#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3fgc s LYS 2 N 0.00 3.17 -0.05 2.12 1.02 -0.47 -5.03 119.74 120.50 3fgc s LYS 2 Ca 0.00 -0.48 0.04 0.00 0.02 0.00 0.00 55.97 55.56 3fgc s LYS 2 Cb 0.00 -2.92 -0.00 0.00 -0.52 0.00 0.00 37.83 34.39 3fgc s LYS 2 CO 0.00 0.63 -0.18 -0.06 -0.92 0.00 0.00 175.35 174.82 3fgc s PHE 3 N -1.30 1.87 0.14 3.18 0.08 -1.26 -1.19 117.98 119.49 3fgc s PHE 3 Ca 0.27 -0.59 0.08 0.00 0.12 0.00 0.00 56.93 56.80 3fgc s PHE 3 Cb -0.12 -1.26 -0.04 0.00 -0.57 0.00 0.00 43.02 41.02 3fgc s PHE 3 CO 0.18 -0.22 -0.10 0.20 -0.10 0.00 0.00 175.22 175.18 3fgc s GLY 4 N 0.14 1.75 -0.20 4.36 0.00 -0.07 -1.21 107.32 112.09 3fgc s GLY 4 Ca -0.07 -1.35 -0.02 0.00 0.00 0.00 0.00 44.72 43.28 3fgc s GLY 4 CO 0.03 -1.35 -0.11 0.21 0.00 0.00 0.00 173.10 171.88 3fgc s ASN 5 N -2.49 3.84 -0.30 1.64 2.47 -0.21 -0.52 114.94 119.37 3fgc s ASN 5 Ca 0.23 -0.49 -0.13 0.00 0.42 0.00 0.00 52.86 52.89 3fgc s ASN 5 Cb -0.10 -1.63 -0.04 0.00 -1.45 0.00 0.00 41.25 38.03 3fgc s ASN 5 CO 0.14 -0.00 0.27 0.12 -3.72 0.00 0.00 177.10 173.91 3fgc s PHE 6 N 1.34 3.23 -0.26 0.43 5.99 0.31 -0.81 117.98 128.21 3fgc s PHE 6 Ca 0.04 0.12 -0.08 0.00 0.00 0.00 0.00 56.93 57.02 3fgc s PHE 6 Cb -0.14 -2.49 -0.03 0.00 0.00 0.00 0.00 43.02 40.37 3fgc s PHE 6 CO -0.06 -0.25 0.09 -0.51 -0.00 0.00 0.00 175.22 174.49 3fgc s LEU 7 N 1.87 3.57 0.05 6.12 1.43 -0.09 -4.34 118.68 127.29 3fgc s LEU 7 Ca 0.10 -0.22 0.19 0.00 -1.03 0.00 0.00 54.13 53.17 3fgc s LEU 7 Cb -0.16 -1.95 -0.15 0.00 0.03 0.00 0.00 46.19 43.95 3fgc s LEU 7 CO 0.11 -0.05 0.73 0.18 0.23 0.00 0.00 176.35 177.54 3fgc n LEU 8 N 4.94 0.63 -2.79 1.79 4.77 -1.26 -2.34 117.00 122.74 3fgc n LEU 8 Ca -0.16 0.27 -0.19 0.00 -0.03 0.00 0.00 56.01 55.90 3fgc n LEU 8 Cb 0.51 0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 3fgc n LEU 8 CO 0.31 0.09 -0.11 0.41 -1.33 0.00 0.00 177.39 176.77 3fgc n THR 9 N -2.73 -1.15 -1.94 -5.08 -1.04 -1.26 -4.30 114.28 96.79 3fgc n THR 9 Ca -0.09 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.50 3fgc n THR 9 Cb 0.78 -2.49 -0.02 0.00 -1.82 0.00 0.00 70.33 66.78 3fgc n THR 9 CO 0.00 0.00 0.00 -0.47 -0.64 0.00 0.00 175.07 173.96 3fgc s TYR 10 N -2.92 2.92 -0.50 -1.42 5.04 -1.26 -0.16 117.35 119.04 3fgc s TYR 10 Ca 0.17 0.98 -0.12 0.00 -2.44 0.00 0.00 57.07 55.65 3fgc s TYR 10 Cb -0.08 -3.90 0.12 0.00 0.35 0.00 0.00 41.96 38.45 3fgc s TYR 10 CO 0.21 -2.92 0.41 -1.14 -1.34 0.00 0.00 175.55 170.77 3fgc s GLN 11 N -0.55 2.70 0.50 4.97 0.74 0.33 -4.93 119.66 123.41 3fgc s GLN 11 Ca 0.60 -1.75 -0.22 0.00 0.05 0.00 0.00 55.36 54.04 3fgc s GLN 11 Cb -0.44 -4.09 -0.06 0.00 1.10 0.00 0.00 33.01 29.52 3fgc s GLN 11 CO 0.46 -1.25 1.23 -1.25 -0.55 0.00 0.00 175.29 173.92 3fgc s PRO 12 N 1.45 3.51 0.67 1.67 0.04 -1.26 -4.83 135.00 136.24 3fgc s PRO 12 Ca 0.05 1.91 0.43 0.00 0.04 0.00 0.00 61.00 63.43 3fgc s PRO 12 Cb -0.28 -2.32 2.33 0.00 0.04 0.00 0.00 34.50 34.28 3fgc s PRO 12 CO 0.01 -0.79 2.32 -1.00 0.04 0.00 0.00 177.00 177.58 3fgc h PRO 13 N 1.77 0.00 -0.00 0.56 0.13 -1.98 -1.11 132.00 131.37 3fgc h PRO 13 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 3fgc h PRO 13 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 3fgc h PRO 13 CO 0.59 0.00 -0.24 -0.85 -0.23 0.00 0.00 178.00 177.27 3fgc n GLU 14 N -3.09 0.35 -4.01 0.86 0.00 -1.26 -4.83 120.64 108.67 3fgc n GLU 14 Ca -0.03 -0.15 -0.33 0.00 0.00 0.00 0.00 57.16 56.65 3fgc n GLU 14 Cb 0.11 -1.50 -0.06 0.00 0.00 0.00 0.00 31.44 29.99 3fgc n GLU 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3fgc s LEU 15 N -2.75 4.10 0.67 -1.84 1.43 -0.42 -5.12 118.68 114.74 3fgc s LEU 15 Ca 0.19 0.21 -0.07 0.00 -1.03 0.00 0.00 54.13 53.44 3fgc s LEU 15 Cb 0.19 -2.48 0.04 0.00 0.03 0.00 0.00 46.19 43.97 3fgc s LEU 15 CO 0.56 0.25 0.99 -0.94 0.23 0.00 0.00 176.35 177.45 3fgc s SER 16 N -1.95 5.15 0.29 2.29 1.04 -1.26 -4.80 113.70 114.46 3fgc s SER 16 Ca 0.26 0.64 0.01 0.00 0.48 0.00 0.00 55.95 57.34 3fgc s SER 16 Cb -0.12 -1.43 0.44 0.00 0.10 0.00 0.00 66.02 65.01 3fgc s SER 16 CO 0.18 -1.39 1.80 1.56 0.98 0.00 0.00 173.24 176.37 3fgc h GLN 17 N -0.48 0.66 -0.66 4.02 4.20 -1.99 -1.43 115.11 119.43 3fgc h GLN 17 Ca -0.45 -0.17 -0.05 0.00 0.06 0.00 0.00 58.65 58.04 3fgc h GLN 17 Cb 1.29 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.96 3fgc h GLN 17 CO 0.61 0.70 0.20 1.15 -0.67 0.00 0.00 178.83 180.82 3fgc h THR 18 N 0.63 1.25 -0.30 -0.54 2.02 -1.99 -0.47 112.91 113.51 3fgc h THR 18 Ca 0.12 -0.87 -0.10 0.00 0.77 0.00 0.00 66.41 66.34 3fgc h THR 18 Cb 0.42 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.39 3fgc h THR 18 CO 0.02 0.33 -0.19 -0.33 0.37 0.00 0.00 175.52 175.72 3fgc h GLU 19 N 0.96 0.66 -0.76 6.66 5.08 -1.86 -1.49 114.58 123.83 3fgc h GLU 19 Ca 0.21 -0.31 0.03 0.00 -1.00 0.00 0.00 59.36 58.30 3fgc h GLU 19 Cb 0.30 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.50 3fgc h GLU 19 CO -0.01 0.90 0.48 0.28 -1.00 0.00 0.00 179.01 179.67 3fgc h VAL 20 N 0.41 1.11 -0.65 3.13 2.07 -1.08 -2.27 116.25 118.97 3fgc h VAL 20 Ca 0.06 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.23 3fgc h VAL 20 Cb 0.73 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 3fgc h VAL 20 CO 0.05 0.17 0.28 0.24 0.02 0.00 0.00 177.57 178.33 3fgc h MET 21 N 0.94 0.96 -0.83 1.57 2.86 -0.91 -1.93 114.93 117.60 3fgc h MET 21 Ca 0.31 -0.16 0.07 0.00 -2.06 0.00 0.00 59.70 57.85 3fgc h MET 21 Cb 0.02 -0.16 -0.05 0.00 0.06 0.00 0.00 31.60 31.46 3fgc h MET 21 CO -0.11 0.79 0.54 -0.22 1.06 0.00 0.00 176.91 178.97 3fgc h LYS 22 N 0.91 0.86 -0.37 1.72 3.64 -1.14 -2.43 116.57 119.76 3fgc h LYS 22 Ca 0.22 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.46 3fgc h LYS 22 Cb 0.18 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 3fgc h LYS 22 CO -0.02 0.57 -0.09 0.00 -2.27 0.00 0.00 179.45 177.64 3fgc h ARG 23 N 0.89 0.72 -0.27 1.90 3.08 -1.12 0.34 114.38 119.92 3fgc h ARG 23 Ca 0.36 -0.28 0.06 0.00 0.07 0.00 0.00 59.98 60.20 3fgc h ARG 23 Cb 0.27 -0.04 -0.07 0.00 0.08 0.00 0.00 29.97 30.20 3fgc h ARG 23 CO -0.13 0.87 -0.26 1.25 -1.07 0.00 0.00 179.97 180.63 3fgc h LEU 24 N 0.52 -0.83 -0.14 3.04 5.85 -1.11 0.18 115.31 122.82 3fgc h LEU 24 Ca 0.09 0.15 0.03 0.00 0.84 0.00 0.00 57.88 58.99 3fgc h LEU 24 Cb 0.61 0.39 -0.03 0.00 0.37 0.00 0.00 40.66 42.00 3fgc h LEU 24 CO 0.04 -0.29 -0.04 0.58 -0.34 0.00 0.00 178.44 178.39 3fgc h VAL 25 N -0.25 0.85 -0.32 1.05 2.07 -1.25 -1.76 116.25 116.64 3fgc h VAL 25 Ca 0.14 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.52 3fgc h VAL 25 Cb 0.48 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 3fgc h VAL 25 CO -0.41 0.00 -0.36 0.78 0.02 0.00 0.00 177.57 177.60 3fgc h ASN 26 N -0.00 0.76 0.78 0.57 -0.26 -0.72 -2.46 115.58 114.25 3fgc h ASN 26 Ca 0.07 -0.33 -0.16 0.00 -0.56 0.00 0.00 56.30 55.32 3fgc h ASN 26 Cb 0.11 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 37.13 3fgc h ASN 26 CO -0.15 1.05 -0.75 -0.07 -1.06 0.00 0.00 177.43 176.45 3fgc h LEU 27 N 0.60 0.00 -0.23 1.61 3.38 -0.47 -1.27 115.31 118.92 3fgc h LEU 27 Ca 0.06 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 3fgc h LEU 27 Cb 0.89 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.63 3fgc h LEU 27 CO 0.08 0.75 0.10 1.23 0.09 0.00 0.00 178.44 180.69 3fgc h GLY 28 N 2.30 0.37 2.00 0.83 0.00 -1.21 -2.93 103.07 104.44 3fgc h GLY 28 Ca -0.01 -0.20 -0.05 0.00 0.00 0.00 0.00 47.33 47.07 3fgc h GLY 28 CO 0.10 0.19 -0.22 0.50 0.00 0.00 0.00 176.54 177.11 3fgc h LYS 29 N 0.23 0.00 0.00 4.80 1.57 -1.32 -3.10 116.57 118.75 3fgc h LYS 29 Ca 0.08 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.82 3fgc h LYS 29 Cb 0.17 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3fgc h LYS 29 CO -0.01 0.22 -0.18 0.00 -0.57 0.00 0.00 179.45 178.92 3fgc h ALA 30 N 1.78 0.89 0.24 3.86 0.00 -1.17 -3.41 119.26 121.46 3fgc h ALA 30 Ca -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3fgc h ALA 30 Cb 0.54 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3fgc h ALA 30 CO 0.03 0.22 -0.12 0.77 0.00 0.00 0.00 179.25 180.15 3fgc h SER 31 N 0.00 -0.27 -0.91 0.00 0.02 -1.43 -2.77 113.55 108.18 3fgc h SER 31 Ca -0.00 -0.08 0.17 0.00 -0.84 0.00 0.00 61.79 61.04 3fgc h SER 31 Cb 1.10 0.07 -0.10 0.00 0.14 0.00 0.00 62.40 63.61 3fgc h SER 31 CO 0.02 -0.09 0.50 -0.08 -1.14 0.00 0.00 176.83 176.04 3fgc h GLU 32 N -0.44 0.65 0.00 3.45 4.81 -1.78 -1.08 114.58 120.19 3fgc h GLU 32 Ca -0.03 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 3fgc h GLU 32 Cb 0.33 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.57 3fgc h GLU 32 CO 0.05 0.43 -0.06 0.78 -0.73 0.00 0.00 179.01 179.48 3fgc h GLY 33 N 0.66 0.00 -2.14 1.92 0.00 -1.76 -1.80 103.07 99.96 3fgc h GLY 33 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.84 3fgc h GLY 33 CO -0.38 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.16 3fgc n GLY 35 N 1.45 0.82 3.70 0.00 0.00 -0.68 -4.62 105.19 105.87 3fgc n GLY 35 Ca 0.20 -0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.77 3fgc n GLY 35 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3fgc s PHE 36 N -2.00 3.49 0.09 1.61 0.08 -1.00 -4.67 117.98 115.58 3fgc s PHE 36 Ca 0.00 1.10 0.12 0.00 0.12 0.00 0.00 56.93 58.26 3fgc s PHE 36 Cb 0.00 -2.78 0.15 0.00 -0.57 0.00 0.00 43.02 39.82 3fgc s PHE 36 CO 0.00 -0.01 1.48 -0.44 -0.10 0.00 0.00 175.22 176.15 3fgc h ASP 37 N 7.02 0.00 -4.00 1.36 3.32 -1.48 -3.33 116.42 119.31 3fgc h ASP 37 Ca -0.37 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 56.41 3fgc h ASP 37 Cb 1.17 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.45 3fgc h ASP 37 CO 0.77 0.68 -0.74 -0.89 -1.72 0.00 0.00 179.24 177.34 3fgc s THR 38 N -3.13 0.25 -0.16 0.35 2.01 -1.15 -1.40 115.64 112.41 3fgc s THR 38 Ca 0.01 -0.27 -0.04 0.00 0.31 0.00 0.00 61.69 61.71 3fgc s THR 38 Cb 0.10 -0.24 -0.03 0.00 0.01 0.00 0.00 72.50 72.35 3fgc s THR 38 CO 0.76 -0.02 -0.03 -0.69 -0.69 0.00 0.00 174.62 173.95 3fgc s VAL 39 N -0.29 3.91 -0.10 3.82 1.01 0.23 -1.05 120.40 127.93 3fgc s VAL 39 Ca -0.01 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 61.61 3fgc s VAL 39 Cb -0.03 -2.72 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 3fgc s VAL 39 CO -0.00 0.49 -0.05 0.26 0.00 0.00 0.00 175.10 175.79 3fgc s TRP 40 N 0.42 2.99 -0.17 5.22 0.52 0.01 -0.17 118.94 127.76 3fgc s TRP 40 Ca -0.04 -0.11 -0.01 0.00 0.02 0.00 0.00 56.10 55.97 3fgc s TRP 40 Cb -0.14 -1.82 -0.01 0.00 -1.15 0.00 0.00 33.47 30.36 3fgc s TRP 40 CO 0.03 0.19 -0.11 -0.51 0.02 0.00 0.00 176.95 176.57 3fgc s LEU 41 N -0.34 2.67 0.33 2.99 1.43 0.67 -0.92 118.68 125.52 3fgc s LEU 41 Ca 0.05 -0.41 -0.26 0.00 -1.03 0.00 0.00 54.13 52.48 3fgc s LEU 41 Cb -0.12 -1.63 -0.10 0.00 0.03 0.00 0.00 46.19 44.37 3fgc s LEU 41 CO 0.02 0.06 0.97 -0.22 0.23 0.00 0.00 176.35 177.42 3fgc s LEU 42 N 0.96 4.34 -0.17 1.79 2.96 -0.99 -0.72 118.68 126.85 3fgc s LEU 42 Ca -0.02 1.90 -0.08 0.00 -0.22 0.00 0.00 54.13 55.72 3fgc s LEU 42 Cb -0.15 -4.00 -0.04 0.00 0.50 0.00 0.00 46.19 42.50 3fgc s LEU 42 CO -0.01 -0.13 0.10 -0.70 -1.32 0.00 0.00 176.35 174.29 3fgc s GLU 43 N -2.05 3.87 -0.04 1.98 2.12 -1.25 -4.68 118.70 118.66 3fgc s GLU 43 Ca 0.51 -0.26 -0.24 0.00 0.36 0.00 0.00 54.97 55.34 3fgc s GLU 43 Cb -0.20 -3.26 0.05 0.00 0.26 0.00 0.00 34.13 30.98 3fgc s GLU 43 CO 0.26 0.42 0.52 -1.58 -0.54 0.00 0.00 175.26 174.34 3fgc s HIS 44 N -0.03 -0.46 -0.02 5.30 2.46 0.13 -4.89 115.29 117.79 3fgc s HIS 44 Ca 0.08 0.78 0.05 0.00 0.47 0.00 0.00 55.06 56.45 3fgc s HIS 44 Cb -0.12 0.27 -0.01 0.00 -0.13 0.00 0.00 32.58 32.59 3fgc s HIS 44 CO 0.00 -0.51 -0.18 -1.01 -2.47 0.00 0.00 174.74 170.58 3fgc s HIS 45 N -1.19 1.63 0.00 3.88 3.76 -1.26 -2.45 115.29 119.66 3fgc s HIS 45 Ca -0.12 -0.34 0.00 0.00 -0.15 0.00 0.00 55.06 54.45 3fgc s HIS 45 Cb -0.02 -1.06 0.00 0.00 1.11 0.00 0.00 32.58 32.61 3fgc s HIS 45 CO 0.07 -0.06 0.00 1.19 -0.85 0.00 0.00 174.74 175.09 3fgc n PHE 46 N 2.75 0.00 -4.30 1.40 3.72 -1.26 -4.92 117.46 114.85 3fgc n PHE 46 Ca -0.15 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.08 3fgc n PHE 46 Cb 0.54 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.97 3fgc n PHE 46 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3fgc s THR 47 N -1.64 1.19 -1.07 4.37 -4.23 -1.26 -5.03 115.64 107.95 3fgc s THR 47 Ca 0.00 -2.07 0.10 0.00 -1.18 0.00 0.00 61.69 58.54 3fgc s THR 47 Cb 0.00 -2.11 0.10 0.00 1.34 0.00 0.00 72.50 71.83 3fgc s THR 47 CO 0.00 -0.53 1.29 -1.84 -0.54 0.00 0.00 174.62 173.00 3fgc n GLU 48 N -0.33 0.02 -0.19 3.99 0.00 -1.26 -2.98 120.64 119.90 3fgc n GLU 48 Ca -0.08 0.31 0.06 0.00 0.00 0.00 0.00 57.16 57.46 3fgc n GLU 48 Cb 0.62 -1.50 0.34 0.00 0.00 0.00 0.00 31.44 30.90 3fgc n GLU 48 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 3fgc h PHE 49 N 0.00 0.79 -1.79 -1.84 3.57 -1.88 0.96 116.94 116.74 3fgc h PHE 49 Ca 0.00 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.56 3fgc h PHE 49 Cb 0.15 -0.26 -0.24 0.00 2.79 0.00 0.00 35.95 38.40 3fgc h PHE 49 CO 0.00 0.42 0.23 0.20 -2.23 0.00 0.00 178.31 176.92 3fgc s GLY 50 N -3.56 -0.35 0.00 2.40 0.00 -1.16 -4.08 107.32 100.57 3fgc s GLY 50 Ca -0.10 2.59 0.24 0.00 0.00 0.00 0.00 44.72 47.45 3fgc s GLY 50 CO 0.77 2.21 1.29 1.04 0.00 0.00 0.00 173.10 178.41 3fgc n LEU 51 N 3.39 1.00 -4.50 0.66 4.77 0.77 -4.26 117.00 118.84 3fgc n LEU 51 Ca -0.17 -0.30 -0.43 0.00 -0.03 0.00 0.00 56.01 55.08 3fgc n LEU 51 Cb 0.57 -0.12 -0.05 0.00 -2.33 0.00 0.00 43.42 41.49 3fgc n LEU 51 CO 0.01 0.21 0.55 -0.22 -1.33 0.00 0.00 177.39 176.61 3fgc s LEU 52 N -2.78 4.42 0.00 2.23 2.96 -1.26 -4.89 118.68 119.37 3fgc s LEU 52 Ca 0.15 -0.45 0.22 0.00 -0.22 0.00 0.00 54.13 53.83 3fgc s LEU 52 Cb 0.18 -2.74 -0.01 0.00 0.50 0.00 0.00 46.19 44.11 3fgc s LEU 52 CO 0.67 -1.01 1.04 0.61 -1.32 0.00 0.00 176.35 176.33 3fgc n GLY 53 N 5.09 -1.08 2.40 7.98 0.00 -1.02 -0.69 105.19 117.86 3fgc n GLY 53 Ca -0.01 -0.52 -0.26 0.00 0.00 0.00 0.00 46.02 45.23 3fgc n GLY 53 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3fgc n ASN 54 N -1.55 1.87 0.26 1.61 4.13 -1.26 -4.65 115.26 115.68 3fgc n ASN 54 Ca 0.04 -3.02 0.17 0.00 1.68 0.00 0.00 54.58 53.46 3fgc n ASN 54 Cb 0.34 -0.66 0.91 0.00 -1.54 0.00 0.00 39.78 38.84 3fgc n ASN 54 CO 0.00 0.00 0.00 -0.65 0.28 0.00 0.00 177.26 176.89 3fgc h PRO 55 N 4.45 0.00 -0.95 3.52 0.11 -1.88 -2.29 132.00 134.95 3fgc h PRO 55 Ca 0.16 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.28 3fgc h PRO 55 Cb 0.78 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 31.84 3fgc h PRO 55 CO 0.63 0.00 0.63 1.88 -0.21 0.00 0.00 178.00 180.93 3fgc h TYR 56 N 0.00 1.19 0.03 0.65 0.05 -1.98 0.48 116.97 117.39 3fgc h TYR 56 Ca 0.05 0.03 -0.19 0.00 0.05 0.00 0.00 58.73 58.66 3fgc h TYR 56 Cb 0.32 -0.40 0.02 0.00 1.01 0.00 0.00 36.73 37.67 3fgc h TYR 56 CO 0.00 0.73 -0.78 0.28 -1.05 0.00 0.00 178.16 177.35 3fgc h VAL 57 N 1.27 1.39 -0.59 -2.88 2.07 -1.86 -1.16 116.25 114.50 3fgc h VAL 57 Ca 0.36 -2.20 -0.05 0.00 0.82 0.00 0.00 66.70 65.62 3fgc h VAL 57 Cb -0.11 2.63 -0.03 0.00 -1.52 0.00 0.00 31.29 32.27 3fgc h VAL 57 CO -0.09 0.65 0.15 0.00 0.02 0.00 0.00 177.57 178.31 3fgc h ALA 58 N 0.30 1.17 -0.55 1.67 0.00 -1.45 -2.09 119.26 118.32 3fgc h ALA 58 Ca -0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 3fgc h ALA 58 Cb 1.49 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 3fgc h ALA 58 CO 0.15 0.57 0.25 0.00 0.00 0.00 0.00 179.25 180.23 3fgc h ALA 59 N 1.30 0.71 -0.50 0.00 0.00 -0.88 -2.34 119.26 117.54 3fgc h ALA 59 Ca 0.19 -0.13 0.10 0.00 0.00 0.00 0.00 54.91 55.07 3fgc h ALA 59 Cb 0.30 -0.22 -0.10 0.00 0.00 0.00 0.00 17.79 17.77 3fgc h ALA 59 CO -0.00 0.28 -0.16 0.00 0.00 0.00 0.00 179.25 179.36 3fgc h ALA 60 N 1.09 0.26 0.56 0.00 0.00 -0.85 0.22 119.26 120.54 3fgc h ALA 60 Ca 0.19 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 3fgc h ALA 60 Cb 0.14 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 3fgc h ALA 60 CO -0.02 -0.48 -0.31 1.25 0.00 0.00 0.00 179.25 179.68 3fgc h HIS 61 N -0.05 -0.82 -0.68 0.00 6.17 -1.22 0.17 115.15 118.73 3fgc h HIS 61 Ca 0.24 -0.01 -0.05 0.00 0.71 0.00 0.00 60.37 61.26 3fgc h HIS 61 Cb 0.42 0.28 -0.03 0.00 2.52 0.00 0.00 27.41 30.60 3fgc h HIS 61 CO -0.46 -0.49 0.23 1.25 0.71 0.00 0.00 177.93 179.18 3fgc h LEU 62 N -0.81 0.95 -1.11 0.26 5.85 -1.32 -1.84 115.31 117.29 3fgc h LEU 62 Ca -0.07 -0.16 -0.05 0.00 0.84 0.00 0.00 57.88 58.45 3fgc h LEU 62 Cb 0.65 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3fgc h LEU 62 CO 0.09 0.87 0.08 -0.07 -0.34 0.00 0.00 178.44 179.08 3fgc h LEU 63 N 1.00 0.66 -0.85 2.25 3.38 -0.40 -2.83 115.31 118.51 3fgc h LEU 63 Ca 0.22 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 3fgc h LEU 63 Cb 0.25 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 3fgc h LEU 63 CO -0.01 0.68 0.41 1.23 0.09 0.00 0.00 178.44 180.83 3fgc h GLY 64 N 0.91 1.32 0.74 0.83 0.00 -0.05 -2.77 103.07 104.05 3fgc h GLY 64 Ca 0.15 -0.66 0.00 0.00 0.00 0.00 0.00 47.33 46.82 3fgc h GLY 64 CO 0.00 0.62 0.00 0.00 0.00 0.00 0.00 176.54 177.17 3fgc n ALA 65 N -2.42 2.67 -2.34 3.60 0.00 -0.75 -4.91 120.51 116.36 3fgc n ALA 65 Ca 0.08 -0.23 -0.20 0.00 0.00 0.00 0.00 53.44 53.10 3fgc n ALA 65 Cb 0.14 -1.45 -0.09 0.00 0.00 0.00 0.00 19.45 18.05 3fgc n ALA 65 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3fgc s THR 66 N -2.00 0.26 0.02 0.00 -4.23 -1.04 -5.07 115.64 103.57 3fgc s THR 66 Ca 0.45 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.96 3fgc s THR 66 Cb 0.21 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.57 3fgc s THR 66 CO 0.35 0.00 0.00 1.21 -0.54 0.00 0.00 174.62 175.64 3fgc n GLU 67 N -0.62 0.00 0.00 3.99 2.13 -1.26 -4.90 120.64 119.98 3fgc n GLU 67 Ca 0.02 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.85 3fgc n GLU 67 Cb 0.64 -0.28 -0.01 0.00 0.27 0.00 0.00 31.44 32.07 3fgc n GLU 67 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3fgc n THR 68 N -2.84 0.00 -2.42 6.31 -2.24 -1.26 -5.02 114.28 106.82 3fgc n THR 68 Ca 0.00 -0.45 -0.41 0.00 -2.27 0.00 0.00 64.05 60.92 3fgc n THR 68 Cb 0.25 1.01 -0.04 0.00 -2.10 0.00 0.00 70.33 69.45 3fgc n THR 68 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3fgc s LEU 69 N -1.77 4.52 0.09 3.22 2.96 -1.26 -5.03 118.68 121.41 3fgc s LEU 69 Ca 0.01 2.30 -0.06 0.00 -0.22 0.00 0.00 54.13 56.17 3fgc s LEU 69 Cb 0.02 -3.62 -0.05 0.00 0.50 0.00 0.00 46.19 43.03 3fgc s LEU 69 CO 0.09 -0.23 0.35 0.20 -1.32 0.00 0.00 176.35 175.44 3fgc s ASN 70 N -0.61 6.52 -0.03 3.68 0.02 -0.49 -4.91 114.94 119.12 3fgc s ASN 70 Ca 0.47 0.61 0.03 0.00 -1.02 0.00 0.00 52.86 52.95 3fgc s ASN 70 Cb -0.33 -2.10 0.00 0.00 0.02 0.00 0.00 41.25 38.84 3fgc s ASN 70 CO 0.41 0.14 -0.10 -0.69 0.02 0.00 0.00 177.10 176.88 3fgc s VAL 71 N -1.50 0.86 0.28 1.60 1.01 -0.49 -0.60 120.40 121.56 3fgc s VAL 71 Ca 0.36 -0.39 0.02 0.00 0.00 0.00 0.00 61.98 61.97 3fgc s VAL 71 Cb -0.13 -0.77 -0.06 0.00 0.00 0.00 0.00 36.38 35.42 3fgc s VAL 71 CO 0.21 0.27 0.08 -0.83 0.00 0.00 0.00 175.10 174.83 3fgc s GLY 72 N 0.27 1.84 -0.14 4.51 0.00 0.77 -0.88 107.32 113.68 3fgc s GLY 72 Ca -0.05 -1.93 -0.06 0.00 0.00 0.00 0.00 44.72 42.68 3fgc s GLY 72 CO 0.01 -1.68 0.08 -0.51 0.00 0.00 0.00 173.10 171.00 3fgc s THR 73 N -3.58 4.96 -0.41 0.90 -4.23 -0.44 -0.24 115.64 112.60 3fgc s THR 73 Ca 0.37 0.01 0.04 0.00 -1.18 0.00 0.00 61.69 60.93 3fgc s THR 73 Cb 0.08 -3.18 0.18 0.00 1.34 0.00 0.00 72.50 70.92 3fgc s THR 73 CO 0.14 0.54 0.37 0.00 -0.54 0.00 0.00 174.62 175.13 3fgc n ALA 74 N 2.70 2.69 -2.33 3.99 0.00 0.10 -2.14 120.51 125.53 3fgc n ALA 74 Ca -0.18 -3.07 -0.08 0.00 0.00 0.00 0.00 53.44 50.11 3fgc n ALA 74 Cb 0.53 -0.78 -0.09 0.00 0.00 0.00 0.00 19.45 19.12 3fgc n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3fgc s ALA 75 N -0.01 0.21 0.24 0.00 0.00 -1.26 -3.78 121.76 117.17 3fgc s ALA 75 Ca 0.33 -0.94 -0.30 0.00 0.00 0.00 0.00 51.96 51.05 3fgc s ALA 75 Cb 0.05 0.33 -0.10 0.00 0.00 0.00 0.00 23.12 23.40 3fgc s ALA 75 CO -0.19 -0.40 1.42 0.42 0.00 0.00 0.00 175.76 177.01 3fgc s ILE 76 N -3.68 2.72 -0.85 0.00 -1.09 -0.30 -3.83 121.20 114.18 3fgc s ILE 76 Ca 0.04 0.61 -0.24 0.00 -2.23 0.00 0.00 60.65 58.84 3fgc s ILE 76 Cb 0.05 -3.39 0.06 0.00 -1.58 0.00 0.00 42.46 37.61 3fgc s ILE 76 CO -0.09 0.10 1.25 -0.69 -1.23 0.00 0.00 174.94 174.28 3fgc s VAL 77 N -0.01 4.05 0.12 2.92 1.01 -1.26 -0.68 120.40 126.54 3fgc s VAL 77 Ca 0.59 -0.42 -0.20 0.00 0.00 0.00 0.00 61.98 61.94 3fgc s VAL 77 Cb -0.41 -4.90 -0.08 0.00 0.00 0.00 0.00 36.38 30.99 3fgc s VAL 77 CO 0.43 -1.76 1.75 0.25 0.00 0.00 0.00 175.10 175.77 3fgc h LEU 78 N 12.25 0.05 -2.48 3.92 5.85 -1.61 -3.12 115.31 130.16 3fgc h LEU 78 Ca -0.06 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.68 3fgc h LEU 78 Cb 1.04 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 3fgc h LEU 78 CO 1.29 0.05 0.02 -0.65 -0.34 0.00 0.00 178.44 178.81 3fgc h PRO 79 N 0.12 0.00 -0.27 5.25 0.11 -1.80 -3.16 132.00 132.25 3fgc h PRO 79 Ca 0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.17 3fgc h PRO 79 Cb 0.04 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.15 3fgc h PRO 79 CO -0.07 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 177.97 3fgc n THR 80 N -3.78 0.35 -4.01 -1.15 -2.24 -1.18 -4.80 114.28 97.46 3fgc n THR 80 Ca -0.03 -0.43 -0.10 0.00 -2.27 0.00 0.00 64.05 61.23 3fgc n THR 80 Cb 0.10 0.33 -0.11 0.00 -2.10 0.00 0.00 70.33 68.55 3fgc n THR 80 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3fgc s ALA 81 N -1.65 0.27 0.18 6.98 0.00 -1.20 -4.89 121.76 121.46 3fgc s ALA 81 Ca 0.29 -0.70 -0.32 0.00 0.00 0.00 0.00 51.96 51.23 3fgc s ALA 81 Cb 0.16 0.14 -0.11 0.00 0.00 0.00 0.00 23.12 23.30 3fgc s ALA 81 CO 0.22 -0.15 1.77 -1.58 0.00 0.00 0.00 175.76 176.02 3fgc s HIS 82 N -1.71 2.63 0.41 0.00 2.46 -1.26 -4.92 115.29 112.90 3fgc s HIS 82 Ca -0.12 0.20 0.11 0.00 0.47 0.00 0.00 55.06 55.72 3fgc s HIS 82 Cb -0.08 -4.17 0.86 0.00 -0.13 0.00 0.00 32.58 29.07 3fgc s HIS 82 CO -0.02 -4.56 1.95 -1.00 -2.47 0.00 0.00 174.74 168.64 3fgc h PRO 83 N 7.44 0.17 -0.16 2.88 0.13 -1.93 -1.49 132.00 139.04 3fgc h PRO 83 Ca -0.44 -0.04 -0.17 0.00 -0.87 0.00 0.00 66.00 64.49 3fgc h PRO 83 Cb 1.21 -0.02 0.01 0.00 0.13 0.00 0.00 31.00 32.32 3fgc h PRO 83 CO 0.96 0.31 -0.55 0.28 -0.23 0.00 0.00 178.00 178.77 3fgc h VAL 84 N 0.16 1.32 -0.66 1.56 2.07 -1.95 -1.43 116.25 117.32 3fgc h VAL 84 Ca 0.03 -1.80 0.04 0.00 0.82 0.00 0.00 66.70 65.80 3fgc h VAL 84 Cb 0.34 2.00 -0.05 0.00 -1.52 0.00 0.00 31.29 32.06 3fgc h VAL 84 CO 0.02 0.56 0.39 0.03 0.02 0.00 0.00 177.57 178.59 3fgc h ARG 85 N 0.33 0.72 -0.74 1.57 3.08 -1.85 -2.26 114.38 115.23 3fgc h ARG 85 Ca -0.02 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 59.93 3fgc h ARG 85 Cb 1.17 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 31.03 3fgc h ARG 85 CO 0.12 0.48 0.23 1.96 -1.07 0.00 0.00 179.97 181.69 3fgc h GLN 86 N 0.75 1.14 -0.85 0.04 4.20 -1.26 -1.99 115.11 117.13 3fgc h GLN 86 Ca 0.28 -0.24 -0.02 0.00 0.06 0.00 0.00 58.65 58.73 3fgc h GLN 86 Cb 0.09 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.67 3fgc h GLN 86 CO -0.14 0.97 0.45 0.00 -0.67 0.00 0.00 178.83 179.44 3fgc h ALA 87 N 1.15 1.09 -0.21 3.87 0.00 -1.00 0.16 119.26 124.31 3fgc h ALA 87 Ca 0.24 -0.13 0.03 0.00 0.00 0.00 0.00 54.91 55.04 3fgc h ALA 87 Cb 0.30 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 3fgc h ALA 87 CO -0.01 0.61 0.04 0.93 0.00 0.00 0.00 179.25 180.82 3fgc h GLU 88 N 1.19 0.12 -0.03 0.00 5.08 -1.31 -1.49 114.58 118.13 3fgc h GLU 88 Ca 0.30 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.65 3fgc h GLU 88 Cb 0.05 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3fgc h GLU 88 CO -0.05 0.08 0.02 -0.44 -1.00 0.00 0.00 179.01 177.62 3fgc h ASP 89 N 0.12 0.04 -0.19 1.42 3.32 -0.95 -1.06 116.42 119.12 3fgc h ASP 89 Ca 0.10 -0.02 0.02 0.00 0.02 0.00 0.00 57.03 57.15 3fgc h ASP 89 Cb 0.10 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 3fgc h ASP 89 CO -0.13 0.05 0.05 0.58 -1.72 0.00 0.00 179.24 178.07 3fgc h VAL 90 N 0.02 0.94 -0.65 -1.35 2.07 -0.68 -0.68 116.25 115.92 3fgc h VAL 90 Ca 0.01 -0.05 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 3fgc h VAL 90 Cb 0.01 0.79 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 3fgc h VAL 90 CO -0.00 0.02 0.37 0.78 0.02 0.00 0.00 177.57 178.77 3fgc h ASN 91 N 0.14 0.80 -0.20 0.57 2.35 -1.10 0.11 115.58 118.24 3fgc h ASN 91 Ca 0.08 -0.08 0.04 0.00 -0.55 0.00 0.00 56.30 55.79 3fgc h ASN 91 Cb 0.06 -0.20 -0.04 0.00 0.05 0.00 0.00 38.32 38.19 3fgc h ASN 91 CO -0.10 0.65 -0.05 -0.07 -1.65 0.00 0.00 177.43 176.21 3fgc h LEU 92 N 0.89 -0.19 -0.15 1.61 3.38 -1.09 0.38 115.31 120.15 3fgc h LEU 92 Ca 0.23 0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.29 3fgc h LEU 92 Cb 0.01 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3fgc h LEU 92 CO -0.04 -0.07 -0.02 -0.07 0.09 0.00 0.00 178.44 178.34 3fgc h LEU 93 N -0.00 -0.09 -0.36 1.67 3.38 -0.86 -0.21 115.31 118.83 3fgc h LEU 93 Ca 0.10 0.04 0.08 0.00 0.09 0.00 0.00 57.88 58.18 3fgc h LEU 93 Cb 0.15 0.07 -0.07 0.00 0.09 0.00 0.00 40.66 40.90 3fgc h LEU 93 CO -0.21 -0.03 -0.12 -0.78 0.09 0.00 0.00 178.44 177.40 3fgc h ASP 94 N 0.03 -0.42 0.43 -0.43 3.58 -0.62 -0.99 116.42 118.01 3fgc h ASP 94 Ca 0.07 0.12 -0.02 0.00 0.42 0.00 0.00 57.03 57.62 3fgc h ASP 94 Cb 0.09 0.26 0.00 0.00 1.72 0.00 0.00 39.33 41.41 3fgc h ASP 94 CO -0.13 -0.15 -0.21 1.56 -2.88 0.00 0.00 179.24 177.43 3fgc h GLN 95 N -0.04 -0.56 -0.74 0.28 1.08 -0.05 0.02 115.11 115.10 3fgc h GLN 95 Ca 0.18 0.04 0.06 0.00 -1.45 0.00 0.00 58.65 57.48 3fgc h GLN 95 Cb 0.31 0.13 -0.06 0.00 -0.05 0.00 0.00 27.48 27.81 3fgc h GLN 95 CO -0.40 -0.26 0.43 0.52 -0.95 0.00 0.00 178.83 178.18 3fgc h MET 96 N -0.88 0.77 -0.00 1.46 2.86 -1.06 -2.36 114.93 115.72 3fgc h MET 96 Ca -0.06 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.53 3fgc h MET 96 Cb 0.56 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.05 3fgc h MET 96 CO 0.10 0.51 -0.17 -1.13 1.06 0.00 0.00 176.91 177.28 3fgc n SER 97 N -4.72 0.62 -3.47 1.22 3.41 -0.38 -4.94 113.62 105.36 3fgc n SER 97 Ca 0.10 -0.62 -0.19 0.00 -0.26 0.00 0.00 58.87 57.90 3fgc n SER 97 Cb 0.17 -0.01 0.06 0.00 -0.26 0.00 0.00 64.21 64.17 3fgc n SER 97 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3fgc n LYS 98 N -0.90 -4.33 -0.52 4.33 5.02 -0.74 -3.67 118.16 117.35 3fgc n LYS 98 Ca 0.13 0.75 0.00 0.00 -2.02 0.00 0.00 58.31 57.18 3fgc n LYS 98 Cb 0.30 -5.50 0.00 0.00 -0.02 0.00 0.00 35.03 29.82 3fgc n LYS 98 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3fgc n GLY 99 N -1.33 0.74 1.05 0.72 0.00 -0.08 -4.95 105.19 101.33 3fgc n GLY 99 Ca -0.21 -0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.91 3fgc n GLY 99 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3fgc n ARG 100 N -2.52 2.35 -3.29 1.61 1.74 -1.24 -4.92 116.66 110.39 3fgc n ARG 100 Ca 0.00 -2.06 -0.38 0.00 -0.77 0.00 0.00 57.85 54.63 3fgc n ARG 100 Cb 0.00 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 29.90 3fgc n ARG 100 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3fgc s PHE 101 N -1.40 3.64 -0.17 -1.55 5.36 -1.26 -1.39 117.98 121.21 3fgc s PHE 101 Ca 0.39 1.07 0.01 0.00 -0.96 0.00 0.00 56.93 57.44 3fgc s PHE 101 Cb 0.21 -2.53 0.01 0.00 -0.34 0.00 0.00 43.02 40.37 3fgc s PHE 101 CO 0.29 0.35 -0.18 1.03 -1.46 0.00 0.00 175.22 175.26 3fgc s ARG 102 N -0.12 3.08 -1.05 10.12 1.81 -0.06 -4.23 118.95 128.50 3fgc s ARG 102 Ca 0.28 -0.80 -0.12 0.00 -1.72 0.00 0.00 55.73 53.38 3fgc s ARG 102 Cb -0.17 -2.60 0.24 0.00 -0.45 0.00 0.00 34.95 31.97 3fgc s ARG 102 CO 0.14 -0.12 1.08 0.12 -0.68 0.00 0.00 175.30 175.84 3fgc s PHE 103 N 1.12 3.98 0.09 -0.53 5.36 0.45 -1.33 117.98 127.12 3fgc s PHE 103 Ca 0.00 -2.37 -0.28 0.00 -0.96 0.00 0.00 56.93 53.32 3fgc s PHE 103 Cb -0.14 -3.93 -0.06 0.00 -0.34 0.00 0.00 43.02 38.55 3fgc s PHE 103 CO -0.07 -1.06 0.88 0.20 -1.46 0.00 0.00 175.22 173.72 3fgc s GLY 104 N 1.87 2.93 0.04 13.12 0.00 -0.91 -1.22 107.32 123.16 3fgc s GLY 104 Ca 0.29 0.46 0.05 0.00 0.00 0.00 0.00 44.72 45.52 3fgc s GLY 104 CO -0.07 1.29 -0.13 -0.26 0.00 0.00 0.00 173.10 173.93 3fgc s ILE 105 N -0.12 1.03 0.21 0.90 -4.36 0.03 -1.15 121.20 117.75 3fgc s ILE 105 Ca 0.43 -1.04 -0.03 0.00 -0.26 0.00 0.00 60.65 59.76 3fgc s ILE 105 Cb -0.22 -0.95 -0.03 0.00 1.25 0.00 0.00 42.46 42.50 3fgc s ILE 105 CO 0.27 -0.07 0.19 0.00 0.24 0.00 0.00 174.94 175.57 3fgc h ARG 107 N 2.54 0.00 0.00 0.00 3.08 -1.86 -1.86 114.38 116.29 3fgc h ARG 107 Ca -0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.71 3fgc h ARG 107 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 3fgc h ARG 107 CO 0.49 0.36 0.00 0.41 -1.07 0.00 0.00 179.97 180.17 3fgc n GLY 108 N 0.75 2.33 0.08 0.04 0.00 -1.26 -4.57 105.19 102.56 3fgc n GLY 108 Ca 0.01 -1.44 0.05 0.00 0.00 0.00 0.00 46.02 44.64 3fgc n GLY 108 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3fgc n LEU 109 N 0.00 0.57 -4.15 0.99 7.94 -1.26 -4.94 117.00 116.14 3fgc n LEU 109 Ca 0.00 0.23 -0.32 0.00 -1.11 0.00 0.00 56.01 54.81 3fgc n LEU 109 Cb 0.00 0.06 -0.16 0.00 0.53 0.00 0.00 43.42 43.84 3fgc n LEU 109 CO 0.00 0.04 -0.54 -0.31 -1.11 0.00 0.00 177.39 175.47 3fgc s TYR 110 N -3.16 2.66 0.59 1.96 2.02 -1.26 -4.98 117.35 115.17 3fgc s TYR 110 Ca -0.04 -1.39 0.28 0.00 -0.37 0.00 0.00 57.07 55.55 3fgc s TYR 110 Cb 0.10 -1.82 1.68 0.00 -0.40 0.00 0.00 41.96 41.51 3fgc s TYR 110 CO 0.83 -0.65 2.13 0.22 -1.57 0.00 0.00 175.55 176.51 3fgc h ASP 111 N 7.46 0.00 -0.27 2.29 3.58 -1.92 -2.48 116.42 125.08 3fgc h ASP 111 Ca -0.35 0.00 -0.02 0.00 0.42 0.00 0.00 57.03 57.08 3fgc h ASP 111 Cb 1.18 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 42.21 3fgc h ASP 111 CO 0.57 0.00 0.11 0.07 -2.88 0.00 0.00 179.24 177.11 3fgc h LYS 112 N 0.00 0.47 -0.32 0.28 2.10 -1.93 0.21 116.57 117.38 3fgc h LYS 112 Ca 0.07 -0.06 -0.05 0.00 -2.00 0.00 0.00 60.65 58.61 3fgc h LYS 112 Cb 0.39 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 31.61 3fgc h LYS 112 CO -0.00 0.41 0.02 -0.44 -2.00 0.00 0.00 179.45 177.44 3fgc h ASP 113 N 0.47 0.54 -0.44 7.07 5.19 -1.83 -1.12 116.42 126.30 3fgc h ASP 113 Ca 0.12 -0.29 -0.06 0.00 -0.62 0.00 0.00 57.03 56.17 3fgc h ASP 113 Cb 0.13 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.48 3fgc h ASP 113 CO -0.01 0.70 0.03 -0.26 -3.12 0.00 0.00 179.24 176.58 3fgc h PHE 114 N 0.37 0.83 -0.23 4.55 -1.00 -1.37 -1.12 116.94 118.97 3fgc h PHE 114 Ca 0.09 -0.13 0.06 0.00 2.81 0.00 0.00 57.97 60.80 3fgc h PHE 114 Cb 0.41 -0.22 -0.06 0.00 3.61 0.00 0.00 35.95 39.69 3fgc h PHE 114 CO 0.03 0.80 -0.18 -0.09 -1.61 0.00 0.00 178.31 177.26 3fgc h ARG 115 N 0.62 -0.18 -0.00 1.51 9.65 -0.48 0.26 114.38 125.76 3fgc h ARG 115 Ca 0.13 0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.02 3fgc h ARG 115 Cb 0.46 0.04 0.00 0.00 -1.39 0.00 0.00 29.97 29.08 3fgc h ARG 115 CO 0.02 -0.12 -0.00 0.28 2.80 0.00 0.00 179.97 182.95 3fgc h VAL 116 N -0.18 1.58 0.00 0.20 2.07 -1.10 -3.20 116.25 115.61 3fgc h VAL 116 Ca 0.13 -1.71 0.00 0.00 0.82 0.00 0.00 66.70 65.95 3fgc h VAL 116 Cb 0.38 2.74 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 3fgc h VAL 116 CO -0.34 0.44 0.00 0.49 0.02 0.00 0.00 177.57 178.18 3fgc n PHE 117 N -4.74 0.00 -1.38 1.57 3.72 -0.43 -4.91 117.46 111.28 3fgc n PHE 117 Ca -0.09 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.31 3fgc n PHE 117 Cb 0.36 -0.50 0.00 0.00 -0.94 0.00 0.00 39.48 38.40 3fgc n PHE 117 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3fgc n GLY 118 N 0.64 0.63 3.41 1.37 0.00 0.69 -5.01 105.19 106.92 3fgc n GLY 118 Ca 0.05 -0.35 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 3fgc n GLY 118 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3fgc s THR 119 N -2.40 0.00 -0.38 2.61 -1.32 0.01 -4.68 115.64 109.48 3fgc s THR 119 Ca 0.00 -1.75 -0.12 0.00 -1.21 0.00 0.00 61.69 58.61 3fgc s THR 119 Cb 0.00 -2.58 0.02 0.00 -1.51 0.00 0.00 72.50 68.43 3fgc s THR 119 CO 0.00 0.00 0.23 -0.62 -2.21 0.00 0.00 174.62 172.02 3fgc s ASP 120 N -3.27 5.86 0.49 8.08 -1.08 -1.26 -4.19 116.67 121.30 3fgc s ASP 120 Ca 0.34 -0.91 0.17 0.00 -0.52 0.00 0.00 52.55 51.63 3fgc s ASP 120 Cb 0.01 -2.07 1.19 0.00 -1.46 0.00 0.00 42.92 40.59 3fgc s ASP 120 CO 0.22 -0.39 2.08 -0.03 0.52 0.00 0.00 175.17 177.57 3fgc h MET 121 N 8.49 0.00 0.00 4.34 1.85 -1.92 -0.87 114.93 126.82 3fgc h MET 121 Ca -0.27 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.82 3fgc h MET 121 Cb 1.11 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.14 3fgc h MET 121 CO 0.68 0.09 0.00 -0.25 -0.40 0.00 0.00 176.91 177.04 3fgc n ASP 122 N -4.35 0.56 -0.85 1.39 8.00 -1.26 -2.16 116.55 117.89 3fgc n ASP 122 Ca -0.03 0.70 0.07 0.00 0.71 0.00 0.00 54.79 56.24 3fgc n ASP 122 Cb 0.17 -0.79 0.21 0.00 -0.02 0.00 0.00 41.12 40.69 3fgc n ASP 122 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 3fgc n ASN 123 N -2.19 3.45 -0.14 -2.24 4.05 -0.34 -4.78 115.26 113.09 3fgc n ASN 123 Ca 0.00 -2.34 0.04 0.00 0.45 0.00 0.00 54.58 52.74 3fgc n ASN 123 Cb 0.13 -0.37 0.35 0.00 1.23 0.00 0.00 39.78 41.12 3fgc n ASN 123 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 177.26 174.98 3fgc h SER 124 N 2.28 0.65 -0.07 1.20 4.64 -1.44 -1.58 113.55 119.24 3fgc h SER 124 Ca 0.00 -0.01 -0.04 0.00 -0.47 0.00 0.00 61.79 61.27 3fgc h SER 124 Cb 1.03 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.97 3fgc h SER 124 CO 0.09 0.45 -0.12 -0.09 -0.87 0.00 0.00 176.83 176.28 3fgc h ARG 125 N 0.75 0.21 -0.32 4.77 2.43 -1.86 -0.03 114.38 120.33 3fgc h ARG 125 Ca 0.26 -0.13 -0.07 0.00 -0.81 0.00 0.00 59.98 59.23 3fgc h ARG 125 Cb 0.09 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 3fgc h ARG 125 CO -0.07 0.70 -0.10 0.00 -1.51 0.00 0.00 179.97 178.99 3fgc h ALA 126 N 0.50 1.24 -0.32 2.80 0.00 -1.85 -1.10 119.26 120.53 3fgc h ALA 126 Ca 0.00 -0.26 -0.12 0.00 0.00 0.00 0.00 54.91 54.53 3fgc h ALA 126 Cb 0.69 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 3fgc h ALA 126 CO 0.03 0.50 -0.27 -0.07 0.00 0.00 0.00 179.25 179.44 3fgc h LEU 127 N 0.49 0.79 -0.41 0.00 3.38 -1.20 -0.16 115.31 118.21 3fgc h LEU 127 Ca 0.09 -0.45 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 3fgc h LEU 127 Cb 0.48 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3fgc h LEU 127 CO 0.03 1.08 0.14 -0.03 0.09 0.00 0.00 178.44 179.74 3fgc h MET 128 N 0.51 0.63 -0.54 1.13 4.05 -0.88 0.11 114.93 119.95 3fgc h MET 128 Ca 0.06 -0.13 0.02 0.00 -0.28 0.00 0.00 59.70 59.37 3fgc h MET 128 Cb 0.83 -0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 31.50 3fgc h MET 128 CO 0.07 0.62 0.32 0.22 0.23 0.00 0.00 176.91 178.37 3fgc h ASP 129 N 0.51 0.52 -0.05 1.39 3.58 -1.14 -1.33 116.42 119.91 3fgc h ASP 129 Ca 0.13 0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.47 3fgc h ASP 129 Cb 0.24 -0.11 0.01 0.00 1.72 0.00 0.00 39.33 41.19 3fgc h ASP 129 CO -0.01 0.37 -0.42 0.00 -2.88 0.00 0.00 179.24 176.31 3fgc h TRP 131 N -0.15 0.67 -0.01 0.00 -0.00 -0.82 -1.88 115.95 113.77 3fgc h TRP 131 Ca -0.04 0.03 0.03 0.00 -0.00 0.00 0.00 58.89 58.91 3fgc h TRP 131 Cb 1.10 -0.20 -0.04 0.00 -0.00 0.00 0.00 29.16 30.01 3fgc h TRP 131 CO 0.14 0.31 -0.21 -0.92 -0.00 0.00 0.00 178.44 177.77 3fgc h TYR 132 N 0.67 -0.54 -0.37 0.49 3.20 -1.21 -0.04 116.97 119.17 3fgc h TYR 132 Ca 0.31 0.02 0.06 0.00 3.14 0.00 0.00 58.73 62.26 3fgc h TYR 132 Cb 0.21 0.24 -0.05 0.00 1.54 0.00 0.00 36.73 38.67 3fgc h TYR 132 CO -0.08 -0.29 0.04 -0.44 -1.64 0.00 0.00 178.16 175.75 3fgc h ASP 133 N -0.33 -0.06 -0.53 -2.11 3.32 -1.19 0.14 116.42 115.66 3fgc h ASP 133 Ca 0.06 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3fgc h ASP 133 Cb 0.41 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 3fgc h ASP 133 CO -0.20 0.00 0.34 -0.07 -1.72 0.00 0.00 179.24 177.59 3fgc h LEU 134 N 0.15 0.62 -0.31 1.55 3.38 -1.17 0.65 115.31 120.18 3fgc h LEU 134 Ca 0.18 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 3fgc h LEU 134 Cb 0.23 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3fgc h LEU 134 CO -0.26 0.47 0.15 0.24 0.09 0.00 0.00 178.44 179.13 3fgc h MET 135 N 0.71 0.45 -0.21 1.13 2.86 -0.68 -1.48 114.93 117.71 3fgc h MET 135 Ca 0.19 -0.07 -0.11 0.00 -2.06 0.00 0.00 59.70 57.66 3fgc h MET 135 Cb -0.05 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.52 3fgc h MET 135 CO -0.04 0.42 -0.33 -0.22 1.06 0.00 0.00 176.91 177.80 3fgc h LYS 136 N 0.36 0.44 -0.55 1.72 1.63 -0.81 0.14 116.57 119.51 3fgc h LYS 136 Ca 0.11 -0.19 0.00 0.00 -0.85 0.00 0.00 60.65 59.72 3fgc h LYS 136 Cb 0.13 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.72 3fgc h LYS 136 CO -0.01 0.73 0.36 1.49 -3.45 0.00 0.00 179.45 178.56 3fgc h GLU 137 N 0.38 0.73 -0.23 1.90 4.81 -0.68 -0.22 114.58 121.26 3fgc h GLU 137 Ca 0.05 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 3fgc h GLU 137 Cb 0.77 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.98 3fgc h GLU 137 CO 0.06 0.49 0.11 0.78 -0.73 0.00 0.00 179.01 179.72 3fgc h GLY 138 N 0.74 0.36 0.55 1.92 0.00 -0.41 0.49 103.07 106.72 3fgc h GLY 138 Ca 0.20 -0.18 0.07 0.00 0.00 0.00 0.00 47.33 47.43 3fgc h GLY 138 CO -0.04 0.17 0.30 0.74 0.00 0.00 0.00 176.54 177.70 3fgc h PHE 139 N 0.24 0.54 -0.05 5.60 0.04 -0.61 -0.20 116.94 122.50 3fgc h PHE 139 Ca 0.08 0.03 -0.09 0.00 2.80 0.00 0.00 57.97 60.79 3fgc h PHE 139 Cb 0.12 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.13 3fgc h PHE 139 CO -0.02 0.21 -0.31 -0.91 -0.60 0.00 0.00 178.31 176.67 3fgc h ASN 140 N 0.54 0.36 0.00 2.17 -0.26 -0.97 -3.40 115.58 114.02 3fgc h ASN 140 Ca 0.30 -0.68 -0.11 0.00 -0.56 0.00 0.00 56.30 55.25 3fgc h ASN 140 Cb 0.28 -0.11 -0.02 0.00 -1.06 0.00 0.00 38.32 37.41 3fgc h ASN 140 CO -0.23 0.98 -1.85 -0.62 -1.06 0.00 0.00 177.43 174.64 3fgc n GLU 141 N -4.44 0.92 -0.23 0.81 -0.58 0.15 -4.95 120.64 112.34 3fgc n GLU 141 Ca -0.09 -0.09 0.00 0.00 -0.42 0.00 0.00 57.16 56.56 3fgc n GLU 141 Cb 0.51 -1.38 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 3fgc n GLU 141 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3fgc n GLY 142 N 1.79 0.77 3.29 0.62 0.00 -0.09 -5.02 105.19 106.55 3fgc n GLY 142 Ca -0.12 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.77 3fgc n GLY 142 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fgc s TYR 143 N -2.19 -0.24 -0.00 1.61 1.51 -1.25 -1.27 117.35 115.51 3fgc s TYR 143 Ca 0.00 0.33 0.00 0.00 -1.01 0.00 0.00 57.07 56.39 3fgc s TYR 143 Cb 0.00 0.16 -0.00 0.00 -0.11 0.00 0.00 41.96 42.00 3fgc s TYR 143 CO 0.00 -0.46 -0.01 0.42 -1.11 0.00 0.00 175.55 174.39 3fgc s ILE 144 N -1.67 0.07 0.02 2.71 1.01 -0.69 -3.30 121.20 119.36 3fgc s ILE 144 Ca -0.11 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.49 3fgc s ILE 144 Cb -0.03 -0.07 -0.02 0.00 0.01 0.00 0.00 42.46 42.35 3fgc s ILE 144 CO 0.03 0.01 -0.03 0.00 0.00 0.00 0.00 174.94 174.95 3fgc s ALA 145 N -0.05 0.13 -0.02 9.38 0.00 -1.26 -0.88 121.76 129.06 3fgc s ALA 145 Ca 0.00 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.48 3fgc s ALA 145 Cb -0.01 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.23 3fgc s ALA 145 CO -0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 175.76 175.57 3fgc s ALA 146 N -1.19 0.71 -0.40 0.00 0.00 -0.81 -4.96 121.76 115.10 3fgc s ALA 146 Ca -0.13 -0.24 0.10 0.00 0.00 0.00 0.00 51.96 51.69 3fgc s ALA 146 Cb -0.08 -0.29 0.32 0.00 0.00 0.00 0.00 23.12 23.07 3fgc s ALA 146 CO -0.01 0.10 0.82 -3.47 0.00 0.00 0.00 175.76 173.20 3fgc n ASP 147 N 3.38 -0.30 -4.20 0.00 2.03 -1.25 -1.00 116.55 115.20 3fgc n ASP 147 Ca -0.19 -3.17 -0.27 0.00 0.52 0.00 0.00 54.79 51.69 3fgc n ASP 147 Cb 0.54 0.19 -0.08 0.00 -0.72 0.00 0.00 41.12 41.05 3fgc n ASP 147 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 3fgc s ASN 148 N -1.93 2.98 0.45 1.67 2.20 -0.76 -5.03 114.94 114.52 3fgc s ASN 148 Ca 0.34 -1.67 0.22 0.00 -0.94 0.00 0.00 52.86 50.81 3fgc s ASN 148 Cb 0.31 0.51 1.21 0.00 -2.00 0.00 0.00 41.25 41.27 3fgc s ASN 148 CO -0.09 -0.92 1.84 -0.08 -2.94 0.00 0.00 177.10 174.91 3fgc h GLU 149 N 1.73 0.28 0.00 3.55 4.81 -2.00 -3.19 114.58 119.76 3fgc h GLU 149 Ca -0.36 -0.02 -0.33 0.00 -0.13 0.00 0.00 59.36 58.52 3fgc h GLU 149 Cb 1.28 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 30.53 3fgc h GLU 149 CO 0.59 0.18 -2.09 0.72 -0.73 0.00 0.00 179.01 177.68 3fgc n HIS 150 N -4.46 0.42 -3.54 0.92 -0.00 -1.26 -4.64 115.22 102.67 3fgc n HIS 150 Ca 0.21 0.15 -0.14 0.00 -0.00 0.00 0.00 57.72 57.94 3fgc n HIS 150 Cb 0.84 -1.07 -0.05 0.00 -0.00 0.00 0.00 29.99 29.70 3fgc n HIS 150 CO 0.00 0.00 0.00 -1.50 -0.00 0.00 0.00 176.34 174.84 3fgc s ILE 151 N -2.55 0.00 -0.09 1.59 2.07 -1.20 -3.29 121.20 117.72 3fgc s ILE 151 Ca -0.08 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.09 3fgc s ILE 151 Cb 0.07 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.69 3fgc s ILE 151 CO 0.83 0.00 0.24 -0.54 -1.91 0.00 0.00 174.94 173.56 3fgc s LYS 152 N -1.39 0.24 0.01 3.50 1.02 -1.26 -1.83 119.74 120.03 3fgc s LYS 152 Ca -0.06 0.41 -0.28 0.00 0.02 0.00 0.00 55.97 56.06 3fgc s LYS 152 Cb -0.00 0.03 0.08 0.00 -0.52 0.00 0.00 37.83 37.42 3fgc s LYS 152 CO 0.04 -0.08 0.71 -0.59 -0.92 0.00 0.00 175.35 174.51 3fgc s PHE 153 N 0.58 -0.55 0.80 3.18 -0.12 -0.17 -4.95 117.98 116.75 3fgc s PHE 153 Ca -0.04 0.70 -0.11 0.00 -0.05 0.00 0.00 56.93 57.43 3fgc s PHE 153 Cb -0.05 0.48 0.07 0.00 -0.63 0.00 0.00 43.02 42.89 3fgc s PHE 153 CO -0.03 -0.65 1.09 -1.25 -0.05 0.00 0.00 175.22 174.32 3fgc s PRO 154 N -2.26 2.06 0.29 1.99 0.04 -1.26 -1.93 135.00 133.92 3fgc s PRO 154 Ca -0.04 0.80 -0.30 0.00 0.04 0.00 0.00 61.00 61.50 3fgc s PRO 154 Cb -0.00 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 32.52 3fgc s PRO 154 CO -0.01 -1.68 1.55 0.21 0.04 0.00 0.00 177.00 177.11 3fgc s LYS 155 N -5.05 4.16 0.05 4.56 2.20 -1.26 -4.65 119.74 119.75 3fgc s LYS 155 Ca 0.61 2.51 0.06 0.00 -0.36 0.00 0.00 55.97 58.79 3fgc s LYS 155 Cb -0.15 -3.04 -0.03 0.00 -1.51 0.00 0.00 37.83 33.10 3fgc s LYS 155 CO 0.55 -0.57 -0.16 0.96 -0.36 0.00 0.00 175.35 175.77 3fgc s ILE 156 N -0.09 1.29 0.03 5.43 -5.25 -0.06 -4.99 121.20 117.57 3fgc s ILE 156 Ca 0.61 -1.16 -0.30 0.00 -0.99 0.00 0.00 60.65 58.81 3fgc s ILE 156 Cb -0.46 -1.17 -0.07 0.00 2.95 0.00 0.00 42.46 43.70 3fgc s ILE 156 CO 0.48 -0.01 1.64 -1.58 -1.79 0.00 0.00 174.94 173.68 3fgc s GLN 157 N -1.36 4.20 -0.24 0.37 0.74 -1.26 -1.70 119.66 120.42 3fgc s GLN 157 Ca 0.03 2.27 -0.19 0.00 0.05 0.00 0.00 55.36 57.52 3fgc s GLN 157 Cb -0.09 -3.71 -0.03 0.00 1.10 0.00 0.00 33.01 30.29 3fgc s GLN 157 CO 0.02 -0.75 0.55 -1.17 -0.55 0.00 0.00 175.29 173.39 3fgc s LEU 158 N 3.00 4.08 0.08 3.68 2.96 -0.40 -4.95 118.68 127.14 3fgc s LEU 158 Ca 0.73 0.62 0.05 0.00 -0.22 0.00 0.00 54.13 55.31 3fgc s LEU 158 Cb -0.37 -2.74 -0.04 0.00 0.50 0.00 0.00 46.19 43.54 3fgc s LEU 158 CO 0.31 -0.28 -0.02 0.20 -1.32 0.00 0.00 176.35 175.24 3fgc s ASN 159 N 1.42 4.89 1.00 3.68 0.01 -1.26 -4.41 114.94 120.26 3fgc s ASN 159 Ca 0.24 -0.20 -0.14 0.00 -0.71 0.00 0.00 52.86 52.04 3fgc s ASN 159 Cb -0.16 -1.13 0.19 0.00 0.41 0.00 0.00 41.25 40.57 3fgc s ASN 159 CO 0.09 0.19 1.15 -0.81 -1.51 0.00 0.00 177.10 176.21 3fgc n PRO 160 N 0.70 -1.11 -1.52 -0.60 -0.04 -1.26 -4.53 135.00 126.64 3fgc n PRO 160 Ca -0.12 -1.78 -0.29 0.00 -0.04 0.00 0.00 63.50 61.27 3fgc n PRO 160 Cb 0.52 -1.18 0.12 0.00 -0.04 0.00 0.00 33.50 32.93 3fgc n PRO 160 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 3fgc s SER 161 N -5.19 3.83 0.09 3.54 1.04 -1.26 -4.84 113.70 110.91 3fgc s SER 161 Ca 0.65 1.12 -0.30 0.00 0.48 0.00 0.00 55.95 57.90 3fgc s SER 161 Cb -0.02 -1.76 -0.06 0.00 0.10 0.00 0.00 66.02 64.29 3fgc s SER 161 CO 0.46 -2.36 1.06 0.00 0.98 0.00 0.00 173.24 173.37 3fgc s ALA 162 N -3.21 3.29 0.09 5.32 0.00 -1.26 -4.79 121.76 121.20 3fgc s ALA 162 Ca 0.63 0.70 -0.19 0.00 0.00 0.00 0.00 51.96 53.10 3fgc s ALA 162 Cb -0.15 -3.35 -0.07 0.00 0.00 0.00 0.00 23.12 19.54 3fgc s ALA 162 CO 0.54 -0.22 1.59 -0.92 0.00 0.00 0.00 175.76 176.75 3fgc h TYR 163 N 6.04 0.41 -3.29 0.00 3.20 -1.83 -3.43 116.97 118.06 3fgc h TYR 163 Ca -0.42 -0.05 -0.58 0.00 3.14 0.00 0.00 58.73 60.82 3fgc h TYR 163 Cb 1.21 -0.12 -0.07 0.00 1.54 0.00 0.00 36.73 39.30 3fgc h TYR 163 CO 0.65 0.47 -0.10 0.99 -1.64 0.00 0.00 178.16 178.54 3fgc s THR 164 N -5.32 5.10 0.15 1.81 2.01 -1.26 -4.98 115.64 113.14 3fgc s THR 164 Ca -0.14 1.04 -0.33 0.00 0.31 0.00 0.00 61.69 62.58 3fgc s THR 164 Cb 0.08 -3.85 -0.12 0.00 0.01 0.00 0.00 72.50 68.62 3fgc s THR 164 CO 0.73 0.37 1.72 1.67 -0.69 0.00 0.00 174.62 178.42 3fgc n GLN 165 N 3.24 2.56 -0.98 4.92 0.00 -1.26 -0.80 117.38 125.06 3fgc n GLN 165 Ca -0.07 0.93 0.00 0.00 -0.00 0.00 0.00 57.00 57.85 3fgc n GLN 165 Cb 0.52 -2.76 0.00 0.00 0.00 0.00 0.00 30.24 27.99 3fgc n GLN 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3fgc n GLY 166 N 3.90 0.53 0.00 1.69 0.00 -1.26 -4.84 105.19 105.21 3fgc n GLY 166 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 3fgc n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3fgc n GLY 167 N -2.21 -0.14 3.73 -0.02 0.00 0.02 -4.71 105.19 101.88 3fgc n GLY 167 Ca 0.00 -1.79 -0.40 0.00 0.00 0.00 0.00 46.02 43.83 3fgc n GLY 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3fgc n ALA 168 N 0.02 1.66 -1.69 4.61 0.00 -1.26 -4.72 120.51 119.12 3fgc n ALA 168 Ca 0.00 0.22 -0.44 0.00 0.00 0.00 0.00 53.44 53.22 3fgc n ALA 168 Cb 0.00 -2.34 -0.04 0.00 0.00 0.00 0.00 19.45 17.08 3fgc n ALA 168 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3fgc n PRO 169 N -0.33 2.56 -3.47 0.00 -0.04 -1.26 -4.69 135.00 127.77 3fgc n PRO 169 Ca 0.07 0.93 -0.38 0.00 -0.04 0.00 0.00 63.50 64.08 3fgc n PRO 169 Cb 0.42 -2.78 -0.06 0.00 -0.04 0.00 0.00 33.50 31.04 3fgc n PRO 169 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3fgc s VAL 170 N 2.03 5.01 0.07 0.52 1.01 -1.26 -0.41 120.40 127.37 3fgc s VAL 170 Ca 0.81 0.88 0.07 0.00 0.00 0.00 0.00 61.98 63.74 3fgc s VAL 170 Cb -0.56 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.06 3fgc s VAL 170 CO 0.38 0.56 -0.19 -0.31 0.00 0.00 0.00 175.10 175.54 3fgc s TYR 171 N -0.98 1.63 -0.18 5.22 1.51 -0.36 -4.15 117.35 120.04 3fgc s TYR 171 Ca 0.24 -0.40 0.01 0.00 -1.01 0.00 0.00 57.07 55.91 3fgc s TYR 171 Cb -0.17 -0.93 0.02 0.00 -0.11 0.00 0.00 41.96 40.77 3fgc s TYR 171 CO 0.14 0.12 -0.19 0.08 -1.11 0.00 0.00 175.55 174.58 3fgc s VAL 172 N -1.01 2.13 -0.21 0.71 1.01 0.21 -0.78 120.40 122.46 3fgc s VAL 172 Ca 0.05 -0.92 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 3fgc s VAL 172 Cb -0.09 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 3fgc s VAL 172 CO 0.03 0.53 1.46 -0.69 0.00 0.00 0.00 175.10 176.43 3fgc s VAL 173 N 1.25 3.93 -0.01 2.92 1.01 -0.54 -1.67 120.40 127.28 3fgc s VAL 173 Ca 0.04 1.07 0.00 0.00 0.00 0.00 0.00 61.98 63.09 3fgc s VAL 173 Cb -0.13 -3.86 0.01 0.00 0.00 0.00 0.00 36.38 32.39 3fgc s VAL 173 CO -0.11 -0.29 0.00 0.00 0.00 0.00 0.00 175.10 174.70 3fgc s ALA 174 N 4.48 0.14 0.00 5.51 0.00 -1.24 -4.75 121.76 125.90 3fgc s ALA 174 Ca 0.64 0.08 0.00 0.00 0.00 0.00 0.00 51.96 52.68 3fgc s ALA 174 Cb -0.23 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 22.75 3fgc s ALA 174 CO 0.25 -0.03 0.36 -0.85 0.00 0.00 0.00 175.76 175.49 3fgc n GLU 175 N 3.54 0.00 -4.43 0.00 -0.00 -1.26 -4.53 120.64 113.95 3fgc n GLU 175 Ca -0.19 -0.00 -0.25 0.00 -0.00 0.00 0.00 57.16 56.72 3fgc n GLU 175 Cb 0.55 -0.00 -0.11 0.00 -0.00 0.00 0.00 31.44 31.89 3fgc n GLU 175 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.13 175.59 3fgc s SER 176 N -0.00 3.39 0.33 -1.84 1.04 -1.26 -5.04 113.70 110.32 3fgc s SER 176 Ca 0.00 -0.95 0.01 0.00 0.48 0.00 0.00 55.95 55.48 3fgc s SER 176 Cb 0.00 -0.26 0.56 0.00 0.10 0.00 0.00 66.02 66.42 3fgc s SER 176 CO 0.00 0.05 1.98 0.00 0.98 0.00 0.00 173.24 176.25 3fgc h ALA 177 N 2.73 1.48 -0.02 5.32 0.00 -1.99 -1.36 119.26 125.41 3fgc h ALA 177 Ca -0.42 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.32 3fgc h ALA 177 Cb 1.23 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.74 3fgc h ALA 177 CO 0.55 0.47 -0.45 0.66 0.00 0.00 0.00 179.25 180.48 3fgc h SER 178 N 0.92 0.04 0.71 0.00 4.64 -1.99 -2.00 113.55 115.87 3fgc h SER 178 Ca 0.25 -0.02 -0.26 0.00 -0.47 0.00 0.00 61.79 61.29 3fgc h SER 178 Cb -0.07 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.00 3fgc h SER 178 CO -0.05 0.49 -1.25 0.74 -0.87 0.00 0.00 176.83 175.89 3fgc h THR 179 N 0.03 1.46 -0.14 2.95 2.02 -1.78 -1.94 112.91 115.52 3fgc h THR 179 Ca -0.00 -3.11 0.03 0.00 0.77 0.00 0.00 66.41 64.11 3fgc h THR 179 Cb 0.81 2.84 -0.03 0.00 -1.74 0.00 0.00 68.15 70.03 3fgc h THR 179 CO 0.06 0.88 -0.06 0.74 0.37 0.00 0.00 175.52 177.51 3fgc h THR 180 N 0.04 0.79 -0.48 3.16 2.02 -1.16 -0.53 112.91 116.75 3fgc h THR 180 Ca -0.13 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.02 3fgc h THR 180 Cb 1.92 0.79 -0.02 0.00 -1.74 0.00 0.00 68.15 69.10 3fgc h THR 180 CO 0.16 0.00 0.16 -0.33 0.37 0.00 0.00 175.52 175.88 3fgc h GLU 181 N -0.05 0.74 -0.24 6.66 5.08 -1.40 0.19 114.58 125.57 3fgc h GLU 181 Ca 0.08 -0.15 0.05 0.00 -1.00 0.00 0.00 59.36 58.33 3fgc h GLU 181 Cb 0.16 -0.11 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 3fgc h GLU 181 CO -0.17 0.69 -0.05 2.35 -1.00 0.00 0.00 179.01 180.82 3fgc h TRP 182 N 0.64 -0.11 -0.46 4.33 7.01 -1.11 0.60 115.95 126.84 3fgc h TRP 182 Ca 0.16 0.02 -0.02 0.00 2.11 0.00 0.00 58.89 61.16 3fgc h TRP 182 Cb 0.25 0.09 -0.02 0.00 -2.10 0.00 0.00 29.16 27.38 3fgc h TRP 182 CO 0.01 -0.10 0.22 0.00 -2.79 0.00 0.00 178.44 175.79 3fgc h ALA 183 N 1.24 0.59 -0.80 2.65 0.00 -0.87 -3.04 119.26 119.04 3fgc h ALA 183 Ca 0.12 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3fgc h ALA 183 Cb 0.17 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.74 3fgc h ALA 183 CO -0.24 0.15 0.52 0.00 0.00 0.00 0.00 179.25 179.68 3fgc h ALA 184 N 1.07 1.03 0.00 0.00 0.00 -0.16 -0.85 119.26 120.35 3fgc h ALA 184 Ca 0.16 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3fgc h ALA 184 Cb 0.11 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.60 3fgc h ALA 184 CO -0.02 0.38 0.01 0.93 0.00 0.00 0.00 179.25 180.55 3fgc h GLU 185 N 1.05 0.00 -0.01 0.00 5.08 -0.77 -0.84 114.58 119.08 3fgc h GLU 185 Ca 0.30 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.66 3fgc h GLU 185 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 3fgc h GLU 185 CO -0.08 0.00 -0.34 0.54 -1.00 0.00 0.00 179.01 178.13 3fgc n ARG 186 N -3.01 1.82 -1.17 2.33 1.74 -0.79 -4.98 116.66 112.59 3fgc n ARG 186 Ca -0.03 -0.70 -0.06 0.00 -0.77 0.00 0.00 57.85 56.30 3fgc n ARG 186 Cb 0.07 -1.23 -0.02 0.00 -1.02 0.00 0.00 32.46 30.26 3fgc n ARG 186 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3fgc n GLY 187 N 1.11 0.83 3.83 -0.13 0.00 -0.32 -5.00 105.19 105.51 3fgc n GLY 187 Ca 0.06 -0.75 -0.38 0.00 0.00 0.00 0.00 46.02 44.95 3fgc n GLY 187 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3fgc s LEU 188 N -1.32 4.43 0.50 0.99 1.43 -0.44 -4.97 118.68 119.29 3fgc s LEU 188 Ca 0.00 0.82 -0.22 0.00 -1.03 0.00 0.00 54.13 53.70 3fgc s LEU 188 Cb 0.00 -2.47 -0.06 0.00 0.03 0.00 0.00 46.19 43.69 3fgc s LEU 188 CO 0.00 0.31 1.25 -2.16 0.23 0.00 0.00 176.35 175.98 3fgc s PRO 189 N -0.88 3.49 0.19 1.29 0.04 -1.26 -4.55 135.00 133.33 3fgc s PRO 189 Ca 0.21 1.98 0.06 0.00 0.04 0.00 0.00 61.00 63.29 3fgc s PRO 189 Cb -0.15 -2.34 -0.04 0.00 0.04 0.00 0.00 34.50 32.00 3fgc s PRO 189 CO 0.11 -0.83 0.16 -1.64 0.04 0.00 0.00 177.00 174.84 3fgc s MET 190 N -2.78 2.92 -0.23 4.56 -1.94 -1.26 -0.62 119.30 119.95 3fgc s MET 190 Ca 0.67 -0.93 -0.03 0.00 -1.71 0.00 0.00 55.69 53.69 3fgc s MET 190 Cb -0.34 -2.63 0.00 0.00 2.01 0.00 0.00 34.83 33.88 3fgc s MET 190 CO 0.41 0.46 -0.04 0.42 -0.01 0.00 0.00 175.02 176.25 3fgc s ILE 191 N -1.88 3.27 0.27 2.53 1.01 -0.67 -0.46 121.20 125.26 3fgc s ILE 191 Ca 0.32 -0.64 -0.14 0.00 0.00 0.00 0.00 60.65 60.19 3fgc s ILE 191 Cb -0.09 -2.54 -0.08 0.00 0.01 0.00 0.00 42.46 39.76 3fgc s ILE 191 CO 0.24 0.35 0.66 -0.76 0.00 0.00 0.00 174.94 175.43 3fgc s LEU 192 N 1.44 4.15 0.52 2.97 1.43 0.49 -3.67 118.68 126.01 3fgc s LEU 192 Ca 0.04 1.17 -0.21 0.00 -1.03 0.00 0.00 54.13 54.11 3fgc s LEU 192 Cb -0.15 -3.84 -0.06 0.00 0.03 0.00 0.00 46.19 42.17 3fgc s LEU 192 CO -0.03 -0.12 1.16 -0.55 0.23 0.00 0.00 176.35 177.04 3fgc s SER 193 N -2.19 5.78 0.00 2.29 0.15 -1.26 -2.91 113.70 115.56 3fgc s SER 193 Ca 0.50 2.28 0.26 0.00 0.70 0.00 0.00 55.95 59.68 3fgc s SER 193 Cb -0.12 -2.59 0.58 0.00 -1.71 0.00 0.00 66.02 62.18 3fgc s SER 193 CO 0.19 -1.18 1.47 -2.67 1.20 0.00 0.00 173.24 172.25 3fgc n TRP 194 N -1.05 0.00 0.70 3.44 4.27 -1.25 -3.97 117.44 119.58 3fgc n TRP 194 Ca 0.10 0.00 0.12 0.00 -3.89 0.00 0.00 57.50 53.83 3fgc n TRP 194 Cb 0.49 -0.02 0.26 0.00 -1.36 0.00 0.00 31.31 30.69 3fgc n TRP 194 CO 0.00 0.00 0.00 0.44 -2.29 0.00 0.00 177.69 175.84 3fgc n ILE 195 N 0.39 0.35 -4.11 -1.67 -5.35 -1.26 -4.85 119.36 102.86 3fgc n ILE 195 Ca 0.15 -0.58 -0.22 0.00 -0.27 0.00 0.00 62.75 61.82 3fgc n ILE 195 Cb 0.45 0.83 -0.06 0.00 -1.74 0.00 0.00 39.64 39.12 3fgc n ILE 195 CO 0.00 0.00 0.00 0.27 -1.76 0.00 0.00 176.55 175.06 3fgc s ILE 196 N -1.65 3.54 0.63 7.28 -4.36 -1.25 -5.04 121.20 120.35 3fgc s ILE 196 Ca 0.36 -1.64 0.02 0.00 -0.26 0.00 0.00 60.65 59.13 3fgc s ILE 196 Cb 0.21 -3.07 0.09 0.00 1.25 0.00 0.00 42.46 40.94 3fgc s ILE 196 CO 0.30 -0.27 0.88 0.54 0.24 0.00 0.00 174.94 176.62 3fgc s ASN 197 N -3.82 4.78 0.27 4.36 2.20 -1.26 -4.86 114.94 116.62 3fgc s ASN 197 Ca 0.35 -0.40 -0.01 0.00 -0.94 0.00 0.00 52.86 51.87 3fgc s ASN 197 Cb -0.05 -0.17 0.52 0.00 -2.00 0.00 0.00 41.25 39.56 3fgc s ASN 197 CO 0.23 -1.53 1.80 0.74 -2.94 0.00 0.00 177.10 175.39 3fgc h THR 198 N -0.18 0.83 -0.31 0.54 2.02 -1.97 -0.30 112.91 113.54 3fgc h THR 198 Ca -0.36 -0.27 -0.04 0.00 0.77 0.00 0.00 66.41 66.50 3fgc h THR 198 Cb 1.28 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 3fgc h THR 198 CO 0.43 0.14 0.03 -0.74 0.37 0.00 0.00 175.52 175.75 3fgc h HIS 199 N 0.79 0.56 -0.91 3.16 -0.00 -1.99 -1.40 115.15 115.35 3fgc h HIS 199 Ca 0.47 -0.09 -0.01 0.00 -0.00 0.00 0.00 60.37 60.74 3fgc h HIS 199 Cb 0.56 -0.15 -0.04 0.00 -0.00 0.00 0.00 27.41 27.77 3fgc h HIS 199 CO -0.05 0.63 0.52 0.93 -0.00 0.00 0.00 177.93 179.97 3fgc h GLU 200 N 0.33 1.26 -0.35 5.26 5.08 -1.80 -2.07 114.58 122.30 3fgc h GLU 200 Ca 0.09 -0.13 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 3fgc h GLU 200 Cb 0.39 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 3fgc h GLU 200 CO 0.01 0.90 0.22 0.87 -1.00 0.00 0.00 179.01 180.01 3fgc h LYS 201 N 1.27 0.46 -0.58 2.33 1.57 -0.94 -1.33 116.57 119.35 3fgc h LYS 201 Ca 0.32 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.97 3fgc h LYS 201 Cb -0.01 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 3fgc h LYS 201 CO -0.06 0.33 -0.03 -0.22 -0.57 0.00 0.00 179.45 178.90 3fgc h LYS 202 N 0.46 1.04 -0.27 3.15 3.64 -1.15 -1.15 116.57 122.29 3fgc h LYS 202 Ca 0.13 -0.34 -0.11 0.00 -1.27 0.00 0.00 60.65 59.05 3fgc h LYS 202 Cb -0.02 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.69 3fgc h LYS 202 CO -0.03 1.04 -0.30 0.00 -2.27 0.00 0.00 179.45 177.89 3fgc h ALA 203 N 1.01 0.96 -0.39 5.00 0.00 -1.29 0.73 119.26 125.28 3fgc h ALA 203 Ca 0.16 -0.39 -0.13 0.00 0.00 0.00 0.00 54.91 54.56 3fgc h ALA 203 Cb 0.59 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3fgc h ALA 203 CO 0.03 0.61 -0.24 0.37 0.00 0.00 0.00 179.25 180.02 3fgc h GLN 204 N 0.49 0.86 -0.26 0.00 4.15 -1.09 -2.34 115.11 116.92 3fgc h GLN 204 Ca 0.06 -0.40 -0.02 0.00 0.77 0.00 0.00 58.65 59.06 3fgc h GLN 204 Cb 0.77 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.44 3fgc h GLN 204 CO 0.06 1.04 0.08 -0.07 -1.93 0.00 0.00 178.83 178.01 3fgc h LEU 205 N 0.67 0.38 -0.90 -2.39 -0.00 -0.96 -1.06 115.31 111.04 3fgc h LEU 205 Ca 0.08 -0.21 0.06 0.00 -0.00 0.00 0.00 57.88 57.81 3fgc h LEU 205 Cb 0.82 -0.10 -0.06 0.00 -0.00 0.00 0.00 40.66 41.31 3fgc h LEU 205 CO 0.07 0.49 0.57 0.44 -0.00 0.00 0.00 178.44 180.00 3fgc h ASP 206 N 0.25 0.91 0.24 -0.43 3.32 -0.84 0.32 116.42 120.19 3fgc h ASP 206 Ca 0.08 0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 3fgc h ASP 206 Cb 0.24 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.61 3fgc h ASP 206 CO -0.00 0.58 -0.13 0.25 -1.72 0.00 0.00 179.24 178.22 3fgc h LEU 207 N 1.05 -0.31 -0.21 1.55 5.85 -1.35 -2.54 115.31 119.36 3fgc h LEU 207 Ca 0.39 0.01 0.06 0.00 0.84 0.00 0.00 57.88 59.18 3fgc h LEU 207 Cb 0.15 0.08 -0.07 0.00 0.37 0.00 0.00 40.66 41.20 3fgc h LEU 207 CO -0.17 -0.21 -0.26 0.22 -0.34 0.00 0.00 178.44 177.68 3fgc h TYR 208 N -0.34 -0.69 -0.38 1.25 5.03 -0.42 -2.89 116.97 118.52 3fgc h TYR 208 Ca -0.03 0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.28 3fgc h TYR 208 Cb 0.27 0.33 -0.02 0.00 1.55 0.00 0.00 36.73 38.87 3fgc h TYR 208 CO -0.07 -0.33 0.08 -0.91 -1.32 0.00 0.00 178.16 175.61 3fgc h ASN 209 N -0.28 0.52 -0.04 -2.11 2.35 -0.29 0.48 115.58 116.20 3fgc h ASN 209 Ca 0.12 -0.08 0.04 0.00 -0.55 0.00 0.00 56.30 55.83 3fgc h ASN 209 Cb 0.47 -0.13 -0.05 0.00 0.05 0.00 0.00 38.32 38.66 3fgc h ASN 209 CO -0.37 0.53 -0.26 -0.33 -1.65 0.00 0.00 177.43 175.35 3fgc h GLU 210 N 0.55 -0.36 -0.26 0.81 5.08 -1.24 -0.06 114.58 119.10 3fgc h GLU 210 Ca 0.13 0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.45 3fgc h GLU 210 Cb 0.23 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.56 3fgc h GLU 210 CO -0.00 -0.24 -0.08 0.28 -1.00 0.00 0.00 179.01 177.97 3fgc h VAL 211 N -0.38 1.29 -0.35 3.13 2.07 -1.46 -2.75 116.25 117.80 3fgc h VAL 211 Ca 0.08 -1.10 0.00 0.00 0.82 0.00 0.00 66.70 66.49 3fgc h VAL 211 Cb 0.48 1.48 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 3fgc h VAL 211 CO -0.26 0.35 0.22 0.00 0.02 0.00 0.00 177.57 177.90 3fgc h ALA 212 N 0.76 0.45 -0.87 1.67 0.00 -0.84 -2.59 119.26 117.83 3fgc h ALA 212 Ca 0.06 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.02 3fgc h ALA 212 Cb 0.55 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.13 3fgc h ALA 212 CO 0.03 -0.07 0.53 1.15 0.00 0.00 0.00 179.25 180.88 3fgc h THR 213 N 0.47 0.98 -0.97 0.00 2.02 -1.07 -2.10 112.91 112.24 3fgc h THR 213 Ca 0.13 -0.32 0.06 0.00 0.77 0.00 0.00 66.41 67.05 3fgc h THR 213 Cb -0.03 -0.02 -0.06 0.00 -1.74 0.00 0.00 68.15 66.30 3fgc h THR 213 CO -0.03 0.17 0.63 -0.33 0.37 0.00 0.00 175.52 176.33 3fgc h GLU 214 N 0.93 1.11 0.00 6.66 5.08 -1.17 -1.36 114.58 125.83 3fgc h GLU 214 Ca 0.40 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 3fgc h GLU 214 Cb 0.27 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3fgc h GLU 214 CO -0.21 0.74 0.00 0.72 -1.00 0.00 0.00 179.01 179.26 3fgc n HIS 215 N -4.48 0.51 -0.19 4.33 8.25 -1.01 -4.92 115.22 117.71 3fgc n HIS 215 Ca 0.14 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.80 3fgc n HIS 215 Cb 0.17 -0.81 0.00 0.00 1.12 0.00 0.00 29.99 30.47 3fgc n HIS 215 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3fgc n GLY 216 N 0.14 0.75 3.77 -1.41 0.00 -0.51 -5.07 105.19 102.86 3fgc n GLY 216 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 3fgc n GLY 216 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3fgc s TYR 217 N -2.18 2.99 -0.62 1.61 2.02 -0.82 -4.98 117.35 115.36 3fgc s TYR 217 Ca 0.00 1.50 -0.28 0.00 -0.37 0.00 0.00 57.07 57.92 3fgc s TYR 217 Cb 0.00 -3.51 0.02 0.00 -0.40 0.00 0.00 41.96 38.07 3fgc s TYR 217 CO 0.00 -1.62 1.37 0.34 -1.57 0.00 0.00 175.55 174.07 3fgc s ASP 218 N -0.94 6.12 0.20 2.29 -1.08 -1.26 -4.28 116.67 117.71 3fgc s ASP 218 Ca 0.56 0.04 0.20 0.00 -0.52 0.00 0.00 52.55 52.83 3fgc s ASP 218 Cb -0.34 -2.55 0.87 0.00 -1.46 0.00 0.00 42.92 39.44 3fgc s ASP 218 CO 0.43 -1.77 1.62 1.33 0.52 0.00 0.00 175.17 177.30 3fgc n VAL 219 N 6.71 0.95 0.86 1.11 0.24 -1.26 -2.01 118.33 124.92 3fgc n VAL 219 Ca 0.10 0.31 0.12 0.00 -2.04 0.00 0.00 64.34 62.82 3fgc n VAL 219 Cb 0.49 -1.21 0.24 0.00 -1.47 0.00 0.00 33.84 31.89 3fgc n VAL 219 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 3fgc n THR 220 N -2.04 0.11 -1.45 3.34 -2.24 -1.26 -4.01 114.28 106.74 3fgc n THR 220 Ca 0.02 -0.09 -0.07 0.00 -2.27 0.00 0.00 64.05 61.64 3fgc n THR 220 Cb 0.18 0.10 0.20 0.00 -2.10 0.00 0.00 70.33 68.71 3fgc n THR 220 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 3fgc n LYS 221 N -1.70 1.87 -4.33 -0.78 5.02 -0.85 -4.98 118.16 112.42 3fgc n LYS 221 Ca 0.05 -3.19 -0.34 0.00 -2.02 0.00 0.00 58.31 52.81 3fgc n LYS 221 Cb 0.37 -1.86 -0.12 0.00 -0.02 0.00 0.00 35.03 33.40 3fgc n LYS 221 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3fgc s ILE 222 N -3.27 3.91 -1.04 -0.18 1.01 -1.26 -5.03 121.20 115.34 3fgc s ILE 222 Ca 0.46 -0.35 -0.07 0.00 0.00 0.00 0.00 60.65 60.69 3fgc s ILE 222 Cb 0.42 -2.73 -0.08 0.00 0.01 0.00 0.00 42.46 40.08 3fgc s ILE 222 CO 0.01 0.48 3.00 -0.67 0.00 0.00 0.00 174.94 177.75 3fgc n ASP 223 N 3.68 7.51 -4.76 3.58 2.03 -1.26 -4.96 116.55 122.37 3fgc n ASP 223 Ca -0.17 -2.73 -0.37 0.00 0.52 0.00 0.00 54.79 52.03 3fgc n ASP 223 Cb 0.52 -1.45 0.01 0.00 -0.72 0.00 0.00 41.12 39.49 3fgc n ASP 223 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 3fgc s HIS 224 N 0.79 2.60 -0.04 -0.67 3.76 -1.26 -4.66 115.29 115.81 3fgc s HIS 224 Ca 0.65 1.48 0.07 0.00 -0.15 0.00 0.00 55.06 57.10 3fgc s HIS 224 Cb 0.24 -3.54 -0.01 0.00 1.11 0.00 0.00 32.58 30.38 3fgc s HIS 224 CO -0.07 -2.09 -0.24 0.00 -0.85 0.00 0.00 174.74 171.49 3fgc s LEU 226 N -0.33 4.19 0.15 0.00 1.43 -0.59 -0.38 118.68 123.15 3fgc s LEU 226 Ca 0.02 0.94 0.07 0.00 -1.03 0.00 0.00 54.13 54.13 3fgc s LEU 226 Cb -0.12 -2.96 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 3fgc s LEU 226 CO 0.02 -0.24 -0.02 -0.94 0.23 0.00 0.00 176.35 175.39 3fgc s SER 227 N 1.08 4.72 -0.15 2.29 1.04 -1.15 -0.20 113.70 121.35 3fgc s SER 227 Ca 0.31 -0.36 -0.12 0.00 0.48 0.00 0.00 55.95 56.27 3fgc s SER 227 Cb -0.16 -1.00 0.04 0.00 0.10 0.00 0.00 66.02 65.00 3fgc s SER 227 CO 0.12 0.12 0.38 -0.31 0.98 0.00 0.00 173.24 174.53 3fgc s TYR 228 N -1.55 -0.46 -0.18 5.02 2.02 -0.13 -3.81 117.35 118.26 3fgc s TYR 228 Ca 0.26 1.07 -0.21 0.00 -0.37 0.00 0.00 57.07 57.82 3fgc s TYR 228 Cb -0.10 0.17 -0.03 0.00 -0.40 0.00 0.00 41.96 41.60 3fgc s TYR 228 CO 0.17 -0.24 0.62 0.42 -1.57 0.00 0.00 175.55 174.96 3fgc s ILE 229 N 0.59 5.03 -0.05 2.71 -1.09 -1.26 0.06 121.20 127.19 3fgc s ILE 229 Ca -0.03 1.19 0.04 0.00 -2.23 0.00 0.00 60.65 59.62 3fgc s ILE 229 Cb -0.05 -3.94 -0.00 0.00 -1.58 0.00 0.00 42.46 36.89 3fgc s ILE 229 CO -0.04 0.13 -0.16 -0.89 -1.23 0.00 0.00 174.94 172.76 3fgc s THR 230 N 1.76 1.37 -0.29 2.92 2.01 0.82 -3.98 115.64 120.24 3fgc s THR 230 Ca 0.29 -0.67 0.03 0.00 0.31 0.00 0.00 61.69 61.65 3fgc s THR 230 Cb -0.16 -1.19 0.17 0.00 0.01 0.00 0.00 72.50 71.33 3fgc s THR 230 CO 0.11 0.40 0.43 -0.55 -0.69 0.00 0.00 174.62 174.32 3fgc s SER 231 N 0.14 0.14 -0.22 3.53 0.15 -0.19 -4.44 113.70 112.81 3fgc s SER 231 Ca -0.06 -0.35 -0.10 0.00 0.70 0.00 0.00 55.95 56.14 3fgc s SER 231 Cb -0.12 1.21 -0.05 0.00 -1.71 0.00 0.00 66.02 65.36 3fgc s SER 231 CO 0.03 -0.34 0.13 -0.69 1.20 0.00 0.00 173.24 173.56 3fgc s VAL 232 N 2.55 5.24 -0.23 4.45 1.01 -1.26 -0.96 120.40 131.20 3fgc s VAL 232 Ca 0.10 0.13 -0.19 0.00 0.00 0.00 0.00 61.98 62.02 3fgc s VAL 232 Cb -0.12 -3.42 0.06 0.00 0.00 0.00 0.00 36.38 32.90 3fgc s VAL 232 CO -0.29 0.39 0.59 -0.62 0.00 0.00 0.00 175.10 175.17 3fgc s ASP 233 N 0.79 -0.66 0.57 3.32 -1.08 -0.47 -4.85 116.67 114.30 3fgc s ASP 233 Ca 0.07 1.21 0.30 0.00 -0.52 0.00 0.00 52.55 53.61 3fgc s ASP 233 Cb -0.13 1.19 1.73 0.00 -1.46 0.00 0.00 42.92 44.25 3fgc s ASP 233 CO 0.02 -0.21 2.19 0.45 0.52 0.00 0.00 175.17 178.14 3fgc h HIS 234 N 5.66 0.00 -2.76 -5.34 3.86 -1.95 -3.02 115.15 111.59 3fgc h HIS 234 Ca -0.29 0.00 -0.66 0.00 -1.16 0.00 0.00 60.37 58.26 3fgc h HIS 234 Cb 1.18 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 29.48 3fgc h HIS 234 CO 0.33 0.05 0.38 0.34 0.86 0.00 0.00 177.93 179.89 3fgc s ASP 235 N -6.05 6.18 0.15 2.45 -1.08 -1.26 -4.82 116.67 112.23 3fgc s ASP 235 Ca -0.04 -1.15 -0.17 0.00 -0.52 0.00 0.00 52.55 50.67 3fgc s ASP 235 Cb 0.14 -2.37 0.00 0.00 -1.46 0.00 0.00 42.92 39.23 3fgc s ASP 235 CO 0.55 -1.31 1.80 -1.28 0.52 0.00 0.00 175.17 175.45 3fgc h SER 236 N 9.42 0.40 0.66 -0.34 0.87 -1.89 -2.78 113.55 119.90 3fgc h SER 236 Ca -0.29 -0.01 -0.10 0.00 -1.23 0.00 0.00 61.79 60.17 3fgc h SER 236 Cb 1.08 -0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 3fgc h SER 236 CO 1.15 0.29 -0.46 0.78 -0.53 0.00 0.00 176.83 178.06 3fgc h ASN 237 N 0.48 0.00 -0.25 6.23 -0.26 -1.93 -2.18 115.58 117.68 3fgc h ASN 237 Ca 0.14 0.00 -0.09 0.00 -0.56 0.00 0.00 56.30 55.78 3fgc h ASN 237 Cb -0.04 0.00 -0.00 0.00 -1.06 0.00 0.00 38.32 37.21 3fgc h ASN 237 CO -0.04 0.46 -0.21 -0.09 -1.06 0.00 0.00 177.43 176.49 3fgc h ARG 238 N 0.00 0.58 -0.71 0.81 2.43 -1.92 -1.66 114.38 113.92 3fgc h ARG 238 Ca -0.00 -0.29 0.09 0.00 -0.81 0.00 0.00 59.98 58.96 3fgc h ARG 238 Cb 0.91 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.40 3fgc h ARG 238 CO 0.06 0.88 0.35 0.00 -1.51 0.00 0.00 179.97 179.75 3fgc h ALA 239 N 0.69 0.98 -0.50 2.80 0.00 -1.22 -1.69 119.26 120.32 3fgc h ALA 239 Ca 0.04 0.06 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 3fgc h ALA 239 Cb 0.76 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 3fgc h ALA 239 CO 0.05 -0.05 -0.12 0.87 0.00 0.00 0.00 179.25 180.00 3fgc h LYS 240 N 0.60 0.95 0.07 0.00 1.57 -1.22 -2.37 116.57 116.16 3fgc h LYS 240 Ca 0.35 -0.35 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3fgc h LYS 240 Cb 0.37 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.62 3fgc h LYS 240 CO -0.27 1.01 -0.03 -0.44 -0.57 0.00 0.00 179.45 179.15 3fgc h ASP 241 N 0.84 -0.08 -0.20 0.86 3.32 -1.00 0.87 116.42 121.03 3fgc h ASP 241 Ca 0.13 -0.10 0.06 0.00 0.02 0.00 0.00 57.03 57.14 3fgc h ASP 241 Cb 0.67 0.02 -0.06 0.00 0.22 0.00 0.00 39.33 40.18 3fgc h ASP 241 CO 0.05 0.05 -0.21 0.40 -1.72 0.00 0.00 179.24 177.81 3fgc h ILE 242 N -0.20 0.46 -0.29 0.35 2.04 -1.25 -0.27 117.51 118.35 3fgc h ILE 242 Ca -0.01 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 3fgc h ILE 242 Cb 0.17 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 3fgc h ILE 242 CO 0.02 0.00 0.03 0.00 0.00 0.00 0.00 178.15 178.19 3fgc h ARG 244 N 0.30 0.09 -0.42 0.00 2.43 -0.70 -0.04 114.38 116.04 3fgc h ARG 244 Ca 0.09 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.28 3fgc h ARG 244 Cb 0.38 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.88 3fgc h ARG 244 CO 0.01 0.06 0.23 -0.91 -1.51 0.00 0.00 179.97 177.84 3fgc h ASN 245 N 0.09 0.34 -0.30 -3.80 -0.26 -0.94 -2.61 115.58 108.11 3fgc h ASN 245 Ca 0.12 0.01 0.03 0.00 -0.56 0.00 0.00 56.30 55.90 3fgc h ASN 245 Cb 0.15 -0.05 -0.03 0.00 -1.06 0.00 0.00 38.32 37.33 3fgc h ASN 245 CO -0.20 0.25 0.12 0.15 -1.06 0.00 0.00 177.43 176.69 3fgc h PHE 246 N 0.46 0.23 -0.29 1.19 3.57 -1.07 -2.59 116.94 118.44 3fgc h PHE 246 Ca 0.18 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.64 3fgc h PHE 246 Cb 0.06 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.72 3fgc h PHE 246 CO -0.09 0.11 -0.03 -0.07 -2.23 0.00 0.00 178.31 176.00 3fgc h LEU 247 N 0.27 0.43 -0.28 0.59 3.38 -0.90 -0.57 115.31 118.22 3fgc h LEU 247 Ca 0.13 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.01 3fgc h LEU 247 Cb 0.07 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 3fgc h LEU 247 CO -0.11 0.52 0.15 1.23 0.09 0.00 0.00 178.44 180.32 3fgc h GLY 248 N 0.81 0.43 1.42 0.83 0.00 -1.38 -1.71 103.07 103.45 3fgc h GLY 248 Ca 0.09 -0.20 -0.09 0.00 0.00 0.00 0.00 47.33 47.13 3fgc h GLY 248 CO 0.01 0.19 -0.13 0.45 0.00 0.00 0.00 176.54 177.07 3fgc h HIS 249 N 0.33 0.76 0.13 5.60 3.86 -0.91 -2.13 115.15 122.79 3fgc h HIS 249 Ca 0.10 -0.14 -0.28 0.00 -1.16 0.00 0.00 60.37 58.89 3fgc h HIS 249 Cb 0.09 -0.20 0.02 0.00 1.06 0.00 0.00 27.41 28.38 3fgc h HIS 249 CO -0.03 0.79 -1.24 2.35 0.86 0.00 0.00 177.93 180.66 3fgc h TRP 250 N 0.63 0.73 -0.77 2.45 7.01 -1.13 -0.74 115.95 124.13 3fgc h TRP 250 Ca 0.11 -0.49 -0.05 0.00 2.11 0.00 0.00 58.89 60.57 3fgc h TRP 250 Cb 0.58 -0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.57 3fgc h TRP 250 CO 0.03 1.36 0.28 -0.92 -2.79 0.00 0.00 178.44 176.39 3fgc h TYR 251 N 0.16 1.20 -0.31 2.65 3.20 -1.27 0.12 116.97 122.72 3fgc h TYR 251 Ca -0.16 -0.11 -0.11 0.00 3.14 0.00 0.00 58.73 61.49 3fgc h TYR 251 Cb 1.93 -0.35 -0.01 0.00 1.54 0.00 0.00 36.73 39.83 3fgc h TYR 251 CO 0.09 0.93 -0.28 -0.44 -1.64 0.00 0.00 178.16 176.81 3fgc h ASP 252 N 1.13 0.65 -0.02 -2.11 3.32 -1.16 -1.62 116.42 116.61 3fgc h ASP 252 Ca 0.25 -0.25 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 3fgc h ASP 252 Cb 0.26 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3fgc h ASP 252 CO -0.01 0.90 -0.33 -1.28 -1.72 0.00 0.00 179.24 176.80 3fgc h SER 253 N 0.55 0.50 -0.50 6.45 0.87 -0.79 -1.54 113.55 119.08 3fgc h SER 253 Ca 0.07 -0.20 -0.02 0.00 -1.23 0.00 0.00 61.79 60.42 3fgc h SER 253 Cb 0.76 -0.14 -0.02 0.00 -0.44 0.00 0.00 62.40 62.56 3fgc h SER 253 CO 0.06 0.80 0.24 0.22 -0.53 0.00 0.00 176.83 177.62 3fgc h TYR 254 N 0.42 0.72 -0.05 2.24 3.20 -0.35 -1.55 116.97 121.60 3fgc h TYR 254 Ca 0.05 -0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.88 3fgc h TYR 254 Cb 0.78 -0.22 -0.00 0.00 1.54 0.00 0.00 36.73 38.82 3fgc h TYR 254 CO 0.03 0.57 0.03 0.28 -1.64 0.00 0.00 178.16 177.42 3fgc h VAL 255 N 0.66 1.09 -0.12 1.81 2.07 -1.21 -2.41 116.25 118.14 3fgc h VAL 255 Ca 0.17 -0.24 -0.04 0.00 0.82 0.00 0.00 66.70 67.40 3fgc h VAL 255 Cb 0.12 1.16 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3fgc h VAL 255 CO -0.02 0.07 -0.12 0.78 0.02 0.00 0.00 177.57 178.30 3fgc h ASN 256 N -0.01 0.17 0.59 0.57 2.35 -1.18 -2.20 115.58 115.86 3fgc h ASN 256 Ca 0.02 -0.03 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 3fgc h ASN 256 Cb 0.09 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 3fgc h ASN 256 CO -0.00 0.32 -0.38 0.00 -1.65 0.00 0.00 177.43 175.71 3fgc h ALA 257 N 1.70 1.16 0.00 -0.83 0.00 -1.01 -2.72 119.26 117.56 3fgc h ALA 257 Ca 0.04 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3fgc h ALA 257 Cb 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.06 3fgc h ALA 257 CO 0.02 0.48 0.00 1.79 0.00 0.00 0.00 179.25 181.54 3fgc h THR 258 N 0.00 0.00 -0.34 0.00 1.35 -0.91 -3.31 112.91 109.71 3fgc h THR 258 Ca -0.00 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 3fgc h THR 258 Cb 0.78 1.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.95 3fgc h THR 258 CO 0.05 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.61 3fgc n LYS 259 N -3.00 2.88 -0.31 4.72 5.02 -1.05 -4.76 118.16 121.66 3fgc n LYS 259 Ca 0.03 -2.08 -0.02 0.00 -2.02 0.00 0.00 58.31 54.22 3fgc n LYS 259 Cb 0.43 -1.29 0.15 0.00 -0.02 0.00 0.00 35.03 34.30 3fgc n LYS 259 CO 0.00 0.00 0.00 -0.84 -0.52 0.00 0.00 177.40 176.04 3fgc h ILE 260 N 1.97 1.24 -0.61 -0.18 -2.65 -1.59 -1.87 117.51 113.82 3fgc h ILE 260 Ca 0.00 -0.49 -0.12 0.00 1.03 0.00 0.00 64.86 65.27 3fgc h ILE 260 Cb 0.76 -0.04 -0.07 0.00 -2.05 0.00 0.00 36.82 35.42 3fgc h ILE 260 CO 0.01 0.24 0.16 0.49 0.03 0.00 0.00 178.15 179.08 3fgc n PHE 261 N -4.37 2.08 -0.24 0.16 3.72 -1.26 -4.78 117.46 112.76 3fgc n PHE 261 Ca 0.10 -0.92 0.05 0.00 -0.05 0.00 0.00 57.45 56.62 3fgc n PHE 261 Cb 0.05 -0.58 0.17 0.00 -0.94 0.00 0.00 39.48 38.18 3fgc n PHE 261 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 3fgc h ASP 262 N 2.81 -0.10 -0.44 4.37 5.19 -1.68 -2.39 116.42 124.19 3fgc h ASP 262 Ca 0.15 0.16 -0.27 0.00 -0.62 0.00 0.00 57.03 56.45 3fgc h ASP 262 Cb 2.04 0.24 -0.17 0.00 0.18 0.00 0.00 39.33 41.62 3fgc h ASP 262 CO 0.58 -0.08 -0.19 0.47 -3.12 0.00 0.00 179.24 176.90 3fgc n ASP 263 N -5.21 3.26 -4.98 6.45 8.00 -1.26 -5.08 116.55 117.72 3fgc n ASP 263 Ca 0.13 -3.80 -0.20 0.00 0.71 0.00 0.00 54.79 51.63 3fgc n ASP 263 Cb 0.45 -0.60 0.01 0.00 -0.02 0.00 0.00 41.12 40.96 3fgc n ASP 263 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 3fgc s SER 264 N -2.77 5.72 -0.26 -2.24 1.04 -0.90 -5.02 113.70 109.28 3fgc s SER 264 Ca 0.47 -0.12 -0.29 0.00 0.48 0.00 0.00 55.95 56.49 3fgc s SER 264 Cb 0.41 -1.07 -0.02 0.00 0.10 0.00 0.00 66.02 65.44 3fgc s SER 264 CO -0.00 -0.71 1.67 -0.62 0.98 0.00 0.00 173.24 174.55 3fgc s ASP 265 N -4.28 6.23 0.00 7.02 3.68 -1.26 -4.88 116.67 123.18 3fgc s ASP 265 Ca 0.51 1.51 0.08 0.00 2.13 0.00 0.00 52.55 56.78 3fgc s ASP 265 Cb -0.10 -2.53 0.49 0.00 -1.45 0.00 0.00 42.92 39.33 3fgc s ASP 265 CO 0.34 -1.40 1.16 1.67 0.13 0.00 0.00 175.17 177.08 3fgc n GLN 266 N 7.91 0.82 -2.37 4.34 7.27 -1.26 -4.87 117.38 129.21 3fgc n GLN 266 Ca 0.20 0.00 -0.42 0.00 0.07 0.00 0.00 57.00 56.85 3fgc n GLN 266 Cb 0.46 -1.16 -0.03 0.00 2.41 0.00 0.00 30.24 31.92 3fgc n GLN 266 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 3fgc s THR 267 N -2.00 4.05 0.32 1.69 2.01 -1.26 -5.02 115.64 115.43 3fgc s THR 267 Ca 0.12 1.39 -0.08 0.00 0.31 0.00 0.00 61.69 63.43 3fgc s THR 267 Cb 0.06 -3.89 -0.06 0.00 0.01 0.00 0.00 72.50 68.61 3fgc s THR 267 CO 0.10 -0.01 0.64 -0.54 -0.69 0.00 0.00 174.62 174.11 3fgc s LYS 268 N 2.39 3.73 0.00 4.92 1.02 -1.26 -5.11 119.74 125.42 3fgc s LYS 268 Ca 0.59 0.24 0.00 0.00 0.02 0.00 0.00 55.97 56.82 3fgc s LYS 268 Cb -0.27 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.49 3fgc s LYS 268 CO 0.23 0.14 0.00 0.41 -0.92 0.00 0.00 175.35 175.22 3fgc n GLY 269 N -0.89 0.80 3.65 -3.33 0.00 -1.26 -5.00 105.19 99.17 3fgc n GLY 269 Ca 0.00 -1.80 -0.45 0.00 0.00 0.00 0.00 46.02 43.77 3fgc n GLY 269 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3fgc n TYR 270 N 0.00 2.00 -2.84 1.61 9.36 -1.26 -4.90 117.16 121.13 3fgc n TYR 270 Ca 0.00 0.48 -0.43 0.00 3.32 0.00 0.00 57.90 61.27 3fgc n TYR 270 Cb 0.00 -2.42 -0.03 0.00 -0.63 0.00 0.00 39.34 36.26 3fgc n TYR 270 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 3fgc s ASP 271 N 0.20 6.57 0.00 2.98 2.15 -1.26 -4.81 116.67 122.51 3fgc s ASP 271 Ca 0.68 -1.85 0.29 0.00 0.43 0.00 0.00 52.55 52.11 3fgc s ASP 271 Cb -0.68 -2.44 1.40 0.00 -0.30 0.00 0.00 42.92 40.90 3fgc s ASP 271 CO 0.51 -1.19 2.00 0.49 -0.17 0.00 0.00 175.17 176.81 3fgc n PHE 272 N 7.14 0.00 -2.22 -5.34 3.01 -1.26 -4.03 117.46 114.76 3fgc n PHE 272 Ca 0.24 0.00 -0.15 0.00 1.01 0.00 0.00 57.45 58.55 3fgc n PHE 272 Cb 0.49 -0.37 0.04 0.00 -0.01 0.00 0.00 39.48 39.63 3fgc n PHE 272 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 3fgc n ASN 273 N -1.37 3.74 -0.32 4.37 5.03 -1.26 -4.96 115.26 120.48 3fgc n ASN 273 Ca 0.11 -3.26 0.19 0.00 0.87 0.00 0.00 54.58 52.49 3fgc n ASN 273 Cb 0.28 -0.39 0.38 0.00 -1.02 0.00 0.00 39.78 39.03 3fgc n ASN 273 CO 0.00 0.00 0.00 0.50 -1.83 0.00 0.00 177.26 175.93 3fgc h LYS 274 N 2.19 0.10 -0.00 3.52 1.63 -1.91 -0.07 116.57 122.03 3fgc h LYS 274 Ca 0.20 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.99 3fgc h LYS 274 Cb 1.44 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 33.05 3fgc h LYS 274 CO 0.54 0.07 -0.00 0.41 -3.45 0.00 0.00 179.45 177.02 3fgc n GLY 275 N -1.38 -1.02 0.11 5.01 0.00 -1.25 -3.83 105.19 102.82 3fgc n GLY 275 Ca 0.27 -0.20 0.12 0.00 0.00 0.00 0.00 46.02 46.21 3fgc n GLY 275 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3fgc h GLN 276 N 0.08 0.00 -6.66 1.61 4.20 -0.99 -3.35 115.11 110.00 3fgc h GLN 276 Ca 0.00 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.21 3fgc h GLN 276 Cb 0.07 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 3fgc h GLN 276 CO 0.00 0.00 0.24 -1.58 -0.67 0.00 0.00 178.83 176.82 3fgc s TRP 277 N -3.30 3.82 -0.01 2.96 0.52 -1.25 -4.44 118.94 117.24 3fgc s TRP 277 Ca 0.02 1.67 0.00 0.00 0.02 0.00 0.00 56.10 57.82 3fgc s TRP 277 Cb 0.10 -2.81 -0.04 0.00 -1.15 0.00 0.00 33.47 29.57 3fgc s TRP 277 CO 0.76 0.40 0.03 1.03 0.02 0.00 0.00 176.95 179.19 3fgc s ARG 278 N -1.53 2.90 0.43 4.98 0.52 -1.26 -5.03 118.95 119.96 3fgc s ARG 278 Ca 0.41 -0.54 0.09 0.00 -0.52 0.00 0.00 55.73 55.18 3fgc s ARG 278 Cb -0.21 -2.75 0.92 0.00 0.52 0.00 0.00 34.95 33.43 3fgc s ARG 278 CO 0.26 0.64 2.04 -0.44 0.02 0.00 0.00 175.30 177.82 3fgc h ASP 279 N 4.36 0.31 -3.15 0.23 3.32 -2.02 -3.45 116.42 116.02 3fgc h ASP 279 Ca -0.49 -0.02 -0.64 0.00 0.02 0.00 0.00 57.03 55.90 3fgc h ASP 279 Cb 1.18 -0.08 -0.15 0.00 0.22 0.00 0.00 39.33 40.50 3fgc h ASP 279 CO 0.59 0.29 -0.75 -0.36 -1.72 0.00 0.00 179.24 177.29 3fgc s PHE 280 N -5.20 2.59 0.75 4.55 0.40 -1.26 -5.13 117.98 114.68 3fgc s PHE 280 Ca -0.07 -0.24 -0.11 0.00 -0.60 0.00 0.00 56.93 55.91 3fgc s PHE 280 Cb 0.17 -1.29 0.04 0.00 0.51 0.00 0.00 43.02 42.45 3fgc s PHE 280 CO 0.72 0.49 1.10 0.14 0.70 0.00 0.00 175.22 178.37 3fgc s VAL 281 N -1.60 3.26 0.64 -0.44 -7.23 -1.26 -4.93 120.40 108.84 3fgc s VAL 281 Ca 0.23 0.41 -0.14 0.00 -1.81 0.00 0.00 61.98 60.67 3fgc s VAL 281 Cb -0.09 -3.28 -0.01 0.00 0.56 0.00 0.00 36.38 33.56 3fgc s VAL 281 CO 0.14 -0.53 1.07 -0.76 -0.31 0.00 0.00 175.10 174.71 3fgc s LEU 282 N -5.57 3.36 0.09 1.32 1.43 -1.26 -5.12 118.68 112.93 3fgc s LEU 282 Ca 0.59 1.82 -0.35 0.00 -1.03 0.00 0.00 54.13 55.16 3fgc s LEU 282 Cb -0.13 -4.53 -0.16 0.00 0.03 0.00 0.00 46.19 41.41 3fgc s LEU 282 CO 0.53 -1.39 1.57 0.11 0.23 0.00 0.00 176.35 177.39 3fgc h LYS 283 N -0.01 -0.87 0.00 1.70 1.79 -2.01 -3.53 116.57 113.64 3fgc h LYS 283 Ca -0.46 0.06 0.00 0.00 -2.18 0.00 0.00 60.65 58.07 3fgc h LYS 283 Cb 1.22 0.20 0.00 0.00 -1.58 0.00 0.00 32.23 32.07 3fgc h LYS 283 CO 0.56 -0.58 0.00 0.54 -1.08 0.00 0.00 179.45 178.89 3fgc n ARG 290 N -5.53 0.00 -2.41 3.15 1.74 -1.26 -5.32 116.66 107.04 3fgc n ARG 290 Ca -0.11 0.00 -0.34 0.00 -0.77 0.00 0.00 57.85 56.64 3fgc n ARG 290 Cb 0.44 0.00 -0.02 0.00 -1.02 0.00 0.00 32.46 31.86 3fgc n ARG 290 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3fgc s ARG 291 N 0.00 3.69 -0.15 5.56 3.00 -1.26 -4.98 118.95 124.80 3fgc s ARG 291 Ca 0.00 1.29 0.14 0.00 0.00 0.00 0.00 55.73 57.17 3fgc s ARG 291 Cb 0.00 -2.08 0.36 0.00 0.00 0.00 0.00 34.95 33.23 3fgc s ARG 291 CO 0.00 -0.52 1.18 0.44 0.00 0.00 0.00 175.30 176.40 3fgc n ILE 292 N -1.28 1.74 -0.08 1.52 -0.00 -1.26 -4.82 119.36 115.19 3fgc n ILE 292 Ca 0.09 -2.53 0.02 0.00 -0.00 0.00 0.00 62.75 60.33 3fgc n ILE 292 Cb 0.53 -0.06 0.33 0.00 -0.00 0.00 0.00 39.64 40.44 3fgc n ILE 292 CO 0.00 0.00 0.00 -2.24 -0.00 0.00 0.00 176.55 174.31 3fgc h ASP 293 N 0.66 0.62 -0.48 7.28 2.03 -1.94 -2.56 116.42 122.03 3fgc h ASP 293 Ca -0.03 -0.04 0.00 0.00 -0.73 0.00 0.00 57.03 56.23 3fgc h ASP 293 Cb 1.12 -0.16 0.00 0.00 -0.83 0.00 0.00 39.33 39.47 3fgc h ASP 293 CO 0.01 0.50 0.00 -1.22 -1.03 0.00 0.00 179.24 177.51 3fgc n TYR 294 N -4.41 0.63 0.41 4.15 4.01 -1.26 -4.44 117.16 116.25 3fgc n TYR 294 Ca 0.04 -0.32 0.12 0.00 -0.16 0.00 0.00 57.90 57.58 3fgc n TYR 294 Cb 0.10 0.00 0.48 0.00 -0.31 0.00 0.00 39.34 39.61 3fgc n TYR 294 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 3fgc n SER 295 N 1.09 0.64 0.27 7.72 3.41 -0.97 -1.45 113.62 124.34 3fgc n SER 295 Ca 0.18 0.65 0.18 0.00 -0.26 0.00 0.00 58.87 59.63 3fgc n SER 295 Cb 0.48 -0.79 0.95 0.00 -0.26 0.00 0.00 64.21 64.58 3fgc n SER 295 CO 0.00 0.00 0.00 0.10 -0.16 0.00 0.00 175.04 174.98 3fgc h TYR 296 N 0.00 0.00 0.00 7.33 -0.00 -1.82 -1.74 116.97 120.74 3fgc h TYR 296 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 58.73 58.68 3fgc h TYR 296 Cb 0.37 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.09 3fgc h TYR 296 CO 0.00 0.00 -0.26 0.93 -0.00 0.00 0.00 178.16 178.83 3fgc h GLU 297 N 0.00 0.00 -0.30 0.10 5.08 -1.61 -3.05 114.58 114.80 3fgc h GLU 297 Ca 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3fgc h GLU 297 Cb 0.07 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 3fgc h GLU 297 CO 0.00 0.26 0.01 0.44 -1.00 0.00 0.00 179.01 178.72 3fgc n ILE 298 N -3.50 2.36 -4.29 3.13 -5.35 -0.66 -4.97 119.36 106.07 3fgc n ILE 298 Ca -0.00 -1.96 -0.16 0.00 -0.27 0.00 0.00 62.75 60.35 3fgc n ILE 298 Cb 0.42 -0.27 -0.10 0.00 -1.74 0.00 0.00 39.64 37.95 3fgc n ILE 298 CO 0.00 0.00 0.00 0.20 -1.76 0.00 0.00 176.55 174.99 3fgc s ASN 299 N -1.94 2.10 -1.21 7.28 0.01 -1.15 -4.98 114.94 115.04 3fgc s ASN 299 Ca 0.43 -1.04 -0.20 0.00 -0.71 0.00 0.00 52.86 51.35 3fgc s ASN 299 Cb 0.36 -0.06 0.05 0.00 0.41 0.00 0.00 41.25 42.01 3fgc s ASN 299 CO 0.08 -0.29 1.68 -2.16 -1.51 0.00 0.00 177.10 174.91 3fgc s PRO 300 N -3.72 3.73 -0.22 -0.60 0.04 -1.26 -4.86 135.00 128.12 3fgc s PRO 300 Ca 0.20 -1.66 -0.01 0.00 0.04 0.00 0.00 61.00 59.57 3fgc s PRO 300 Cb 0.02 -5.46 0.06 0.00 0.04 0.00 0.00 34.50 29.16 3fgc s PRO 300 CO 0.04 -2.41 0.01 0.08 0.04 0.00 0.00 177.00 174.76 3fgc s VAL 301 N 5.10 0.96 -5.00 -0.36 1.01 -1.25 -1.02 120.40 119.84 3fgc s VAL 301 Ca 0.53 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.61 3fgc s VAL 301 Cb 0.02 -1.40 0.00 0.00 0.00 0.00 0.00 36.38 35.01 3fgc s VAL 301 CO 0.03 -0.21 0.00 0.61 0.00 0.00 0.00 175.10 175.53 3fgc n GLY 302 N 4.88 0.36 3.79 4.51 0.00 -0.13 -4.80 105.19 113.79 3fgc n GLY 302 Ca -0.09 -1.45 -0.31 0.00 0.00 0.00 0.00 46.02 44.16 3fgc n GLY 302 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3fgc s THR 303 N -3.46 3.63 0.23 2.61 -4.23 -1.14 -1.36 115.64 111.92 3fgc s THR 303 Ca 0.00 0.54 -0.13 0.00 -1.18 0.00 0.00 61.69 60.92 3fgc s THR 303 Cb 0.00 -3.14 0.29 0.00 1.34 0.00 0.00 72.50 71.00 3fgc s THR 303 CO 0.00 -0.68 1.59 -0.65 -0.54 0.00 0.00 174.62 174.33 3fgc h PRO 304 N -0.88 -0.03 0.00 3.99 0.11 -1.90 -0.84 132.00 132.44 3fgc h PRO 304 Ca -0.44 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 3fgc h PRO 304 Cb 1.22 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.34 3fgc h PRO 304 CO 0.54 -0.02 -0.10 0.93 -0.21 0.00 0.00 178.00 179.14 3fgc h GLU 305 N -0.03 0.00 -0.23 1.05 4.39 -1.93 0.44 114.58 118.27 3fgc h GLU 305 Ca 0.36 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.89 3fgc h GLU 305 Cb 0.59 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.23 3fgc h GLU 305 CO -0.83 0.10 -0.52 0.93 -1.16 0.00 0.00 179.01 177.53 3fgc h GLU 306 N 0.00 0.67 -0.32 2.33 5.08 -1.60 -1.77 114.58 118.97 3fgc h GLU 306 Ca -0.00 -0.41 -0.04 0.00 -1.00 0.00 0.00 59.36 57.91 3fgc h GLU 306 Cb 0.53 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 3fgc h GLU 306 CO 0.01 1.02 0.05 0.00 -1.00 0.00 0.00 179.01 179.09 3fgc h ILE 308 N 0.35 1.03 -0.35 0.00 2.04 -0.14 -2.15 117.51 118.29 3fgc h ILE 308 Ca 0.10 -0.26 -0.13 0.00 1.00 0.00 0.00 64.86 65.57 3fgc h ILE 308 Cb 0.35 0.21 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 3fgc h ILE 308 CO 0.01 0.14 -0.29 0.00 0.00 0.00 0.00 178.15 178.00 3fgc h ALA 309 N 1.32 0.51 -0.53 1.87 0.00 -1.21 -0.09 119.26 121.12 3fgc h ALA 309 Ca 0.28 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 3fgc h ALA 309 Cb 0.10 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3fgc h ALA 309 CO -0.14 0.54 0.29 0.82 0.00 0.00 0.00 179.25 180.76 3fgc h ILE 310 N 0.61 1.18 0.01 0.00 2.04 -1.37 -0.77 117.51 119.20 3fgc h ILE 310 Ca 0.06 -0.46 -0.16 0.00 1.00 0.00 0.00 64.86 65.31 3fgc h ILE 310 Cb 0.87 0.51 0.01 0.00 -0.74 0.00 0.00 36.82 37.47 3fgc h ILE 310 CO 0.08 0.19 -0.61 0.40 0.00 0.00 0.00 178.15 178.21 3fgc h ILE 311 N 0.72 1.43 -0.95 -0.67 2.04 -1.32 -2.49 117.51 116.26 3fgc h ILE 311 Ca 0.19 -2.10 0.09 0.00 1.00 0.00 0.00 64.86 64.04 3fgc h ILE 311 Cb 0.05 2.63 -0.07 0.00 -0.74 0.00 0.00 36.82 38.69 3fgc h ILE 311 CO -0.03 0.61 0.61 -0.61 0.00 0.00 0.00 178.15 178.73 3fgc h GLN 312 N -0.12 0.96 -0.54 2.37 5.75 -1.02 -0.23 115.11 122.29 3fgc h GLN 312 Ca -0.08 -0.06 0.02 0.00 -0.15 0.00 0.00 58.65 58.39 3fgc h GLN 312 Cb 1.33 -0.22 -0.03 0.00 1.07 0.00 0.00 27.48 29.63 3fgc h GLN 312 CO 0.12 0.64 0.33 0.37 -2.65 0.00 0.00 178.83 177.64 3fgc h GLN 313 N 0.99 0.64 -0.31 1.69 4.15 -1.01 0.21 115.11 121.47 3fgc h GLN 313 Ca 0.44 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.80 3fgc h GLN 313 Cb 0.35 -0.15 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 3fgc h GLN 313 CO -0.19 0.43 0.14 -0.44 -1.93 0.00 0.00 178.83 176.83 3fgc h ASP 314 N 0.66 0.42 -0.10 -0.69 3.32 -0.82 -2.43 116.42 116.79 3fgc h ASP 314 Ca 0.22 -0.14 0.04 0.00 0.02 0.00 0.00 57.03 57.16 3fgc h ASP 314 Cb 0.01 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.41 3fgc h ASP 314 CO -0.09 0.45 -0.14 0.40 -1.72 0.00 0.00 179.24 178.14 3fgc h ILE 315 N 0.37 0.64 -0.11 0.35 2.04 -0.89 -1.95 117.51 117.96 3fgc h ILE 315 Ca 0.11 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.00 3fgc h ILE 315 Cb 0.15 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 3fgc h ILE 315 CO -0.01 0.00 0.09 0.44 0.00 0.00 0.00 178.15 178.67 3fgc h ASP 316 N -0.18 0.00 0.90 1.72 3.32 -0.51 0.21 116.42 121.88 3fgc h ASP 316 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 3fgc h ASP 316 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 3fgc h ASP 316 CO -0.21 0.00 -0.87 0.00 -1.72 0.00 0.00 179.24 176.44 3fgc h ALA 317 N 1.93 0.51 0.00 3.45 0.00 -1.16 -3.41 119.26 120.58 3fgc h ALA 317 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3fgc h ALA 317 Cb 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 3fgc h ALA 317 CO -0.00 0.00 -0.85 0.25 0.00 0.00 0.00 179.25 178.65 3fgc n THR 318 N -2.41 0.00 -1.06 0.00 -2.24 -0.76 -4.73 114.28 103.08 3fgc n THR 318 Ca 0.01 -0.02 -0.02 0.00 -2.27 0.00 0.00 64.05 61.75 3fgc n THR 318 Cb 0.50 0.47 -0.01 0.00 -2.10 0.00 0.00 70.33 69.19 3fgc n THR 318 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3fgc n GLY 319 N 2.17 0.43 3.75 3.38 0.00 0.71 -5.02 105.19 110.61 3fgc n GLY 319 Ca 0.00 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 3fgc n GLY 319 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3fgc s ILE 320 N -1.68 3.71 -0.14 -0.61 1.01 -1.26 -4.86 121.20 117.38 3fgc s ILE 320 Ca 0.00 1.67 0.16 0.00 0.00 0.00 0.00 60.65 62.48 3fgc s ILE 320 Cb 0.00 -4.06 0.42 0.00 0.01 0.00 0.00 42.46 38.83 3fgc s ILE 320 CO 0.00 0.38 1.20 -0.90 0.00 0.00 0.00 174.94 175.62 3fgc n ASP 321 N 1.52 1.51 -3.80 3.58 5.75 -1.26 -4.67 116.55 119.17 3fgc n ASP 321 Ca -0.01 -3.25 -0.29 0.00 -0.01 0.00 0.00 54.79 51.24 3fgc n ASP 321 Cb 0.46 -0.45 -0.16 0.00 -1.03 0.00 0.00 41.12 39.94 3fgc n ASP 321 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 3fgc s ASN 322 N -2.83 3.28 -0.34 -1.12 3.84 -1.26 -1.37 114.94 115.15 3fgc s ASN 322 Ca 0.37 -0.99 -0.05 0.00 0.21 0.00 0.00 52.86 52.40 3fgc s ASN 322 Cb 0.38 -0.80 0.05 0.00 -0.55 0.00 0.00 41.25 40.32 3fgc s ASN 322 CO -0.10 -0.29 0.09 -0.63 -2.79 0.00 0.00 177.10 173.38 3fgc s ILE 323 N 1.69 3.57 -0.24 -5.21 -1.09 -0.33 -1.54 121.20 118.04 3fgc s ILE 323 Ca -0.02 -1.26 -0.07 0.00 -2.23 0.00 0.00 60.65 57.07 3fgc s ILE 323 Cb -0.18 -3.06 -0.03 0.00 -1.58 0.00 0.00 42.46 37.62 3fgc s ILE 323 CO -0.08 -0.20 0.06 0.00 -1.23 0.00 0.00 174.94 173.48 3fgc s GLY 326 N -0.41 2.00 0.00 0.00 0.00 0.11 -0.53 107.32 108.48 3fgc s GLY 326 Ca 0.04 -0.77 0.08 0.00 0.00 0.00 0.00 44.72 44.07 3fgc s GLY 326 CO 0.01 0.21 0.74 0.69 0.00 0.00 0.00 173.10 174.75 3fgc n PHE 327 N 3.78 0.00 0.69 1.90 3.01 -1.26 -0.13 117.46 125.45 3fgc n PHE 327 Ca -0.16 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.40 3fgc n PHE 327 Cb 0.52 0.00 0.42 0.00 -0.01 0.00 0.00 39.48 40.41 3fgc n PHE 327 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 3fgc n GLU 328 N 0.42 0.03 0.21 -1.08 1.02 -1.26 -1.99 120.64 117.98 3fgc n GLU 328 Ca 0.04 0.16 0.14 0.00 -0.02 0.00 0.00 57.16 57.49 3fgc n GLU 328 Cb 0.19 -1.50 0.72 0.00 -0.02 0.00 0.00 31.44 30.83 3fgc n GLU 328 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3fgc h ALA 329 N 2.69 1.00 -0.07 0.62 0.00 -1.87 -3.34 119.26 118.29 3fgc h ALA 329 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3fgc h ALA 329 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.11 3fgc h ALA 329 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.34 3fgc n ASN 330 N -2.51 0.43 0.00 0.00 3.02 -0.84 -4.78 115.26 110.58 3fgc n ASN 330 Ca -0.01 -1.79 0.00 0.00 -0.03 0.00 0.00 54.58 52.75 3fgc n ASN 330 Cb 0.10 -0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.23 3fgc n ASN 330 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3fgc n GLY 331 N 0.73 0.59 3.75 7.41 0.00 -1.26 -4.22 105.19 112.19 3fgc n GLY 331 Ca 0.08 -1.53 -0.30 0.00 0.00 0.00 0.00 46.02 44.27 3fgc n GLY 331 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3fgc s SER 332 N -4.00 3.73 0.30 1.61 1.04 -1.26 -4.72 113.70 110.40 3fgc s SER 332 Ca 0.00 1.36 0.06 0.00 0.48 0.00 0.00 55.95 57.85 3fgc s SER 332 Cb 0.00 -2.05 0.74 0.00 0.10 0.00 0.00 66.02 64.81 3fgc s SER 332 CO 0.00 -2.46 1.77 -0.08 0.98 0.00 0.00 173.24 173.45 3fgc h GLU 333 N -1.43 0.70 -0.69 4.02 4.81 -2.00 -1.25 114.58 118.76 3fgc h GLU 333 Ca -0.49 -0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 58.65 3fgc h GLU 333 Cb 1.29 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 30.48 3fgc h GLU 333 CO 0.57 0.47 0.25 1.49 -0.73 0.00 0.00 179.01 181.05 3fgc h GLU 334 N 0.72 1.03 0.00 1.92 4.81 -1.97 -1.55 114.58 119.54 3fgc h GLU 334 Ca 0.58 -0.19 -0.15 0.00 -0.13 0.00 0.00 59.36 59.47 3fgc h GLU 334 Cb 0.93 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 30.12 3fgc h GLU 334 CO -0.40 0.86 -0.71 0.93 -0.73 0.00 0.00 179.01 178.96 3fgc h GLU 335 N 1.00 0.00 -0.06 1.92 5.08 -1.62 -2.13 114.58 118.77 3fgc h GLU 335 Ca 0.23 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 3fgc h GLU 335 Cb 0.23 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.48 3fgc h GLU 335 CO -0.01 0.71 -0.05 0.82 -1.00 0.00 0.00 179.01 179.48 3fgc h ILE 336 N 0.00 1.36 -0.66 3.13 2.04 -1.11 -1.63 117.51 120.64 3fgc h ILE 336 Ca -0.01 -1.16 -0.00 0.00 1.00 0.00 0.00 64.86 64.69 3fgc h ILE 336 Cb 1.46 1.99 -0.03 0.00 -0.74 0.00 0.00 36.82 39.50 3fgc h ILE 336 CO 0.09 0.32 0.41 0.40 0.00 0.00 0.00 178.15 179.37 3fgc h ILE 337 N -0.27 1.18 -0.57 -0.67 2.04 -1.29 -0.57 117.51 117.37 3fgc h ILE 337 Ca 0.01 -0.39 -0.05 0.00 1.00 0.00 0.00 64.86 65.44 3fgc h ILE 337 Cb 0.54 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 3fgc h ILE 337 CO 0.01 0.19 0.18 0.00 0.00 0.00 0.00 178.15 178.53 3fgc h ALA 338 N 1.22 0.74 -0.82 1.87 0.00 -1.44 0.23 119.26 121.06 3fgc h ALA 338 Ca 0.24 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.01 3fgc h ALA 338 Cb -0.05 -0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.46 3fgc h ALA 338 CO -0.05 0.41 0.51 1.03 0.00 0.00 0.00 179.25 181.15 3fgc h SER 339 N 0.79 0.81 -0.55 0.00 0.87 -0.91 -1.35 113.55 113.22 3fgc h SER 339 Ca 0.18 0.01 -0.02 0.00 -1.23 0.00 0.00 61.79 60.74 3fgc h SER 339 Cb 0.28 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.06 3fgc h SER 339 CO -0.01 0.53 0.28 0.24 -0.53 0.00 0.00 176.83 177.34 3fgc h MET 340 N 0.95 0.77 -0.61 2.24 2.07 -0.46 -1.16 114.93 118.72 3fgc h MET 340 Ca 0.35 -0.10 -0.06 0.00 -2.07 0.00 0.00 59.70 57.82 3fgc h MET 340 Cb 0.13 -0.15 -0.03 0.00 -1.87 0.00 0.00 31.60 29.69 3fgc h MET 340 CO -0.16 0.61 0.12 0.87 1.07 0.00 0.00 176.91 179.43 3fgc h LYS 341 N 0.73 0.97 -0.23 1.72 1.57 -0.32 0.21 116.57 121.22 3fgc h LYS 341 Ca 0.19 -0.23 -0.18 0.00 -1.87 0.00 0.00 60.65 58.56 3fgc h LYS 341 Cb 0.08 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.26 3fgc h LYS 341 CO -0.03 0.88 -0.57 1.25 -0.57 0.00 0.00 179.45 180.41 3fgc h LEU 342 N 0.92 0.82 -0.46 2.94 5.85 -1.10 -1.40 115.31 122.88 3fgc h LEU 342 Ca 0.19 -0.45 0.05 0.00 0.84 0.00 0.00 57.88 58.51 3fgc h LEU 342 Cb 0.36 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 3fgc h LEU 342 CO 0.00 1.22 0.20 0.15 -0.34 0.00 0.00 178.44 179.67 3fgc h PHE 343 N 0.56 0.36 -0.55 1.25 3.04 -1.05 -0.49 116.94 120.06 3fgc h PHE 343 Ca 0.01 0.02 0.01 0.00 3.98 0.00 0.00 57.97 61.98 3fgc h PHE 343 Cb 1.16 -0.09 -0.03 0.00 2.56 0.00 0.00 35.95 39.55 3fgc h PHE 343 CO 0.06 0.16 0.36 0.37 -2.02 0.00 0.00 178.31 177.24 3fgc h GLN 344 N 0.40 0.71 0.17 1.11 4.15 -0.68 0.60 115.11 121.57 3fgc h GLN 344 Ca 0.21 -0.04 -0.31 0.00 0.77 0.00 0.00 58.65 59.28 3fgc h GLN 344 Cb 0.17 -0.16 0.01 0.00 0.21 0.00 0.00 27.48 27.71 3fgc h GLN 344 CO -0.18 0.47 -1.43 0.66 -1.93 0.00 0.00 178.83 176.42 3fgc h SER 345 N 0.73 0.58 0.00 -0.69 4.64 -1.11 -3.35 113.55 114.34 3fgc h SER 345 Ca 0.20 -0.66 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 3fgc h SER 345 Cb -0.07 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.83 3fgc h SER 345 CO -0.05 1.53 -0.29 0.47 -0.87 0.00 0.00 176.83 177.62 3fgc n ASP 346 N -3.58 0.30 0.01 4.97 9.92 -0.20 -4.67 116.55 123.30 3fgc n ASP 346 Ca -0.14 -0.64 -0.03 0.00 -0.53 0.00 0.00 54.79 53.45 3fgc n ASP 346 Cb 1.06 1.00 -0.01 0.00 -0.64 0.00 0.00 41.12 42.53 3fgc n ASP 346 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 3fgc n VAL 347 N -1.14 1.18 -0.34 2.53 0.31 -0.27 -4.75 118.33 115.84 3fgc n VAL 347 Ca 0.01 0.29 0.03 0.00 -0.01 0.00 0.00 64.34 64.66 3fgc n VAL 347 Cb 0.09 -1.74 0.11 0.00 -0.91 0.00 0.00 33.84 31.39 3fgc n VAL 347 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 3fgc h MET 348 N -0.23 -0.01 0.00 5.55 2.86 -1.09 -0.91 114.93 121.10 3fgc h MET 348 Ca -0.02 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 3fgc h MET 348 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.02 3fgc h MET 348 CO -0.01 -0.00 0.00 -1.35 1.06 0.00 0.00 176.91 176.60 3fgc h PRO 349 N -0.01 0.00 -0.01 -0.22 0.11 -1.83 -3.10 132.00 126.93 3fgc h PRO 349 Ca 0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.53 3fgc h PRO 349 Cb 0.66 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.77 3fgc h PRO 349 CO -0.96 0.00 -0.48 0.66 -0.21 0.00 0.00 178.00 177.02 3fgc n TYR 350 N -2.40 0.00 -2.71 0.65 4.01 -0.35 -4.91 117.16 111.45 3fgc n TYR 350 Ca 0.02 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.36 3fgc n TYR 350 Cb 0.25 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.22 3fgc n TYR 350 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 3fgc s LEU 351 N -2.45 4.62 0.07 7.72 1.43 -1.17 -5.06 118.68 123.84 3fgc s LEU 351 Ca 0.18 1.99 0.06 0.00 -1.03 0.00 0.00 54.13 55.33 3fgc s LEU 351 Cb 0.17 -3.63 -0.03 0.00 0.03 0.00 0.00 46.19 42.73 3fgc s LEU 351 CO 0.56 0.11 -0.17 -0.54 0.23 0.00 0.00 176.35 176.54 3fgc s LYS 352 N -1.26 1.01 0.46 1.70 1.02 -1.26 -5.01 119.74 116.40 3fgc s LYS 352 Ca 0.42 -0.97 -0.23 0.00 0.02 0.00 0.00 55.97 55.21 3fgc s LYS 352 Cb -0.26 -1.11 -0.07 0.00 -0.52 0.00 0.00 37.83 35.86 3fgc s LYS 352 CO 0.33 0.26 1.19 -1.21 -0.92 0.00 0.00 175.35 175.00 3fgc s GLU 353 N -1.58 3.73 -0.04 1.68 2.02 -1.26 -4.90 118.70 118.36 3fgc s GLU 353 Ca 0.03 1.85 -0.39 0.00 0.02 0.00 0.00 54.97 56.47 3fgc s GLU 353 Cb -0.09 -2.43 -0.18 0.00 0.10 0.00 0.00 34.13 31.52 3fgc s GLU 353 CO 0.03 -0.60 1.32 1.17 0.02 0.00 0.00 175.26 177.19 3fgc n LYS 354 N -0.46 0.65 0.00 1.61 4.81 -1.26 -5.04 118.16 118.47 3fgc n LYS 354 Ca 0.07 0.24 0.00 0.00 -0.87 0.00 0.00 58.31 57.75 3fgc n LYS 354 Cb 0.47 -1.82 0.00 0.00 0.02 0.00 0.00 35.03 33.70 3fgc n LYS 354 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61