.13 -0.03 0.00 -0.11 0.00 0.00 41.96 41.62 3exf s TYR 127 CO 0.00 -0.05 0.01 0.00 -1.11 0.00 0.00 175.55 174.41 3exf s ALA 128 N -0.43 0.45 -0.12 3.71 0.00 -1.04 -4.94 121.76 119.39 3exf s ALA 128 Ca -0.04 -1.16 -0.08 0.00 0.00 0.00 0.00 51.96 50.68 3exf s ALA 128 Cb -0.03 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 3exf s ALA 128 CO -0.00 -0.41 0.46 1.17 0.00 0.00 0.00 175.76 176.98 3exf n LYS 129 N 0.06 0.00 -1.39 0.00 3.00 -1.26 0.40 118.16 118.97 3exf n LYS 129 Ca -0.13 0.00 -0.08 0.00 -0.00 0.00 0.00 58.31 58.10 3exf n LYS 129 Cb 0.62 -0.31 -0.03 0.00 0.00 0.00 0.00 35.03 35.31 3exf n LYS 129 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 3exf n ASN 130 N 1.66 -3.72 -3.65 3.14 5.03 -1.26 -4.98 115.26 111.48 3exf n ASN 130 Ca 0.12 0.15 -0.20 0.00 0.87 0.00 0.00 54.58 55.52 3exf n ASN 130 Cb -0.01 -2.10 -0.17 0.00 -1.02 0.00 0.00 39.78 36.48 3exf n ASN 130 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 3exf s PHE 131 N -2.30 0.00 -0.55 3.10 5.36 0.16 -2.20 117.98 121.56 3exf s PHE 131 Ca 0.00 0.24 0.01 0.00 -0.96 0.00 0.00 56.93 56.22 3exf s PHE 131 Cb 0.00 -0.46 0.45 0.00 -0.34 0.00 0.00 43.02 42.68 3exf s PHE 131 CO 0.00 -0.29 1.77 0.66 -1.46 0.00 0.00 175.22 175.89 3exf n TYR 132 N 5.30 3.08 -1.65 10.12 4.02 -0.83 -2.48 117.16 134.71 3exf n TYR 132 Ca -0.04 -2.77 0.03 0.00 -0.01 0.00 0.00 57.90 55.11 3exf n TYR 132 Cb 0.50 -1.10 -0.01 0.00 -0.02 0.00 0.00 39.34 38.71 3exf n TYR 132 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3exf n GLY 133 N -0.85 -2.06 0.32 2.72 0.00 -1.21 -4.73 105.19 99.38 3exf n GLY 133 Ca 0.57 -1.41 0.00 0.00 0.00 0.00 0.00 46.02 45.18 3exf n GLY 133 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3exf n GLY 134 N -1.20 0.79 2.83 -0.02 0.00 0.09 -1.06 105.19 106.61 3exf n GLY 134 Ca 0.00 -0.68 -0.16 0.00 0.00 0.00 0.00 46.02 45.19 3exf n GLY 134 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3exf s ASN 135 N -2.13 0.34 0.00 1.61 0.01 0.80 -4.43 114.94 111.14 3exf s ASN 135 Ca 0.00 0.21 0.26 0.00 -0.71 0.00 0.00 52.86 52.62 3exf s ASN 135 Cb 0.00 0.10 0.58 0.00 0.41 0.00 0.00 41.25 42.34 3exf s ASN 135 CO 0.00 -0.18 1.46 0.61 -1.51 0.00 0.00 177.10 177.47 3exf n GLY 136 N 4.65 -0.30 3.30 0.66 0.00 -1.26 -3.49 105.19 108.75 3exf n GLY 136 Ca -0.18 -0.48 -0.45 0.00 0.00 0.00 0.00 46.02 44.91 3exf n GLY 136 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3exf s ILE 137 N -2.41 5.00 -0.03 -0.61 -1.09 -1.26 -5.00 121.20 115.80 3exf s ILE 137 Ca 0.25 -1.48 -0.35 0.00 -2.23 0.00 0.00 60.65 56.84 3exf s ILE 137 Cb 0.19 -4.18 -0.13 0.00 -1.58 0.00 0.00 42.46 36.76 3exf s ILE 137 CO 0.50 -0.80 1.74 0.52 -1.23 0.00 0.00 174.94 175.67 3exf n VAL 138 N 5.17 0.34 0.00 2.92 0.31 -1.26 0.05 118.33 125.86 3exf n VAL 138 Ca -0.13 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.14 3exf n VAL 138 Cb 0.41 -1.62 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 3exf n VAL 138 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3exf n GLY 139 N 3.96 2.87 0.26 2.92 0.00 -1.26 -4.90 105.19 109.04 3exf n GLY 139 Ca 0.21 -0.34 0.04 0.00 0.00 0.00 0.00 46.02 45.93 3exf n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3exf h ALA 140 N 0.00 0.92 0.00 4.61 0.00 -0.80 0.13 119.26 124.11 3exf h ALA 140 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3exf h ALA 140 Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3exf h ALA 140 CO 0.00 -0.26 0.20 -0.56 0.00 0.00 0.00 179.25 178.63 3exf h GLN 141 N 0.35 0.00 0.45 0.00 -0.00 -1.91 -3.14 115.11 110.87 3exf h GLN 141 Ca 0.38 0.00 -0.02 0.00 -0.00 0.00 0.00 58.65 59.01 3exf h GLN 141 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.06 3exf h GLN 141 CO -0.42 0.00 -0.22 0.28 -0.00 0.00 0.00 178.83 178.48 3exf h VAL 142 N 0.00 0.00 -0.95 1.86 2.07 -1.08 -1.69 116.25 116.45 3exf h VAL 142 Ca 0.00 -0.51 0.24 0.00 0.82 0.00 0.00 66.70 67.24 3exf h VAL 142 Cb 0.40 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.05 3exf h VAL 142 CO 0.00 0.00 0.50 -0.65 0.02 0.00 0.00 177.57 177.44 3exf h PRO 143 N -1.12 0.48 0.02 1.57 0.11 -1.71 -2.20 132.00 129.15 3exf h PRO 143 Ca -0.06 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 66.04 3exf h PRO 143 Cb 0.46 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 31.41 3exf h PRO 143 CO 0.10 0.32 -0.49 -0.07 -0.21 0.00 0.00 178.00 177.65 3exf h LEU 144 N 0.49 -1.51 -1.38 2.35 3.38 -1.46 -0.22 115.31 116.96 3exf h LEU 144 Ca 0.61 0.17 0.15 0.00 0.09 0.00 0.00 57.88 58.90 3exf h LEU 144 Cb 1.16 0.58 -0.06 0.00 0.09 0.00 0.00 40.66 42.42 3exf h LEU 144 CO -0.50 -0.51 0.56 1.23 0.09 0.00 0.00 178.44 179.31 3exf h GLY 145 N -0.65 1.04 1.41 0.83 0.00 -0.88 0.70 103.07 105.53 3exf h GLY 145 Ca 0.02 -0.26 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 3exf h GLY 145 CO -0.34 0.07 0.00 0.00 0.00 0.00 0.00 176.54 176.28 3exf h ALA 146 N 1.61 1.17 0.01 3.60 0.00 -0.66 0.57 119.26 125.57 3exf h ALA 146 Ca 0.43 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 3exf h ALA 146 Cb 0.79 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.40 3exf h ALA 146 CO -0.18 0.54 -0.01 0.78 0.00 0.00 0.00 179.25 180.38 3exf h GLY 147 N 0.95 -0.02 0.89 0.00 0.00 0.19 -0.55 103.07 104.53 3exf h GLY 147 Ca 0.14 0.01 0.13 0.00 0.00 0.00 0.00 47.33 47.60 3exf h GLY 147 CO 0.02 -0.01 0.43 -2.22 0.00 0.00 0.00 176.54 174.76 3exf h ILE 148 N -0.34 0.46 0.11 2.60 2.04 -0.15 0.11 117.51 122.35 3exf h ILE 148 Ca -0.00 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 3exf h ILE 148 Cb 0.33 0.67 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3exf h ILE 148 CO 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 178.15 178.10 3exf h ALA 149 N 1.57 -0.15 -0.86 1.87 0.00 0.02 -2.78 119.26 118.93 3exf h ALA 149 Ca 0.22 -0.25 0.23 0.00 0.00 0.00 0.00 54.91 55.10 3exf h ALA 149 Cb 1.07 0.06 -0.14 0.00 0.00 0.00 0.00 17.79 18.77 3exf h ALA 149 CO -0.00 -0.22 0.18 1.25 0.00 0.00 0.00 179.25 180.45 3exf h LEU 150 N -0.87 -0.10 -0.57 0.00 5.85 0.08 0.91 115.31 120.61 3exf h LEU 150 Ca -0.02 0.20 0.09 0.00 0.84 0.00 0.00 57.88 59.00 3exf h LEU 150 Cb 0.55 0.30 -0.11 0.00 0.37 0.00 0.00 40.66 41.77 3exf h LEU 150 CO 0.03 -0.17 -0.42 0.00 -0.34 0.00 0.00 178.44 177.53 3exf h ALA 151 N 1.78 -0.28 -0.36 1.25 0.00 -0.72 -0.50 119.26 120.44 3exf h ALA 151 Ca 0.53 0.12 -0.10 0.00 0.00 0.00 0.00 54.91 55.46 3exf h ALA 151 Cb 1.05 0.92 -0.02 0.00 0.00 0.00 0.00 17.79 19.75 3exf h ALA 151 CO -0.68 -0.80 -0.19 0.00 0.00 0.00 0.00 179.25 177.59 3exf h LYS 153 N 0.60 0.78 -0.09 0.00 3.64 -1.11 -2.97 116.57 117.43 3exf h LYS 153 Ca 0.09 -0.32 -0.14 0.00 -1.27 0.00 0.00 60.65 59.01 3exf h LYS 153 Cb 0.66 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.43 3exf h LYS 153 CO 0.05 0.94 -0.57 -0.92 -2.27 0.00 0.00 179.45 176.67 3exf h TYR 154 N 0.68 0.35 -0.30 1.91 5.03 0.46 -2.85 116.97 122.24 3exf h TYR 154 Ca 0.09 -0.13 0.00 0.00 2.58 0.00 0.00 58.73 61.27 3exf h TYR 154 Cb 0.75 -0.06 0.00 0.00 1.55 0.00 0.00 36.73 38.96 3exf h TYR 154 CO 0.04 0.79 0.00 0.09 -1.32 0.00 0.00 178.16 177.76 3exf n ASN 155 N -3.90 2.77 -0.88 -2.11 3.02 0.35 -4.93 115.26 109.58 3exf n ASN 155 Ca -0.02 -2.28 0.00 0.00 -0.03 0.00 0.00 54.58 52.24 3exf n ASN 155 Cb 0.60 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.31 3exf n ASN 155 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3exf n GLY 156 N 0.58 0.00 0.05 7.41 0.00 -1.08 -4.67 105.19 107.48 3exf n GLY 156 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.28 3exf n GLY 156 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3exf n LYS 157 N -0.34 0.25 -0.69 1.61 5.02 -1.21 -4.90 118.16 117.89 3exf n LYS 157 Ca 0.00 -0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 3exf n LYS 157 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.51 3exf n LYS 157 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3exf n ASP 158 N -1.29 -2.07 -4.74 4.39 2.03 -1.26 -5.06 116.55 108.55 3exf n ASP 158 Ca 0.09 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.11 3exf n ASP 158 Cb 0.32 -0.34 0.14 0.00 -0.72 0.00 0.00 41.12 40.51 3exf n ASP 158 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 3exf s GLU 159 N -0.84 1.09 0.26 -0.67 2.02 -1.26 -4.85 118.70 114.45 3exf s GLU 159 Ca 0.00 0.25 0.02 0.00 0.02 0.00 0.00 54.97 55.26 3exf s GLU 159 Cb 0.00 -1.84 -0.05 0.00 0.10 0.00 0.00 34.13 32.34 3exf s GLU 159 CO 0.00 -2.22 0.06 0.14 0.02 0.00 0.00 175.26 173.26 3exf s VAL 160 N -3.31 0.79 -0.06 2.63 -7.23 -1.26 -4.85 120.40 107.11 3exf s VAL 160 Ca 0.64 -2.00 0.03 0.00 -1.81 0.00 0.00 61.98 58.84 3exf s VAL 160 Cb -0.14 -2.57 0.00 0.00 0.56 0.00 0.00 36.38 34.23 3exf s VAL 160 CO 0.53 -0.10 -0.15 0.00 -0.31 0.00 0.00 175.10 175.07 3exf s LEU 162 N 0.34 4.25 -0.25 0.00 1.02 0.17 -0.26 118.68 123.95 3exf s LEU 162 Ca -0.10 0.55 0.00 0.00 0.02 0.00 0.00 54.13 54.61 3exf s LEU 162 Cb -0.14 -2.42 0.07 0.00 0.02 0.00 0.00 46.19 43.73 3exf s LEU 162 CO 0.03 0.09 -0.01 -0.89 0.02 0.00 0.00 176.35 175.59 3exf s THR 163 N 0.46 1.33 -0.08 5.49 2.01 0.65 -1.74 115.64 123.77 3exf s THR 163 Ca 0.18 -1.23 -0.12 0.00 0.31 0.00 0.00 61.69 60.83 3exf s THR 163 Cb -0.13 -1.72 -0.05 0.00 0.01 0.00 0.00 72.50 70.60 3exf s THR 163 CO 0.05 -0.24 0.29 -0.76 -0.69 0.00 0.00 174.62 173.27 3exf s LEU 164 N 1.46 4.39 0.11 4.42 1.02 -0.44 -0.01 118.68 129.63 3exf s LEU 164 Ca -0.01 0.70 -0.08 0.00 0.02 0.00 0.00 54.13 54.75 3exf s LEU 164 Cb -0.18 -2.37 -0.01 0.00 0.02 0.00 0.00 46.19 43.65 3exf s LEU 164 CO -0.09 0.30 0.21 -0.72 0.02 0.00 0.00 176.35 176.06 3exf s TYR 165 N -0.71 0.24 0.46 0.29 1.13 0.70 -4.01 117.35 115.44 3exf s TYR 165 Ca 0.19 -0.65 -0.19 0.00 -1.41 0.00 0.00 57.07 55.01 3exf s TYR 165 Cb -0.14 -0.08 -0.10 0.00 -1.10 0.00 0.00 41.96 40.55 3exf s TYR 165 CO 0.08 -0.58 0.95 0.20 -2.51 0.00 0.00 175.55 173.69 3exf s GLY 166 N -2.89 2.24 0.24 5.49 0.00 -1.26 -0.00 107.32 111.13 3exf s GLY 166 Ca 0.09 0.28 -0.05 0.00 0.00 0.00 0.00 44.72 45.03 3exf s GLY 166 CO -0.08 0.55 1.77 1.29 0.00 0.00 0.00 173.10 176.64 3exf h ASP 167 N 1.51 0.46 -0.99 1.64 3.04 -1.85 0.76 116.42 120.99 3exf h ASP 167 Ca -0.48 0.07 0.10 0.00 -3.24 0.00 0.00 57.03 53.48 3exf h ASP 167 Cb 1.18 -0.00 -0.08 0.00 -1.04 0.00 0.00 39.33 39.39 3exf h ASP 167 CO 0.61 0.24 0.62 1.23 -2.04 0.00 0.00 179.24 179.91 3exf h GLY 168 N 0.60 1.58 0.04 7.15 0.00 -1.89 -2.02 103.07 108.53 3exf h GLY 168 Ca 0.38 -0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.28 3exf h GLY 168 CO -0.30 0.21 -0.02 0.00 0.00 0.00 0.00 176.54 176.43 3exf n ALA 169 N -2.35 2.64 1.70 3.60 0.00 0.16 -3.49 120.51 122.76 3exf n ALA 169 Ca 0.17 -0.37 0.10 0.00 0.00 0.00 0.00 53.44 53.35 3exf n ALA 169 Cb 0.29 -1.27 0.60 0.00 0.00 0.00 0.00 19.45 19.08 3exf n ALA 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3exf n ALA 170 N -0.24 2.47 0.08 0.00 0.00 -0.61 -1.74 120.51 120.47 3exf n ALA 170 Ca 0.20 -0.13 0.05 0.00 0.00 0.00 0.00 53.44 53.56 3exf n ALA 170 Cb 0.28 -1.33 0.10 0.00 0.00 0.00 0.00 19.45 18.50 3exf n ALA 170 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3exf n ASN 171 N -0.87 2.45 -4.65 0.00 3.02 -1.23 -4.97 115.26 109.01 3exf n ASN 171 Ca 0.15 -1.76 -0.43 0.00 -0.03 0.00 0.00 54.58 52.51 3exf n ASN 171 Cb 0.07 -0.13 -0.02 0.00 -0.61 0.00 0.00 39.78 39.09 3exf n ASN 171 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3exf s GLN 172 N -0.94 4.08 0.36 3.52 -1.52 -0.71 -4.93 119.66 119.51 3exf s GLN 172 Ca 0.18 1.58 0.14 0.00 -1.95 0.00 0.00 55.36 55.30 3exf s GLN 172 Cb 0.10 -3.85 0.98 0.00 -0.22 0.00 0.00 33.01 30.01 3exf s GLN 172 CO 0.14 -0.92 1.76 0.78 -0.25 0.00 0.00 175.29 176.80 3exf h GLY 173 N 10.37 1.52 2.00 3.09 0.00 -1.93 -0.43 103.07 117.69 3exf h GLY 173 Ca -0.28 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 46.78 3exf h GLY 173 CO 0.99 -0.16 0.00 0.06 0.00 0.00 0.00 176.54 177.43 3exf h GLN 174 N 0.51 0.00 -0.53 4.80 3.07 -1.95 -0.23 115.11 120.79 3exf h GLN 174 Ca 0.61 0.00 -0.03 0.00 0.09 0.00 0.00 58.65 59.31 3exf h GLN 174 Cb 1.31 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.85 3exf h GLN 174 CO -0.37 0.00 0.21 0.82 0.09 0.00 0.00 178.83 179.58 3exf h ILE 175 N 0.00 1.22 -0.09 1.86 5.03 -1.36 -2.17 117.51 122.00 3exf h ILE 175 Ca 0.00 -0.68 -0.02 0.00 -0.12 0.00 0.00 64.86 64.04 3exf h ILE 175 Cb 0.24 0.67 -0.01 0.00 -3.03 0.00 0.00 36.82 34.70 3exf h ILE 175 CO 0.00 0.26 -0.04 -0.26 -0.68 0.00 0.00 178.15 177.43 3exf h PHE 176 N 0.72 0.13 -0.05 1.37 -1.00 -1.16 0.25 116.94 117.18 3exf h PHE 176 Ca 0.18 -0.00 -0.04 0.00 2.81 0.00 0.00 57.97 60.91 3exf h PHE 176 Cb 0.20 -0.04 0.00 0.00 3.61 0.00 0.00 35.95 39.72 3exf h PHE 176 CO 0.01 0.18 -0.14 0.93 -1.61 0.00 0.00 178.31 177.67 3exf h GLU 177 N 0.13 0.19 -0.81 1.51 5.08 -1.52 -2.74 114.58 116.42 3exf h GLU 177 Ca 0.03 -0.13 0.18 0.00 -1.00 0.00 0.00 59.36 58.44 3exf h GLU 177 Cb 0.16 0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.32 3exf h GLU 177 CO 0.01 0.74 0.28 0.00 -1.00 0.00 0.00 179.01 179.03 3exf h ALA 178 N 0.45 1.16 0.67 3.43 0.00 -1.04 -2.11 119.26 121.82 3exf h ALA 178 Ca -0.00 0.16 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 3exf h ALA 178 Cb 0.75 0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.73 3exf h ALA 178 CO 0.03 -0.32 -0.32 1.88 0.00 0.00 0.00 179.25 180.51 3exf h TYR 179 N 0.34 -0.84 -0.81 0.00 0.05 -0.92 -1.29 116.97 113.50 3exf h TYR 179 Ca 0.48 -0.02 0.08 0.00 0.05 0.00 0.00 58.73 59.32 3exf h TYR 179 Cb 0.84 0.28 -0.05 0.00 1.01 0.00 0.00 36.73 38.81 3exf h TYR 179 CO -0.21 -0.49 0.53 -0.97 -1.05 0.00 0.00 178.16 175.97 3exf h ASN 180 N -1.03 0.72 -0.02 3.88 -1.24 -1.27 0.13 115.58 116.76 3exf h ASN 180 Ca -0.09 0.01 -0.06 0.00 0.71 0.00 0.00 56.30 56.87 3exf h ASN 180 Cb 0.72 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.64 3exf h ASN 180 CO 0.15 0.44 -0.23 0.24 -1.29 0.00 0.00 177.43 176.75 3exf h MET 181 N 0.80 0.18 -0.94 6.67 2.86 -1.32 0.21 114.93 123.39 3exf h MET 181 Ca 0.36 -0.17 0.17 0.00 -2.06 0.00 0.00 59.70 58.00 3exf h MET 181 Cb 0.36 0.04 -0.08 0.00 0.06 0.00 0.00 31.60 31.98 3exf h MET 181 CO -0.14 0.88 0.60 0.00 1.06 0.00 0.00 176.91 179.31 3exf h ALA 182 N 0.31 1.85 0.01 6.32 0.00 -0.90 0.14 119.26 126.99 3exf h ALA 182 Ca -0.02 0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.72 3exf h ALA 182 Cb 0.94 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 3exf h ALA 182 CO 0.05 -0.14 -0.90 0.00 0.00 0.00 0.00 179.25 178.25 3exf h ALA 183 N 1.61 0.50 -0.48 0.00 0.00 -0.69 -2.16 119.26 118.04 3exf h ALA 183 Ca 0.50 -0.76 -0.13 0.00 0.00 0.00 0.00 54.91 54.52 3exf h ALA 183 Cb 0.86 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3exf h ALA 183 CO -0.26 0.98 -0.21 1.25 0.00 0.00 0.00 179.25 181.02 3exf h LEU 184 N 0.07 1.02 -2.73 0.00 5.85 0.29 -3.26 115.31 116.53 3exf h LEU 184 Ca -0.04 -0.39 0.00 0.00 0.84 0.00 0.00 57.88 58.29 3exf h LEU 184 Cb 1.56 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 42.30 3exf h LEU 184 CO 0.13 1.18 0.00 0.79 -0.34 0.00 0.00 178.44 180.21 3exf n TRP 185 N -4.13 0.91 -3.63 1.25 8.01 0.38 -4.97 117.44 115.26 3exf n TRP 185 Ca 0.00 -0.48 -0.20 0.00 -1.31 0.00 0.00 57.50 55.51 3exf n TRP 185 Cb 0.45 -0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.75 3exf n TRP 185 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 3exf n LYS 186 N 1.57 -1.51 -3.61 -0.99 5.02 -0.98 -4.93 118.16 112.72 3exf n LYS 186 Ca 0.23 0.93 -0.37 0.00 -2.02 0.00 0.00 58.31 57.09 3exf n LYS 186 Cb 0.61 -3.01 -0.09 0.00 -0.02 0.00 0.00 35.03 32.52 3exf n LYS 186 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3exf s LEU 187 N -4.70 4.15 0.00 -0.35 1.43 -0.85 -4.63 118.68 113.73 3exf s LEU 187 Ca 0.01 0.24 -0.01 0.00 -1.03 0.00 0.00 54.13 53.34 3exf s LEU 187 Cb -0.00 -2.20 -0.01 0.00 0.03 0.00 0.00 46.19 44.01 3exf s LEU 187 CO 0.87 0.06 0.73 -0.81 0.23 0.00 0.00 176.35 177.43 3exf n PRO 188 N 4.13 0.00 -4.05 1.29 -0.04 -1.26 -2.94 135.00 132.13 3exf n PRO 188 Ca -0.14 -0.37 -0.32 0.00 -0.04 0.00 0.00 63.50 62.64 3exf n PRO 188 Cb 0.52 -1.73 -0.16 0.00 -0.04 0.00 0.00 33.50 32.10 3exf n PRO 188 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3exf s ILE 190 N 1.26 5.03 0.06 0.00 1.01 0.64 -3.07 121.20 126.14 3exf s ILE 190 Ca -0.03 -1.28 -0.30 0.00 0.00 0.00 0.00 60.65 59.05 3exf s ILE 190 Cb -0.17 -4.42 -0.05 0.00 0.01 0.00 0.00 42.46 37.84 3exf s ILE 190 CO -0.08 -1.00 1.05 -0.36 0.00 0.00 0.00 174.94 174.55 3exf s PHE 191 N 2.10 3.62 -0.12 3.97 0.08 -0.96 -0.25 117.98 126.41 3exf s PHE 191 Ca 0.07 1.60 -0.01 0.00 0.12 0.00 0.00 56.93 58.72 3exf s PHE 191 Cb -0.27 -3.21 0.03 0.00 -0.57 0.00 0.00 43.02 39.00 3exf s PHE 191 CO 0.04 -0.39 -0.07 0.42 -0.10 0.00 0.00 175.22 175.13 3exf s ILE 192 N 0.66 1.00 -0.21 0.64 1.01 0.98 -0.79 121.20 124.49 3exf s ILE 192 Ca 0.52 -0.34 -0.13 0.00 0.00 0.00 0.00 60.65 60.70 3exf s ILE 192 Cb -0.25 -1.07 -0.05 0.00 0.01 0.00 0.00 42.46 41.11 3exf s ILE 192 CO 0.30 0.30 0.27 0.00 0.00 0.00 0.00 174.94 175.81 3exf s GLU 194 N 1.01 4.07 -0.79 0.00 2.02 1.00 -1.47 118.70 124.54 3exf s GLU 194 Ca 0.13 -2.75 -0.25 0.00 0.02 0.00 0.00 54.97 52.11 3exf s GLU 194 Cb -0.14 -4.83 -0.07 0.00 0.10 0.00 0.00 34.13 29.20 3exf s GLU 194 CO 0.05 -1.55 2.09 1.21 0.02 0.00 0.00 175.26 177.08 3exf s ASN 195 N 2.29 4.79 -0.36 -0.19 2.47 -0.82 -3.07 114.94 120.05 3exf s ASN 195 Ca 0.36 -0.17 0.08 0.00 0.42 0.00 0.00 52.86 53.55 3exf s ASN 195 Cb -0.06 -2.55 0.69 0.00 -1.45 0.00 0.00 41.25 37.88 3exf s ASN 195 CO -0.04 -2.98 1.79 -0.46 -3.72 0.00 0.00 177.10 171.69 3exf n ASN 196 N 15.12 4.18 0.00 -4.21 6.94 -1.26 -0.83 115.26 135.20 3exf n ASN 196 Ca 0.38 -3.41 0.00 0.00 -0.02 0.00 0.00 54.58 51.53 3exf n ASN 196 Cb 0.48 -0.76 0.00 0.00 -2.36 0.00 0.00 39.78 37.14 3exf n ASN 196 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 3exf n ARG 197 N -0.61 0.00 -4.18 -3.83 1.74 -1.26 -4.45 116.66 104.07 3exf n ARG 197 Ca 0.46 0.00 -0.17 0.00 -0.77 0.00 0.00 57.85 57.37 3exf n ARG 197 Cb 1.43 -4.29 -0.15 0.00 -1.02 0.00 0.00 32.46 28.43 3exf n ARG 197 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 3exf s TYR 198 N -0.97 0.55 -0.31 -1.55 2.02 -1.26 -3.07 117.35 112.76 3exf s TYR 198 Ca 0.00 -0.11 0.03 0.00 -0.37 0.00 0.00 57.07 56.62 3exf s TYR 198 Cb 0.00 -0.39 0.09 0.00 -0.40 0.00 0.00 41.96 41.25 3exf s TYR 198 CO 0.00 -0.04 -0.00 0.20 -1.57 0.00 0.00 175.55 174.13 3exf s GLY 199 N 0.08 1.78 0.00 0.71 0.00 -1.03 -4.56 107.32 104.30 3exf s GLY 199 Ca -0.01 -2.20 0.00 0.00 0.00 0.00 0.00 44.72 42.51 3exf s GLY 199 CO -0.00 0.86 0.00 -0.13 0.00 0.00 0.00 173.10 173.83 3exf n MET 200 N 4.35 0.00 -0.31 2.90 0.00 -1.26 -1.29 117.12 121.51 3exf n MET 200 Ca -0.03 0.00 0.07 0.00 -0.00 0.00 0.00 57.70 57.74 3exf n MET 200 Cb 0.42 0.00 0.21 0.00 0.00 0.00 0.00 33.22 33.85 3exf n MET 200 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3exf n GLY 201 N 0.00 3.31 3.41 -5.12 0.00 -1.26 -4.79 105.19 100.74 3exf n GLY 201 Ca 0.00 -0.68 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 3exf n GLY 201 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3exf s THR 202 N -1.82 4.00 0.49 2.61 2.01 -0.41 -4.83 115.64 117.68 3exf s THR 202 Ca 0.33 -0.28 -0.20 0.00 0.31 0.00 0.00 61.69 61.85 3exf s THR 202 Cb 0.23 -2.85 -0.08 0.00 0.01 0.00 0.00 72.50 69.80 3exf s THR 202 CO 0.13 0.37 1.04 0.00 -0.69 0.00 0.00 174.62 175.47 3exf s ALA 203 N 1.51 2.87 0.15 7.40 0.00 -1.26 -2.47 121.76 129.95 3exf s ALA 203 Ca 0.06 0.60 -0.31 0.00 0.00 0.00 0.00 51.96 52.31 3exf s ALA 203 Cb -0.15 -3.25 -0.08 0.00 0.00 0.00 0.00 23.12 19.64 3exf s ALA 203 CO 0.01 -0.33 1.54 -0.39 0.00 0.00 0.00 175.76 176.59 3exf h VAL 204 N 1.52 0.00 0.00 0.00 -1.51 -1.93 0.19 116.25 114.52 3exf h VAL 204 Ca -0.49 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 64.98 3exf h VAL 204 Cb 1.22 0.00 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 3exf h VAL 204 CO 0.59 0.00 0.11 1.05 -1.23 0.00 0.00 177.57 178.09 3exf h GLU 205 N -0.08 0.00 0.00 5.19 9.09 -1.91 0.16 114.58 127.03 3exf h GLU 205 Ca 0.14 0.00 -0.04 0.00 0.05 0.00 0.00 59.36 59.52 3exf h GLU 205 Cb 0.45 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.54 3exf h GLU 205 CO -0.87 0.00 -0.22 0.00 0.05 0.00 0.00 179.01 177.98 3exf h ARG 206 N 0.00 0.00 0.00 1.06 3.08 -0.98 -3.40 114.38 114.14 3exf h ARG 206 Ca 0.00 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.00 3exf h ARG 206 Cb 0.23 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 3exf h ARG 206 CO 0.00 0.16 -1.19 0.00 -1.07 0.00 0.00 179.97 177.88 3exf n ALA 207 N -2.15 1.93 -2.74 0.04 0.00 0.48 -4.97 120.51 113.10 3exf n ALA 207 Ca 0.03 -0.17 -0.31 0.00 0.00 0.00 0.00 53.44 52.98 3exf n ALA 207 Cb 0.60 0.22 -0.07 0.00 0.00 0.00 0.00 19.45 20.20 3exf n ALA 207 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3exf s ALA 208 N -2.07 3.46 0.08 0.00 0.00 -0.72 -5.02 121.76 117.50 3exf s ALA 208 Ca -0.02 -1.00 -0.13 0.00 0.00 0.00 0.00 51.96 50.81 3exf s ALA 208 Cb 0.01 -1.39 -0.21 0.00 0.00 0.00 0.00 23.12 21.52 3exf s ALA 208 CO 0.11 0.71 1.21 0.00 0.00 0.00 0.00 175.76 177.79 3exf h ALA 209 N 3.65 0.17 -3.30 0.00 0.00 -1.89 -3.43 119.26 114.46 3exf h ALA 209 Ca -0.48 -0.68 -0.67 0.00 0.00 0.00 0.00 54.91 53.08 3exf h ALA 209 Cb 1.17 0.04 -0.34 0.00 0.00 0.00 0.00 17.79 18.66 3exf h ALA 209 CO 0.62 0.69 -0.80 0.45 0.00 0.00 0.00 179.25 180.21 3exf s SER 210 N -7.26 3.88 -0.22 0.00 0.15 -1.26 -4.97 113.70 104.02 3exf s SER 210 Ca -0.10 -0.87 0.10 0.00 0.70 0.00 0.00 55.95 55.78 3exf s SER 210 Cb 0.07 -1.57 0.64 0.00 -1.71 0.00 0.00 66.02 63.45 3exf s SER 210 CO 0.92 -0.09 1.54 0.35 1.20 0.00 0.00 173.24 177.16 3exf n THR 211 N 4.61 2.30 -2.46 6.45 -2.24 -1.26 -4.62 114.28 117.05 3exf n THR 211 Ca -0.18 -1.19 -0.43 0.00 -2.27 0.00 0.00 64.05 59.99 3exf n THR 211 Cb 0.47 -0.37 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 3exf n THR 211 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3exf n ASP 212 N 0.28 4.88 0.24 3.42 8.00 -1.26 -4.90 116.55 127.21 3exf n ASP 212 Ca 0.26 -2.99 0.09 0.00 0.71 0.00 0.00 54.79 52.87 3exf n ASP 212 Cb 1.08 -1.59 0.62 0.00 -0.02 0.00 0.00 41.12 41.21 3exf n ASP 212 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 3exf h TYR 213 N 6.56 0.00 0.00 1.24 0.05 -2.01 -2.56 116.97 120.25 3exf h TYR 213 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.19 3exf h TYR 213 Cb 0.75 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.49 3exf h TYR 213 CO 1.28 0.14 0.00 0.10 -1.05 0.00 0.00 178.16 178.62 3exf h TYR 214 N 0.00 0.00 0.00 4.88 -0.00 -1.90 -2.36 116.97 117.59 3exf h TYR 214 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 3exf h TYR 214 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.01 3exf h TYR 214 CO 0.00 0.00 -0.48 1.63 -0.00 0.00 0.00 178.16 179.31 3exf n LYS 215 N -2.88 0.03 -0.14 0.10 5.02 -0.97 -4.11 118.16 115.22 3exf n LYS 215 Ca 0.03 0.01 -0.05 0.00 -2.02 0.00 0.00 58.31 56.28 3exf n LYS 215 Cb 0.40 -1.52 0.04 0.00 -0.02 0.00 0.00 35.03 33.93 3exf n LYS 215 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3exf h ARG 216 N 0.00 0.38 -0.76 1.97 2.47 -1.44 -0.27 114.38 116.74 3exf h ARG 216 Ca 0.00 -0.02 0.22 0.00 -1.26 0.00 0.00 59.98 58.92 3exf h ARG 216 Cb 0.53 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.73 3exf h ARG 216 CO 0.00 0.25 0.77 0.78 0.56 0.00 0.00 179.97 182.33 3exf h GLY 217 N 0.39 0.00 0.00 0.04 0.00 -1.77 -3.45 103.07 98.28 3exf h GLY 217 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3exf h GLY 217 CO -0.17 0.00 0.00 1.34 0.00 0.00 0.00 176.54 177.71 3exf n ASP 218 N -3.63 0.00 -0.04 0.19 -0.08 -0.11 -2.57 116.55 110.31 3exf n ASP 218 Ca 0.16 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.44 3exf n ASP 218 Cb 1.03 0.00 -0.15 0.00 2.34 0.00 0.00 41.12 44.35 3exf n ASP 218 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 3exf n PHE 219 N 0.00 0.20 -2.68 -0.67 1.16 -1.26 -4.86 117.46 109.35 3exf n PHE 219 Ca 0.00 0.07 -0.42 0.00 -1.87 0.00 0.00 57.45 55.22 3exf n PHE 219 Cb 0.00 -0.82 -0.03 0.00 -1.61 0.00 0.00 39.48 37.02 3exf n PHE 219 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 3exf s ILE 220 N -2.98 4.77 0.74 1.97 1.01 -1.06 -5.04 121.20 120.60 3exf s ILE 220 Ca -0.08 1.99 -0.15 0.00 0.00 0.00 0.00 60.65 62.41 3exf s ILE 220 Cb 0.10 -4.28 0.04 0.00 0.01 0.00 0.00 42.46 38.33 3exf s ILE 220 CO 0.86 0.14 1.20 -0.81 0.00 0.00 0.00 174.94 176.32 3exf n PRO 221 N 4.05 0.56 -3.96 2.79 -0.04 -1.26 -4.61 135.00 132.52 3exf n PRO 221 Ca 0.07 0.26 -0.09 0.00 -0.04 0.00 0.00 63.50 63.69 3exf n PRO 221 Cb 0.50 -2.44 -0.11 0.00 -0.04 0.00 0.00 33.50 31.42 3exf n PRO 221 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3exf s GLY 222 N -1.78 0.20 -0.05 0.55 0.00 0.15 0.33 107.32 106.72 3exf s GLY 222 Ca 0.77 -0.51 -0.03 0.00 0.00 0.00 0.00 44.72 44.94 3exf s GLY 222 CO 0.47 -0.60 0.12 0.48 0.00 0.00 0.00 173.10 173.57 3exf s LEU 223 N -1.50 1.26 -0.20 0.66 2.34 0.14 -0.04 118.68 121.32 3exf s LEU 223 Ca -0.15 0.25 -0.08 0.00 0.06 0.00 0.00 54.13 54.21 3exf s LEU 223 Cb -0.09 0.37 -0.04 0.00 -0.56 0.00 0.00 46.19 45.87 3exf s LEU 223 CO -0.01 -0.08 0.07 -0.60 -1.06 0.00 0.00 176.35 174.67 3exf s ARG 224 N 0.48 3.89 0.34 1.48 3.52 -0.11 -1.70 118.95 126.85 3exf s ARG 224 Ca -0.03 -0.38 0.09 0.00 -0.13 0.00 0.00 55.73 55.28 3exf s ARG 224 Cb -0.05 -3.26 -0.05 0.00 -1.56 0.00 0.00 34.95 30.03 3exf s ARG 224 CO -0.02 0.13 0.02 0.08 -0.81 0.00 0.00 175.30 174.70 3exf s VAL 225 N 0.75 2.69 -0.50 7.11 1.01 0.11 -3.31 120.40 128.27 3exf s VAL 225 Ca 0.04 -1.95 -0.19 0.00 0.00 0.00 0.00 61.98 59.88 3exf s VAL 225 Cb -0.13 -2.81 0.06 0.00 0.00 0.00 0.00 36.38 33.50 3exf s VAL 225 CO 0.02 -0.21 0.59 -0.62 0.00 0.00 0.00 175.10 174.89 3exf s ASP 226 N -3.72 6.22 -0.07 3.32 -1.08 -1.26 -1.91 116.67 118.17 3exf s ASP 226 Ca 0.35 -0.92 0.04 0.00 -0.52 0.00 0.00 52.55 51.50 3exf s ASP 226 Cb -0.01 -2.28 0.25 0.00 -1.46 0.00 0.00 42.92 39.43 3exf s ASP 226 CO 0.20 -0.85 0.89 0.61 0.52 0.00 0.00 175.17 176.54 3exf n GLY 227 N 5.17 1.91 0.00 2.66 0.00 0.17 -2.78 105.19 112.32 3exf n GLY 227 Ca -0.07 -0.28 0.05 0.00 0.00 0.00 0.00 46.02 45.71 3exf n GLY 227 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3exf n MET 228 N 0.19 2.06 -3.38 1.61 2.81 -1.25 -4.06 117.12 115.11 3exf n MET 228 Ca 0.09 -0.05 -0.45 0.00 -1.81 0.00 0.00 57.70 55.48 3exf n MET 228 Cb 0.54 -1.09 -0.02 0.00 -0.71 0.00 0.00 33.22 31.93 3exf n MET 228 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3exf s ASP 229 N -2.51 6.81 0.21 7.83 -1.08 -1.12 -4.15 116.67 122.67 3exf s ASP 229 Ca -0.00 -3.08 0.06 0.00 -0.52 0.00 0.00 52.55 49.01 3exf s ASP 229 Cb 0.07 -2.17 0.64 0.00 -1.46 0.00 0.00 42.92 40.00 3exf s ASP 229 CO 0.40 -0.44 0.99 0.00 0.52 0.00 0.00 175.17 176.64 3exf n ILE 230 N 3.40 -0.26 0.04 4.11 0.13 -1.26 -1.62 119.36 123.88 3exf n ILE 230 Ca 0.17 1.33 -0.19 0.00 -1.10 0.00 0.00 62.75 62.96 3exf n ILE 230 Cb 0.43 -2.04 -0.12 0.00 -0.84 0.00 0.00 39.64 37.07 3exf n ILE 230 CO 0.00 0.00 0.00 -0.07 2.80 0.00 0.00 176.55 179.28 3exf h LEU 231 N 0.00 0.63 -1.16 9.51 3.38 -1.93 -2.41 115.31 123.32 3exf h LEU 231 Ca 0.45 -0.82 0.11 0.00 0.09 0.00 0.00 57.88 57.70 3exf h LEU 231 Cb 1.05 -0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.54 3exf h LEU 231 CO -0.54 1.38 0.59 0.00 0.09 0.00 0.00 178.44 179.96 3exf h VAL 233 N 0.89 1.18 -0.74 0.00 2.07 -1.32 -2.56 116.25 115.78 3exf h VAL 233 Ca 0.44 -0.54 0.01 0.00 0.82 0.00 0.00 66.70 67.42 3exf h VAL 233 Cb 0.47 1.40 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 3exf h VAL 233 CO -0.20 0.15 0.49 -0.09 0.02 0.00 0.00 177.57 177.94 3exf h ARG 234 N -0.08 0.97 -0.06 1.57 2.43 -1.04 0.04 114.38 118.21 3exf h ARG 234 Ca 0.02 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 3exf h ARG 234 Cb 0.23 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 29.55 3exf h ARG 234 CO -0.00 0.64 0.04 0.93 -1.51 0.00 0.00 179.97 180.07 3exf h GLU 235 N 1.00 0.08 -0.48 0.20 4.39 -1.54 -1.07 114.58 117.15 3exf h GLU 235 Ca 0.27 -0.00 0.09 0.00 0.34 0.00 0.00 59.36 60.06 3exf h GLU 235 Cb -0.11 -0.02 -0.07 0.00 -0.10 0.00 0.00 28.75 28.45 3exf h GLU 235 CO -0.06 0.05 0.05 0.00 -1.16 0.00 0.00 179.01 177.89 3exf h ALA 236 N 1.02 0.50 -0.27 3.43 0.00 -0.87 -0.08 119.26 122.99 3exf h ALA 236 Ca 0.02 0.12 0.06 0.00 0.00 0.00 0.00 54.91 55.12 3exf h ALA 236 Cb -0.01 0.19 -0.06 0.00 0.00 0.00 0.00 17.79 17.91 3exf h ALA 236 CO -0.00 -0.35 -0.13 1.15 0.00 0.00 0.00 179.25 179.91 3exf h THR 237 N 0.17 0.59 -0.10 0.00 2.02 -0.90 0.15 112.91 114.85 3exf h THR 237 Ca 0.24 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.45 3exf h THR 237 Cb 0.35 0.59 -0.00 0.00 -1.74 0.00 0.00 68.15 67.34 3exf h THR 237 CO -0.36 0.00 0.07 0.03 0.37 0.00 0.00 175.52 175.63 3exf h ARG 238 N -0.09 0.00 -0.01 6.66 3.08 -0.49 0.10 114.38 123.63 3exf h ARG 238 Ca 0.14 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 3exf h ARG 238 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.36 3exf h ARG 238 CO -0.33 0.00 -0.05 0.35 -1.07 0.00 0.00 179.97 178.87 3exf h PHE 239 N 0.00 0.07 -0.54 3.04 3.04 -0.33 -2.82 116.94 119.39 3exf h PHE 239 Ca 0.05 -0.03 -0.10 0.00 3.98 0.00 0.00 57.97 61.87 3exf h PHE 239 Cb 0.18 -0.01 -0.02 0.00 2.56 0.00 0.00 35.95 38.66 3exf h PHE 239 CO 0.00 0.70 -0.06 0.00 -2.02 0.00 0.00 178.31 176.93 3exf h ALA 240 N 0.36 0.87 0.00 2.41 0.00 -0.07 -1.89 119.26 120.94 3exf h ALA 240 Ca -0.00 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.46 3exf h ALA 240 Cb 0.70 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 3exf h ALA 240 CO 0.01 0.65 -0.61 0.00 0.00 0.00 0.00 179.25 179.30 3exf h ALA 241 N 1.04 0.83 0.01 0.00 0.00 -0.95 0.17 119.26 120.36 3exf h ALA 241 Ca 0.15 -0.55 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 3exf h ALA 241 Cb 0.60 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.29 3exf h ALA 241 CO 0.04 0.76 -0.00 0.00 0.00 0.00 0.00 179.25 180.05 3exf h ALA 242 N 1.39 -0.01 -0.80 0.00 0.00 -1.41 0.38 119.26 118.81 3exf h ALA 242 Ca -0.01 -0.25 0.11 0.00 0.00 0.00 0.00 54.91 54.76 3exf h ALA 242 Cb 1.20 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.87 3exf h ALA 242 CO 0.08 -0.25 -0.45 -0.92 0.00 0.00 0.00 179.25 177.71 3exf h TYR 243 N -0.52 -1.36 0.03 0.00 5.03 -1.27 -0.83 116.97 118.05 3exf h TYR 243 Ca -0.00 0.10 -0.00 0.00 2.58 0.00 0.00 58.73 61.41 3exf h TYR 243 Cb 0.51 0.71 0.00 0.00 1.55 0.00 0.00 36.73 39.50 3exf h TYR 243 CO 0.10 -0.41 -0.02 0.00 -1.32 0.00 0.00 178.16 176.52 3exf h ARG 245 N -0.41 0.00 -0.25 0.00 2.43 -0.22 -1.58 114.38 114.36 3exf h ARG 245 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3exf h ARG 245 Cb 0.38 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.93 3exf h ARG 245 CO 0.01 0.00 0.00 -1.13 -1.51 0.00 0.00 179.97 177.34 3exf n SER 246 N -2.55 1.73 0.00 -3.80 3.41 -0.32 -4.94 113.62 107.15 3exf n SER 246 Ca -0.02 -1.84 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 3exf n SER 246 Cb 0.15 -0.16 0.00 0.00 -0.26 0.00 0.00 64.21 63.94 3exf n SER 246 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3exf n GLY 247 N 1.09 0.64 0.07 5.00 0.00 -0.59 -4.91 105.19 106.48 3exf n GLY 247 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 3exf n GLY 247 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3exf n LYS 248 N -1.98 0.09 0.00 1.61 5.02 -1.20 -4.99 118.16 116.71 3exf n LYS 248 Ca 0.00 0.40 0.00 0.00 -2.02 0.00 0.00 58.31 56.69 3exf n LYS 248 Cb 0.03 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.35 3exf n LYS 248 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3exf n GLY 249 N -0.41 0.45 3.88 0.72 0.00 -1.26 -4.95 105.19 103.62 3exf n GLY 249 Ca 0.02 -1.79 -0.30 0.00 0.00 0.00 0.00 46.02 43.95 3exf n GLY 249 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3exf s PRO 250 N 0.00 3.72 0.01 1.61 0.04 -1.15 -4.38 135.00 134.85 3exf s PRO 250 Ca 0.00 0.45 -0.03 0.00 0.04 0.00 0.00 61.00 61.46 3exf s PRO 250 Cb 0.00 -2.35 -0.01 0.00 0.04 0.00 0.00 34.50 32.18 3exf s PRO 250 CO 0.00 -0.13 0.05 -1.50 0.04 0.00 0.00 177.00 175.47 3exf s ILE 251 N -2.53 0.09 -0.17 0.56 2.07 -1.17 -4.46 121.20 115.58 3exf s ILE 251 Ca 0.51 -0.74 -0.08 0.00 -1.41 0.00 0.00 60.65 58.93 3exf s ILE 251 Cb -0.10 -0.32 -0.04 0.00 0.13 0.00 0.00 42.46 42.12 3exf s ILE 251 CO 0.36 -0.41 0.09 -0.76 -1.91 0.00 0.00 174.94 172.31 3exf s LEU 252 N -1.31 3.99 -0.19 8.50 1.02 0.15 -2.26 118.68 128.58 3exf s LEU 252 Ca -0.14 0.18 0.01 0.00 0.02 0.00 0.00 54.13 54.20 3exf s LEU 252 Cb -0.08 -2.01 0.04 0.00 0.02 0.00 0.00 46.19 44.16 3exf s LEU 252 CO 0.00 0.22 -0.12 -0.32 0.02 0.00 0.00 176.35 176.16 3exf s MET 253 N 0.10 2.15 -0.28 1.70 1.75 0.03 0.24 119.30 124.99 3exf s MET 253 Ca 0.07 -0.83 -0.10 0.00 -1.25 0.00 0.00 55.69 53.58 3exf s MET 253 Cb -0.12 -2.41 -0.03 0.00 2.84 0.00 0.00 34.83 35.11 3exf s MET 253 CO 0.00 -0.39 0.14 -2.00 -0.65 0.00 0.00 175.02 172.12 3exf s GLU 254 N 1.38 3.69 -0.24 4.11 2.12 -0.69 -0.91 118.70 128.16 3exf s GLU 254 Ca -0.00 -0.48 -0.17 0.00 0.36 0.00 0.00 54.97 54.68 3exf s GLU 254 Cb -0.16 -3.53 -0.03 0.00 0.26 0.00 0.00 34.13 30.67 3exf s GLU 254 CO -0.09 -0.25 0.45 -0.51 -0.54 0.00 0.00 175.26 174.32 3exf s LEU 255 N 1.68 4.08 -0.22 2.70 1.02 -0.54 0.10 118.68 127.49 3exf s LEU 255 Ca 0.06 0.46 -0.22 0.00 0.02 0.00 0.00 54.13 54.46 3exf s LEU 255 Cb -0.16 -2.56 -0.02 0.00 0.02 0.00 0.00 46.19 43.47 3exf s LEU 255 CO 0.07 -0.20 0.70 -1.10 0.02 0.00 0.00 176.35 175.84 3exf s GLN 256 N 1.94 4.18 0.14 1.70 -0.21 -0.80 -1.95 119.66 124.67 3exf s GLN 256 Ca 0.19 0.71 0.00 0.00 0.02 0.00 0.00 55.36 56.28 3exf s GLN 256 Cb -0.15 -3.61 -0.00 0.00 1.00 0.00 0.00 33.01 30.24 3exf s GLN 256 CO 0.09 -0.36 0.18 -2.37 -2.12 0.00 0.00 175.29 170.70 3exf n THR 257 N 4.98 0.00 -3.65 -0.19 5.66 -0.01 0.41 114.28 121.48 3exf n THR 257 Ca 0.01 -0.79 -0.14 0.00 -3.05 0.00 0.00 64.05 60.08 3exf n THR 257 Cb 0.49 0.46 -0.08 0.00 -1.55 0.00 0.00 70.33 69.65 3exf n THR 257 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 175.07 171.55 3exf s TYR 258 N -3.76 -0.65 -0.24 1.09 6.14 -1.26 -4.22 117.35 114.45 3exf s TYR 258 Ca 0.13 1.53 -0.05 0.00 0.64 0.00 0.00 57.07 59.32 3exf s TYR 258 Cb -0.00 0.25 -0.00 0.00 0.42 0.00 0.00 41.96 42.62 3exf s TYR 258 CO 0.09 -0.36 -0.01 -0.98 0.64 0.00 0.00 175.55 174.94 3exf s ARG 259 N 0.08 3.30 0.15 4.97 1.70 -1.26 -3.63 118.95 124.25 3exf s ARG 259 Ca -0.02 -0.69 -0.14 0.00 -0.47 0.00 0.00 55.73 54.41 3exf s ARG 259 Cb -0.04 -3.12 0.02 0.00 -0.57 0.00 0.00 34.95 31.24 3exf s ARG 259 CO 0.02 -0.27 1.69 1.88 -1.08 0.00 0.00 175.30 177.55 3exf h TYR 260 N 8.14 0.72 -4.22 5.89 0.05 -1.42 -3.43 116.97 122.70 3exf h TYR 260 Ca -0.38 -0.06 -0.49 0.00 0.05 0.00 0.00 58.73 57.85 3exf h TYR 260 Cb 1.15 -0.21 0.05 0.00 1.01 0.00 0.00 36.73 38.72 3exf h TYR 260 CO 0.60 0.62 0.38 -1.01 -1.05 0.00 0.00 178.16 177.70 3exf s HIS 261 N -5.52 3.19 0.00 4.88 3.76 -1.26 -5.06 115.29 115.28 3exf s HIS 261 Ca -0.13 1.48 0.00 0.00 -0.15 0.00 0.00 55.06 56.26 3exf s HIS 261 Cb 0.11 -2.91 0.00 0.00 1.11 0.00 0.00 32.58 30.89 3exf s HIS 261 CO 0.77 -0.84 0.00 0.41 -0.85 0.00 0.00 174.74 174.23 3exf n GLY 262 N -1.36 -1.42 0.28 -2.22 0.00 -1.26 -4.73 105.19 94.49 3exf n GLY 262 Ca 0.08 -0.48 0.15 0.00 0.00 0.00 0.00 46.02 45.78 3exf n GLY 262 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3exf h HIS 263 N -0.82 0.00 0.00 1.61 2.76 -1.87 -3.46 115.15 113.37 3exf h HIS 263 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3exf h HIS 263 Cb 0.00 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.96 3exf h HIS 263 CO 0.00 0.07 0.00 -1.13 -1.30 0.00 0.00 177.93 175.57 3exf n SER 264 N -3.51 0.00 0.00 3.26 3.41 -1.26 -4.56 113.62 110.96 3exf n SER 264 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.59 3exf n SER 264 Cb 0.19 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.14 3exf n SER 264 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3exf n MET 265 N -1.26 0.00 0.00 4.33 0.00 -1.10 0.51 117.12 119.60 3exf n MET 265 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 57.70 57.85 3exf n MET 265 Cb 0.00 0.00 0.86 0.00 0.00 0.00 0.00 33.22 34.08 3exf n MET 265 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 3exf n SER 266 N -3.02 0.17 -4.58 7.83 3.41 -1.26 -4.52 113.62 111.65 3exf n SER 266 Ca 0.00 -0.88 -0.43 0.00 -0.26 0.00 0.00 58.87 57.30 3exf n SER 266 Cb 0.00 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 63.87 3exf n SER 266 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3exf s ASP 267 N -2.13 6.58 0.43 4.04 -1.08 0.18 -4.88 116.67 119.81 3exf s ASP 267 Ca 0.43 0.32 0.21 0.00 -0.52 0.00 0.00 52.55 52.99 3exf s ASP 267 Cb 0.21 -2.50 1.17 0.00 -1.46 0.00 0.00 42.92 40.34 3exf s ASP 267 CO 0.39 -1.14 1.81 -0.65 0.52 0.00 0.00 175.17 176.10 3exf h PRO 268 N 9.11 0.32 -0.02 4.34 0.11 -1.86 -3.39 132.00 140.61 3exf h PRO 268 Ca -0.23 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 3exf h PRO 268 Cb 1.07 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.10 3exf h PRO 268 CO 1.07 0.21 -0.01 0.41 -0.21 0.00 0.00 178.00 179.48 3exf n GLY 269 N -1.53 0.47 0.03 -0.55 0.00 -1.26 -4.39 105.19 97.96 3exf n GLY 269 Ca 0.23 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3exf n GLY 269 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3exf n VAL 270 N -2.95 0.00 1.31 1.61 0.24 -1.26 -4.64 118.33 112.64 3exf n VAL 270 Ca -0.00 -0.50 0.12 0.00 -2.04 0.00 0.00 64.34 61.92 3exf n VAL 270 Cb 0.03 1.01 0.43 0.00 -1.47 0.00 0.00 33.84 33.84 3exf n VAL 270 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3exf n ALA 271 N -0.18 2.54 -0.66 2.33 0.00 -1.26 -4.02 120.51 119.26 3exf n ALA 271 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.93 3exf n ALA 271 Cb 0.02 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.36 3exf n ALA 271 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3exf n TYR 272 N 0.33 0.00 -3.64 0.00 0.18 -1.26 -5.06 117.16 107.71 3exf n TYR 272 Ca 0.17 -0.10 -0.08 0.00 1.88 0.00 0.00 57.90 59.77 3exf n TYR 272 Cb 0.36 -0.01 -0.07 0.00 -0.38 0.00 0.00 39.34 39.24 3exf n TYR 272 CO 0.00 0.00 0.00 -0.98 -2.08 0.00 0.00 176.86 173.80 3exf s ARG 273 N -0.20 0.51 0.24 -3.48 1.70 -1.26 -4.92 118.95 111.55 3exf s ARG 273 Ca 0.00 0.67 -0.31 0.00 -0.47 0.00 0.00 55.73 55.63 3exf s ARG 273 Cb 0.00 0.21 -0.14 0.00 -0.57 0.00 0.00 34.95 34.45 3exf s ARG 273 CO 0.00 -0.07 1.25 0.25 -1.08 0.00 0.00 175.30 175.65 3exf n THR 274 N 2.67 1.26 -0.09 4.99 -2.24 -1.26 -4.61 114.28 115.00 3exf n THR 274 Ca -0.14 -0.31 0.11 0.00 -2.27 0.00 0.00 64.05 61.44 3exf n THR 274 Cb 0.56 -1.21 0.49 0.00 -2.10 0.00 0.00 70.33 68.07 3exf n THR 274 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 3exf h ARG 275 N 3.35 0.42 0.00 -0.78 3.08 -1.96 -2.28 114.38 116.22 3exf h ARG 275 Ca -0.44 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.54 3exf h ARG 275 Cb 1.31 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 3exf h ARG 275 CO 0.70 0.28 -0.77 1.05 -1.07 0.00 0.00 179.97 180.16 3exf h GLU 276 N 0.44 0.00 -0.93 0.04 -0.00 -2.00 -3.28 114.58 108.85 3exf h GLU 276 Ca 0.28 0.00 0.14 0.00 -0.00 0.00 0.00 59.36 59.78 3exf h GLU 276 Cb 0.52 0.00 -0.09 0.00 -0.00 0.00 0.00 28.75 29.18 3exf h GLU 276 CO -0.08 0.12 0.54 1.49 -0.00 0.00 0.00 179.01 181.08 3exf h GLU 277 N 0.00 0.78 -0.53 1.06 4.81 -1.79 -1.01 114.58 117.90 3exf h GLU 277 Ca -0.03 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 3exf h GLU 277 Cb 1.16 -0.18 -0.03 0.00 0.63 0.00 0.00 28.75 30.34 3exf h GLU 277 CO 0.02 0.52 0.35 0.82 -0.73 0.00 0.00 179.01 179.98 3exf h ILE 278 N 0.80 1.14 0.00 2.32 2.04 -1.62 -1.84 117.51 120.35 3exf h ILE 278 Ca 0.49 -0.25 -0.02 0.00 1.00 0.00 0.00 64.86 66.07 3exf h ILE 278 Cb 0.60 0.37 -0.00 0.00 -0.74 0.00 0.00 36.82 37.04 3exf h ILE 278 CO -0.32 0.13 -0.11 1.56 0.00 0.00 0.00 178.15 179.41 3exf h GLN 279 N 0.71 0.00 0.00 2.37 7.50 -1.34 -1.21 115.11 123.14 3exf h GLN 279 Ca 0.19 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.34 3exf h GLN 279 Cb -0.08 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.45 3exf h GLN 279 CO -0.04 0.11 -1.42 -1.91 -1.50 0.00 0.00 178.83 174.08 3exf n GLU 280 N -3.63 0.36 -0.01 1.46 0.00 -0.65 -1.98 120.64 116.19 3exf n GLU 280 Ca -0.02 -0.08 -0.18 0.00 0.00 0.00 0.00 57.16 56.89 3exf n GLU 280 Cb 0.24 -1.54 -0.14 0.00 0.00 0.00 0.00 31.44 29.99 3exf n GLU 280 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.13 177.41 3exf h VAL 281 N 0.00 1.61 -0.17 6.31 2.07 -1.29 -3.25 116.25 121.53 3exf h VAL 281 Ca 0.00 -2.45 0.05 0.00 0.82 0.00 0.00 66.70 65.12 3exf h VAL 281 Cb 0.78 3.25 -0.01 0.00 -1.52 0.00 0.00 31.29 33.79 3exf h VAL 281 CO 0.00 0.66 0.36 -0.09 0.02 0.00 0.00 177.57 178.52 3exf h ARG 282 N -0.65 0.00 0.00 1.57 2.43 -1.19 0.23 114.38 116.78 3exf h ARG 282 Ca -0.09 0.00 -0.17 0.00 -0.81 0.00 0.00 59.98 58.91 3exf h ARG 282 Cb 1.37 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.89 3exf h ARG 282 CO 0.08 0.00 -1.63 -1.13 -1.51 0.00 0.00 179.97 175.78 3exf n SER 283 N -3.27 2.83 0.00 -3.80 3.41 -0.84 -3.55 113.62 108.40 3exf n SER 283 Ca 0.02 -0.01 0.13 0.00 -0.26 0.00 0.00 58.87 58.74 3exf n SER 283 Cb 0.46 0.55 0.37 0.00 -0.26 0.00 0.00 64.21 65.33 3exf n SER 283 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 3exf n LYS 284 N -2.43 0.00 -2.31 4.33 4.81 -1.05 -4.70 118.16 116.81 3exf n LYS 284 Ca -0.16 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.26 3exf n LYS 284 Cb 0.78 -1.50 0.06 0.00 0.02 0.00 0.00 35.03 34.38 3exf n LYS 284 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 3exf n SER 285 N -1.51 -1.01 -4.73 3.14 3.41 0.80 -5.04 113.62 108.67 3exf n SER 285 Ca 0.06 -1.75 -0.42 0.00 -0.26 0.00 0.00 58.87 56.50 3exf n SER 285 Cb 0.34 0.59 -0.01 0.00 -0.26 0.00 0.00 64.21 64.87 3exf n SER 285 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 3exf n ASP 286 N -0.70 3.36 -0.12 4.04 2.03 -1.23 -4.86 116.55 119.08 3exf n ASP 286 Ca -0.12 1.20 -0.13 0.00 0.52 0.00 0.00 54.79 56.26 3exf n ASP 286 Cb 0.71 -1.55 -0.03 0.00 -0.72 0.00 0.00 41.12 39.53 3exf n ASP 286 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 3exf h PRO 287 N 3.30 0.89 -0.07 -0.67 0.13 -1.87 0.18 132.00 133.89 3exf h PRO 287 Ca -0.48 -0.46 -0.06 0.00 -0.87 0.00 0.00 66.00 64.13 3exf h PRO 287 Cb 1.26 0.01 -0.01 0.00 0.13 0.00 0.00 31.00 32.39 3exf h PRO 287 CO 0.68 1.11 -0.23 0.82 -0.23 0.00 0.00 178.00 180.14 3exf h ILE 288 N 0.70 1.20 0.03 -3.56 2.04 -1.91 -2.94 117.51 113.06 3exf h ILE 288 Ca 0.06 -0.93 -0.22 0.00 1.00 0.00 0.00 64.86 64.77 3exf h ILE 288 Cb 0.93 1.41 -0.01 0.00 -0.74 0.00 0.00 36.82 38.41 3exf h ILE 288 CO 0.09 0.28 -0.98 -0.03 0.00 0.00 0.00 178.15 177.50 3exf h MET 289 N 0.10 0.22 -0.39 2.37 4.05 -1.88 -2.80 114.93 116.61 3exf h MET 289 Ca 0.02 -0.28 -0.14 0.00 -0.28 0.00 0.00 59.70 59.02 3exf h MET 289 Cb 0.47 0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.35 3exf h MET 289 CO 0.03 1.04 -0.32 -0.07 0.23 0.00 0.00 176.91 177.82 3exf h LEU 290 N 0.11 0.91 0.18 3.39 3.38 -0.53 -2.98 115.31 119.76 3exf h LEU 290 Ca -0.06 -0.38 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 3exf h LEU 290 Cb 1.64 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.14 3exf h LEU 290 CO 0.15 1.15 -0.09 0.25 0.09 0.00 0.00 178.44 179.99 3exf h LEU 291 N 0.73 -0.20 -0.95 1.67 5.85 -1.58 -2.93 115.31 117.90 3exf h LEU 291 Ca 0.08 -0.32 0.22 0.00 0.84 0.00 0.00 57.88 58.70 3exf h LEU 291 Cb 0.89 0.05 -0.18 0.00 0.37 0.00 0.00 40.66 41.79 3exf h LEU 291 CO 0.08 0.28 -0.10 0.50 -0.34 0.00 0.00 178.44 178.85 3exf h LYS 292 N -0.76 0.01 0.07 1.25 3.64 -1.59 0.18 116.57 119.37 3exf h LYS 292 Ca -0.02 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 3exf h LYS 292 Cb 0.51 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.33 3exf h LYS 292 CO 0.04 0.01 -0.03 -0.44 -2.27 0.00 0.00 179.45 176.76 3exf h ASP 293 N 0.01 -0.08 -0.74 4.20 5.19 -1.52 0.11 116.42 123.59 3exf h ASP 293 Ca 0.51 -0.04 0.03 0.00 -0.62 0.00 0.00 57.03 56.91 3exf h ASP 293 Cb 0.92 0.02 -0.05 0.00 0.18 0.00 0.00 39.33 40.40 3exf h ASP 293 CO -0.93 -0.01 0.47 0.03 -3.12 0.00 0.00 179.24 175.68 3exf h ARG 294 N -0.13 0.89 0.45 3.56 3.08 -0.90 -1.23 114.38 120.10 3exf h ARG 294 Ca -0.01 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 3exf h ARG 294 Cb 0.11 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.96 3exf h ARG 294 CO 0.02 0.59 -0.21 0.52 -1.07 0.00 0.00 179.97 179.81 3exf h MET 295 N 0.92 -0.58 -0.87 0.04 2.86 -0.23 -1.36 114.93 115.72 3exf h MET 295 Ca 0.30 0.04 0.15 0.00 -2.06 0.00 0.00 59.70 58.13 3exf h MET 295 Cb 0.01 0.13 -0.15 0.00 0.06 0.00 0.00 31.60 31.64 3exf h MET 295 CO -0.11 -0.29 -0.32 0.28 1.06 0.00 0.00 176.91 177.53 3exf h VAL 296 N -1.05 0.07 0.00 -2.22 2.07 -0.76 -1.07 116.25 113.29 3exf h VAL 296 Ca -0.06 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.40 3exf h VAL 296 Cb 0.55 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3exf h VAL 296 CO 0.10 0.00 -0.29 0.78 0.02 0.00 0.00 177.57 178.18 3exf h ASN 297 N -0.04 0.00 -0.63 0.57 -0.26 -1.03 -0.31 115.58 113.88 3exf h ASN 297 Ca 0.35 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.09 3exf h ASN 297 Cb 0.61 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.87 3exf h ASN 297 CO -0.90 0.29 0.00 -1.54 -1.06 0.00 0.00 177.43 174.22 3exf n SER 298 N -3.84 4.87 -3.88 5.81 3.41 -0.53 -4.90 113.62 114.56 3exf n SER 298 Ca -0.01 -2.51 -0.30 0.00 -0.26 0.00 0.00 58.87 55.79 3exf n SER 298 Cb 0.37 -0.60 0.03 0.00 -0.26 0.00 0.00 64.21 63.76 3exf n SER 298 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3exf n ASN 299 N 1.05 -4.99 0.06 4.04 5.15 -0.13 -4.65 115.26 115.80 3exf n ASN 299 Ca 0.26 -0.75 0.13 0.00 -0.60 0.00 0.00 54.58 53.61 3exf n ASN 299 Cb 0.93 -4.00 0.30 0.00 -0.53 0.00 0.00 39.78 36.48 3exf n ASN 299 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 3exf n LEU 300 N -4.73 0.64 -3.63 1.20 4.77 -0.43 -0.79 117.00 114.04 3exf n LEU 300 Ca 0.04 0.34 -0.08 0.00 -0.03 0.00 0.00 56.01 56.29 3exf n LEU 300 Cb 0.53 -0.27 -0.07 0.00 -2.33 0.00 0.00 43.42 41.29 3exf n LEU 300 CO 0.75 -0.07 0.87 0.00 -1.33 0.00 0.00 177.39 177.60 3exf s ALA 301 N -3.11 -2.03 0.76 -1.18 0.00 -1.19 -4.79 121.76 110.21 3exf s ALA 301 Ca 0.09 1.79 -0.11 0.00 0.00 0.00 0.00 51.96 53.73 3exf s ALA 301 Cb 0.14 -1.42 0.04 0.00 0.00 0.00 0.00 23.12 21.88 3exf s ALA 301 CO 0.66 -0.21 1.08 -1.54 0.00 0.00 0.00 175.76 175.75 3exf s SER 302 N -0.07 4.87 0.30 0.00 1.04 -1.26 -3.19 113.70 115.39 3exf s SER 302 Ca 0.04 1.41 0.10 0.00 0.48 0.00 0.00 55.95 57.98 3exf s SER 302 Cb -0.04 -2.20 0.47 0.00 0.10 0.00 0.00 66.02 64.35 3exf s SER 302 CO -0.07 -1.74 1.69 1.62 0.98 0.00 0.00 173.24 175.71 3exf h VAL 303 N -0.93 1.36 -0.48 5.02 3.04 -1.97 -3.14 116.25 119.15 3exf h VAL 303 Ca -0.46 -1.75 -0.05 0.00 -1.01 0.00 0.00 66.70 63.44 3exf h VAL 303 Cb 1.25 1.91 -0.02 0.00 -2.01 0.00 0.00 31.29 32.41 3exf h VAL 303 CO 0.59 0.50 0.09 -0.33 -1.01 0.00 0.00 177.57 177.41 3exf h GLU 304 N 0.05 0.74 -0.28 4.17 3.07 -1.98 0.13 114.58 120.48 3exf h GLU 304 Ca -0.00 -0.16 -0.05 0.00 -0.50 0.00 0.00 59.36 58.65 3exf h GLU 304 Cb 0.92 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.71 3exf h GLU 304 CO 0.07 0.70 -0.04 0.93 -1.40 0.00 0.00 179.01 179.27 3exf h GLU 305 N 0.71 0.52 -0.02 2.33 5.08 -1.96 -2.09 114.58 119.16 3exf h GLU 305 Ca 0.16 -0.19 -0.08 0.00 -1.00 0.00 0.00 59.36 58.25 3exf h GLU 305 Cb 0.31 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.51 3exf h GLU 305 CO 0.00 0.71 -0.36 -0.07 -1.00 0.00 0.00 179.01 178.29 3exf h LEU 306 N 0.29 0.03 -0.34 1.33 3.38 -1.43 0.25 115.31 118.82 3exf h LEU 306 Ca 0.08 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.93 3exf h LEU 306 Cb 0.50 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3exf h LEU 306 CO 0.02 0.39 -0.48 0.50 0.09 0.00 0.00 178.44 178.96 3exf h LYS 307 N 0.03 0.00 -0.14 1.13 1.63 -0.98 -2.36 116.57 115.88 3exf h LYS 307 Ca 0.00 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.65 3exf h LYS 307 Cb 0.64 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.26 3exf h LYS 307 CO 0.05 0.48 -0.56 0.93 -3.45 0.00 0.00 179.45 176.89 3exf h GLU 308 N 0.00 0.42 -0.29 1.90 5.08 0.07 -2.58 114.58 119.18 3exf h GLU 308 Ca -0.00 -0.27 -0.06 0.00 -1.00 0.00 0.00 59.36 58.03 3exf h GLU 308 Cb 1.23 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 3exf h GLU 308 CO 0.06 0.87 -0.06 0.82 -1.00 0.00 0.00 179.01 179.71 3exf h ILE 309 N 0.32 1.28 -0.71 3.13 2.04 -0.66 -2.78 117.51 120.12 3exf h ILE 309 Ca 0.00 -1.07 0.13 0.00 1.00 0.00 0.00 64.86 64.92 3exf h ILE 309 Cb 1.08 1.38 -0.09 0.00 -0.74 0.00 0.00 36.82 38.45 3exf h ILE 309 CO 0.10 0.34 0.27 0.44 0.00 0.00 0.00 178.15 179.30 3exf h ASP 310 N 0.32 0.25 -0.33 1.72 3.32 -1.40 -2.04 116.42 118.26 3exf h ASP 310 Ca 0.08 0.10 -0.05 0.00 0.02 0.00 0.00 57.03 57.18 3exf h ASP 310 Cb 0.53 0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.15 3exf h ASP 310 CO 0.03 0.11 0.01 0.58 -1.72 0.00 0.00 179.24 178.25 3exf h VAL 311 N 0.43 1.25 -0.14 -1.35 2.07 -1.43 -0.37 116.25 116.71 3exf h VAL 311 Ca 0.38 -0.93 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 3exf h VAL 311 Cb 0.54 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 31.52 3exf h VAL 311 CO -0.38 0.31 -0.04 -0.33 0.02 0.00 0.00 177.57 177.15 3exf h GLU 312 N 0.38 0.20 0.10 1.57 5.08 -1.20 -1.69 114.58 119.02 3exf h GLU 312 Ca 0.09 -0.03 -0.27 0.00 -1.00 0.00 0.00 59.36 58.15 3exf h GLU 312 Cb 0.43 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 3exf h GLU 312 CO 0.01 0.26 -1.29 0.28 -1.00 0.00 0.00 179.01 177.27 3exf h VAL 313 N 0.20 1.42 -0.89 3.13 2.07 -1.09 -0.95 116.25 120.14 3exf h VAL 313 Ca 0.05 -3.05 -0.01 0.00 0.82 0.00 0.00 66.70 64.51 3exf h VAL 313 Cb 0.21 2.86 -0.04 0.00 -1.52 0.00 0.00 31.29 32.80 3exf h VAL 313 CO 0.01 0.87 0.52 -0.09 0.02 0.00 0.00 177.57 178.90 3exf h ARG 314 N 0.06 1.23 -0.01 1.57 9.65 -0.57 -0.47 114.38 125.84 3exf h ARG 314 Ca -0.15 -0.12 -0.26 0.00 -1.10 0.00 0.00 59.98 58.35 3exf h ARG 314 Cb 1.95 -0.25 0.02 0.00 -1.39 0.00 0.00 29.97 30.30 3exf h ARG 314 CO 0.18 0.87 -1.00 0.87 2.80 0.00 0.00 179.97 183.69 3exf h LYS 315 N 1.24 0.66 0.04 0.20 1.57 -1.31 -0.63 116.57 118.33 3exf h LYS 315 Ca 0.32 -0.69 0.03 0.00 -1.87 0.00 0.00 60.65 58.44 3exf h LYS 315 Cb -0.02 0.19 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 3exf h LYS 315 CO -0.06 1.28 -0.37 0.93 -0.57 0.00 0.00 179.45 180.67 3exf h GLU 316 N 0.38 -0.53 -0.60 3.15 4.39 -1.09 0.13 114.58 120.42 3exf h GLU 316 Ca -0.11 0.04 0.04 0.00 0.34 0.00 0.00 59.36 59.67 3exf h GLU 316 Cb 1.65 0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 30.38 3exf h GLU 316 CO 0.19 -0.35 0.40 0.82 -1.16 0.00 0.00 179.01 178.91 3exf h ILE 317 N -0.55 1.04 0.00 3.13 1.08 -1.08 -1.69 117.51 119.45 3exf h ILE 317 Ca 0.05 -0.22 -0.11 0.00 -0.39 0.00 0.00 64.86 64.19 3exf h ILE 317 Cb 0.61 0.34 -0.02 0.00 -3.07 0.00 0.00 36.82 34.69 3exf h ILE 317 CO -0.27 0.12 -0.52 -0.08 -0.69 0.00 0.00 178.15 176.71 3exf h GLU 318 N 0.65 0.00 0.00 2.37 4.57 -0.53 -1.86 114.58 119.78 3exf h GLU 318 Ca 0.25 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.43 3exf h GLU 318 Cb 0.16 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.75 3exf h GLU 318 CO -0.07 0.52 -0.65 -0.44 -1.18 0.00 0.00 179.01 177.19 3exf h ASP 319 N 0.00 0.00 0.82 1.04 3.32 0.01 -2.83 116.42 118.78 3exf h ASP 319 Ca -0.01 -0.08 -0.24 0.00 0.02 0.00 0.00 57.03 56.73 3exf h ASP 319 Cb 0.92 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.45 3exf h ASP 319 CO 0.07 0.04 -1.16 0.00 -1.72 0.00 0.00 179.24 176.47 3exf h ALA 320 N 2.21 0.30 0.05 3.45 0.00 -1.28 -2.88 119.26 121.12 3exf h ALA 320 Ca 0.00 -0.96 -0.24 0.00 0.00 0.00 0.00 54.91 53.72 3exf h ALA 320 Cb 0.89 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3exf h ALA 320 CO 0.00 1.18 -1.04 0.00 0.00 0.00 0.00 179.25 179.39 3exf h ALA 321 N 0.84 0.29 -0.55 0.00 0.00 -1.40 0.17 119.26 118.61 3exf h ALA 321 Ca -0.08 -0.78 0.13 0.00 0.00 0.00 0.00 54.91 54.18 3exf h ALA 321 Cb 1.86 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 19.60 3exf h ALA 321 CO 0.15 0.90 0.38 0.37 0.00 0.00 0.00 179.25 181.05 3exf h GLN 322 N 0.15 0.16 0.00 0.00 5.75 -1.59 -2.23 115.11 117.35 3exf h GLN 322 Ca -0.09 -0.01 -0.11 0.00 -0.15 0.00 0.00 58.65 58.29 3exf h GLN 322 Cb 1.71 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 30.21 3exf h GLN 322 CO 0.17 0.11 -0.62 0.35 -2.65 0.00 0.00 178.83 176.19 3exf h PHE 323 N 0.17 0.00 -1.16 3.99 3.57 -1.24 -2.60 116.94 119.66 3exf h PHE 323 Ca 0.26 0.00 0.37 0.00 3.53 0.00 0.00 57.97 62.13 3exf h PHE 323 Cb 0.80 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 39.41 3exf h PHE 323 CO -0.00 1.14 0.72 0.00 -2.23 0.00 0.00 178.31 177.95 3exf h ALA 324 N -0.33 2.40 0.04 2.41 0.00 -0.67 -0.48 119.26 122.64 3exf h ALA 324 Ca -0.17 0.13 -0.32 0.00 0.00 0.00 0.00 54.91 54.55 3exf h ALA 324 Cb 1.08 0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.98 3exf h ALA 324 CO -0.10 -0.98 -1.85 0.25 0.00 0.00 0.00 179.25 176.57 3exf n THR 325 N -4.79 1.66 -0.08 0.00 -2.24 -0.84 -4.20 114.28 103.78 3exf n THR 325 Ca 0.33 -0.75 -0.01 0.00 -2.27 0.00 0.00 64.05 61.35 3exf n THR 325 Cb 1.19 -1.26 0.26 0.00 -2.10 0.00 0.00 70.33 68.41 3exf n THR 325 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3exf h ALA 326 N 0.67 1.34 -2.70 6.98 0.00 -1.12 -3.46 119.26 120.97 3exf h ALA 326 Ca -0.35 -0.17 -0.53 0.00 0.00 0.00 0.00 54.91 53.86 3exf h ALA 326 Cb 2.03 -0.20 0.08 0.00 0.00 0.00 0.00 17.79 19.70 3exf h ALA 326 CO 0.08 0.47 0.90 -3.47 0.00 0.00 0.00 179.25 177.23 3exf n ASP 327 N -4.31 3.81 -4.76 0.00 2.03 -0.22 -4.94 116.55 108.16 3exf n ASP 327 Ca 0.03 1.12 -0.36 0.00 0.52 0.00 0.00 54.79 56.11 3exf n ASP 327 Cb 0.19 -1.57 0.02 0.00 -0.72 0.00 0.00 41.12 39.04 3exf n ASP 327 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 3exf s PRO 328 N -0.00 3.11 0.77 -0.67 0.04 -1.26 -4.73 135.00 132.26 3exf s PRO 328 Ca 0.68 1.73 -0.11 0.00 0.04 0.00 0.00 61.00 63.34 3exf s PRO 328 Cb -0.51 -1.96 0.06 0.00 0.04 0.00 0.00 34.50 32.13 3exf s PRO 328 CO 0.44 -1.07 1.10 -1.21 0.04 0.00 0.00 177.00 176.30 3exf s GLU 329 N -3.33 2.20 0.50 4.56 2.02 -1.26 -0.79 118.70 122.60 3exf s GLU 329 Ca 0.75 1.27 -0.21 0.00 0.02 0.00 0.00 54.97 56.80 3exf s GLU 329 Cb -0.28 -1.88 -0.09 0.00 0.10 0.00 0.00 34.13 31.98 3exf s GLU 329 CO 0.31 -1.70 0.84 -2.30 0.02 0.00 0.00 175.26 172.43 3exf n PRO 330 N -3.40 0.95 -1.52 0.39 -0.02 -1.26 -4.39 135.00 125.76 3exf n PRO 330 Ca 0.10 0.35 -0.33 0.00 -2.02 0.00 0.00 63.50 61.61 3exf n PRO 330 Cb 0.53 -1.95 0.07 0.00 -0.02 0.00 0.00 33.50 32.13 3exf n PRO 330 CO 0.00 0.00 0.00 -2.14 1.98 0.00 0.00 175.50 175.34 3exf s PRO 331 N -2.20 2.44 0.06 0.52 0.02 -1.26 -4.96 135.00 129.63 3exf s PRO 331 Ca 0.68 1.42 -0.01 0.00 0.02 0.00 0.00 61.00 63.10 3exf s PRO 331 Cb -0.50 -1.90 -0.27 0.00 0.02 0.00 0.00 34.50 31.86 3exf s PRO 331 CO 0.54 -1.54 1.09 1.25 -0.33 0.00 0.00 177.00 178.01 3exf h LEU 332 N -0.42 0.31 -1.24 -5.54 5.85 -2.03 -2.55 115.31 109.70 3exf h LEU 332 Ca -0.46 -0.36 0.00 0.00 0.84 0.00 0.00 57.88 57.90 3exf h LEU 332 Cb 1.25 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.18 3exf h LEU 332 CO 0.52 1.29 0.38 1.05 -0.34 0.00 0.00 178.44 181.33 3exf h GLU 333 N 0.05 0.00 -0.21 1.25 4.11 -1.99 -1.33 114.58 116.46 3exf h GLU 333 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.29 3exf h GLU 333 Cb 1.94 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.19 3exf h GLU 333 CO 0.18 0.00 0.00 0.39 0.07 0.00 0.00 179.01 179.65 3exf n GLU 334 N -2.42 2.39 0.07 1.06 1.02 -0.96 -4.53 120.64 117.27 3exf n GLU 334 Ca -0.01 -2.10 -0.13 0.00 -0.02 0.00 0.00 57.16 54.90 3exf n GLU 334 Cb 0.41 -1.48 -0.06 0.00 -0.02 0.00 0.00 31.44 30.28 3exf n GLU 334 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3exf h LEU 335 N 4.54 -1.18 -1.41 -4.62 6.46 -1.37 -2.42 115.31 115.33 3exf h LEU 335 Ca 0.00 0.14 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 3exf h LEU 335 Cb 0.98 0.46 0.00 0.00 -0.73 0.00 0.00 40.66 41.38 3exf h LEU 335 CO 0.00 -0.44 0.00 0.61 -0.62 0.00 0.00 178.44 177.99 3exf n GLY 336 N -1.44 1.54 3.78 3.75 0.00 -1.26 -4.87 105.19 106.69 3exf n GLY 336 Ca -0.06 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.57 3exf n GLY 336 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3exf s TYR 337 N -0.55 3.83 -0.68 1.61 1.51 -0.91 -3.90 117.35 118.26 3exf s TYR 337 Ca 0.00 1.45 -0.00 0.00 -1.01 0.00 0.00 57.07 57.51 3exf s TYR 337 Cb 0.00 -2.66 -0.00 0.00 -0.11 0.00 0.00 41.96 39.19 3exf s TYR 337 CO 0.00 0.50 0.57 0.72 -1.11 0.00 0.00 175.55 176.23 3exf n HIS 338 N 1.87 -1.26 0.10 2.71 8.25 -0.67 -4.96 115.22 121.25 3exf n HIS 338 Ca -0.07 0.53 -0.23 0.00 -0.26 0.00 0.00 57.72 57.70 3exf n HIS 338 Cb 0.50 -3.73 -0.14 0.00 1.12 0.00 0.00 29.99 27.74 3exf n HIS 338 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 3exf h ILE 339 N -1.05 1.30 -2.11 1.59 2.04 -1.80 -3.47 117.51 114.02 3exf h ILE 339 Ca -0.34 -2.49 -0.59 0.00 1.00 0.00 0.00 64.86 62.45 3exf h ILE 339 Cb 1.19 2.79 -0.12 0.00 -0.74 0.00 0.00 36.82 39.94 3exf h ILE 339 CO 0.28 0.75 -0.68 -0.31 0.00 0.00 0.00 178.15 178.19 3exf s TYR 340 N -2.89 2.48 -0.19 1.37 2.02 -1.26 -5.12 117.35 113.76 3exf s TYR 340 Ca -0.10 -0.34 -0.04 0.00 -0.37 0.00 0.00 57.07 56.22 3exf s TYR 340 Cb 0.05 -1.21 -0.02 0.00 -0.40 0.00 0.00 41.96 40.37 3exf s TYR 340 CO 0.92 0.62 -0.02 0.45 -1.57 0.00 0.00 175.55 175.95 3exf s SER 341 N -3.62 4.69 -0.92 2.29 0.15 -1.26 -4.50 113.70 110.53 3exf s SER 341 Ca 0.32 -0.22 0.00 0.00 0.70 0.00 0.00 55.95 56.75 3exf s SER 341 Cb -0.03 -1.79 0.00 0.00 -1.71 0.00 0.00 66.02 62.49 3exf s SER 341 CO 0.18 0.09 0.00 -1.20 1.20 0.00 0.00 173.24 173.50 3exf n SER 342 N 4.08 -3.98 -4.95 5.45 7.64 -1.26 -5.05 113.62 115.55 3exf n SER 342 Ca -0.17 0.20 -0.24 0.00 1.01 0.00 0.00 58.87 59.67 3exf n SER 342 Cb 0.52 -2.34 -0.02 0.00 -1.01 0.00 0.00 64.21 61.35 3exf n SER 342 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 3exf s ASP 343 N -2.88 6.33 0.76 6.43 1.01 -1.26 -5.08 116.67 121.98 3exf s ASP 343 Ca 0.00 0.26 -0.12 0.00 0.71 0.00 0.00 52.55 53.40 3exf s ASP 343 Cb 0.00 -1.95 0.05 0.00 1.01 0.00 0.00 42.92 42.03 3exf s ASP 343 CO 0.00 -0.10 1.10 -2.16 0.21 0.00 0.00 175.17 174.22 3exf s PRO 344 N -3.80 2.26 0.09 8.23 0.04 -1.26 -4.07 135.00 136.49 3exf s PRO 344 Ca 0.37 1.27 -0.31 0.00 0.04 0.00 0.00 61.00 62.37 3exf s PRO 344 Cb -0.10 -1.89 -0.08 0.00 0.04 0.00 0.00 34.50 32.47 3exf s PRO 344 CO 0.31 -1.65 1.57 -2.14 0.04 0.00 0.00 177.00 175.13 3exf s PRO 345 N -4.68 4.23 0.23 0.56 0.02 -1.26 -4.83 135.00 129.27 3exf s PRO 345 Ca 0.63 2.26 0.02 0.00 0.02 0.00 0.00 61.00 63.94 3exf s PRO 345 Cb -0.19 -3.44 -0.01 0.00 0.02 0.00 0.00 34.50 30.88 3exf s PRO 345 CO 0.53 -0.65 0.08 1.97 -0.33 0.00 0.00 177.00 178.60 3exf n PHE 346 N 4.96 0.12 -4.34 6.54 -1.74 -0.63 -4.93 117.46 117.43 3exf n PHE 346 Ca 0.14 -1.45 -0.26 0.00 -0.56 0.00 0.00 57.45 55.32 3exf n PHE 346 Cb 0.41 -0.02 -0.10 0.00 1.52 0.00 0.00 39.48 41.29 3exf n PHE 346 CO 0.00 0.00 0.00 -1.21 -0.56 0.00 0.00 176.76 174.99 3exf s GLU 347 N -2.87 1.90 -0.13 3.97 2.02 -1.26 -0.15 118.70 122.18 3exf s GLU 347 Ca 0.11 -1.39 -0.00 0.00 0.02 0.00 0.00 54.97 53.71 3exf s GLU 347 Cb 0.01 -2.04 0.02 0.00 0.10 0.00 0.00 34.13 32.22 3exf s GLU 347 CO 0.08 0.41 -0.10 0.08 0.02 0.00 0.00 175.26 175.74 3exf s VAL 348 N -1.79 1.25 0.13 2.63 1.01 -0.59 -4.91 120.40 118.13 3exf s VAL 348 Ca 0.24 -0.44 -0.35 0.00 0.00 0.00 0.00 61.98 61.44 3exf s VAL 348 Cb -0.08 -1.22 -0.16 0.00 0.00 0.00 0.00 36.38 34.92 3exf s VAL 348 CO 0.14 0.41 1.41 -1.14 0.00 0.00 0.00 175.10 175.91 3exf n ARG 349 N 4.83 1.53 0.00 2.72 0.63 -1.26 -1.56 116.66 123.55 3exf n ARG 349 Ca -0.15 0.55 0.00 0.00 -0.92 0.00 0.00 57.85 57.33 3exf n ARG 349 Cb 0.50 -2.22 0.00 0.00 0.45 0.00 0.00 32.46 31.19 3exf n ARG 349 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3exf n GLY 350 N 2.76 1.37 0.29 5.14 0.00 0.13 -4.90 105.19 109.97 3exf n GLY 350 Ca 0.17 -1.65 0.14 0.00 0.00 0.00 0.00 46.02 44.68 3exf n GLY 350 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3exf h ALA 351 N -1.54 1.54 -3.88 4.61 0.00 -1.96 -3.44 119.26 114.59 3exf h ALA 351 Ca 0.00 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.66 3exf h ALA 351 Cb 0.00 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.72 3exf h ALA 351 CO 0.00 0.03 -0.22 0.27 0.00 0.00 0.00 179.25 179.33 3exf n ASN 352 N -3.89 -0.43 0.25 0.00 0.23 -1.26 -5.05 115.26 105.11 3exf n ASN 352 Ca -0.03 -2.13 0.15 0.00 -0.53 0.00 0.00 54.58 52.04 3exf n ASN 352 Cb 0.11 0.96 0.48 0.00 -2.08 0.00 0.00 39.78 39.25 3exf n ASN 352 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 3exf h GLN 353 N 0.00 0.00 -0.24 -3.83 3.07 -1.99 -2.06 115.11 110.07 3exf h GLN 353 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.61 3exf h GLN 353 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.19 3exf h GLN 353 CO 0.18 0.00 0.00 0.91 0.09 0.00 0.00 178.83 180.01 3exf n TRP 354 N -3.08 0.31 -3.75 0.06 8.01 -1.26 -4.70 117.44 113.04 3exf n TRP 354 Ca 0.02 -0.15 -0.38 0.00 -1.31 0.00 0.00 57.50 55.68 3exf n TRP 354 Cb 0.39 0.00 -0.12 0.00 -2.01 0.00 0.00 31.31 29.57 3exf n TRP 354 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 3exf s ILE 355 N -1.69 3.98 -0.10 -0.99 1.01 -0.78 -5.03 121.20 117.59 3exf s ILE 355 Ca 0.32 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 60.19 3exf s ILE 355 Cb 0.17 -3.11 0.01 0.00 0.01 0.00 0.00 42.46 39.55 3exf s ILE 355 CO 0.25 0.00 -0.16 -0.54 0.00 0.00 0.00 174.94 174.50 3exf s LYS 356 N 1.48 2.23 0.04 2.79 1.02 -1.26 0.22 119.74 126.26 3exf s LYS 356 Ca 0.02 -0.57 0.05 0.00 0.02 0.00 0.00 55.97 55.48 3exf s LYS 356 Cb -0.18 -1.87 -0.03 0.00 -0.52 0.00 0.00 37.83 35.22 3exf s LYS 356 CO 0.03 -0.04 -0.09 -0.06 -0.92 0.00 0.00 175.35 174.27 3exf s PHE 357 N 0.90 2.80 0.20 3.18 0.08 -0.60 -4.95 117.98 119.59 3exf s PHE 357 Ca -0.08 -0.11 -0.30 0.00 0.12 0.00 0.00 56.93 56.56 3exf s PHE 357 Cb -0.15 -1.54 -0.08 0.00 -0.57 0.00 0.00 43.02 40.68 3exf s PHE 357 CO -0.00 0.37 1.01 0.21 -0.10 0.00 0.00 175.22 176.70 3exf s LYS 358 N -1.64 4.72 -0.33 0.44 2.20 -1.26 -1.54 119.74 122.33 3exf s LYS 358 Ca 0.18 1.58 -0.04 0.00 -0.36 0.00 0.00 55.97 57.33 3exf s LYS 358 Cb -0.11 -3.29 0.05 0.00 -1.51 0.00 0.00 37.83 32.97 3exf s LYS 358 CO 0.09 0.29 0.08 0.45 -0.36 0.00 0.00 175.35 175.90 3exf s SER 359 N -0.57 5.16 0.18 1.43 0.15 0.79 -4.09 113.70 116.75 3exf s SER 359 Ca 0.45 -1.28 0.02 0.00 0.70 0.00 0.00 55.95 55.84 3exf s SER 359 Cb -0.27 -1.81 -0.04 0.00 -1.71 0.00 0.00 66.02 62.20 3exf s SER 359 CO 0.33 -0.33 0.33 0.68 1.20 0.00 0.00 173.24 175.46 3exf s VAL 360 N 1.32 5.28 -2.00 4.45 -7.23 -1.26 -1.61 120.40 119.35 3exf s VAL 360 Ca -0.02 -0.62 0.16 0.00 -1.81 0.00 0.00 61.98 59.69 3exf s VAL 360 Cb -0.20 -3.76 0.46 0.00 0.56 0.00 0.00 36.38 33.44 3exf s VAL 360 CO 0.01 -0.16 1.37 -1.20 -0.31 0.00 0.00 175.10 174.80