#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d6b s THR 5 N 0.00 3.64 -0.11 0.00 -1.32 -1.26 -5.10 115.64 111.48 3d6b s THR 5 Ca 0.00 -0.42 -0.21 0.00 -1.21 0.00 0.00 61.69 59.85 3d6b s THR 5 Cb 0.00 -2.63 -0.04 0.00 -1.51 0.00 0.00 72.50 68.32 3d6b s THR 5 CO 0.00 0.44 0.59 0.12 -2.21 0.00 0.00 174.62 173.56 3d6b s PHE 6 N 1.06 3.51 -0.48 9.09 2.19 -1.26 -5.05 117.98 127.04 3d6b s PHE 6 Ca 0.01 1.02 -0.14 0.00 0.33 0.00 0.00 56.93 58.16 3d6b s PHE 6 Cb -0.15 -2.69 0.10 0.00 -1.31 0.00 0.00 43.02 38.97 3d6b s PHE 6 CO 0.01 0.07 0.39 -1.01 1.83 0.00 0.00 175.22 176.51 3d6b s HIS 7 N 0.94 3.29 0.43 10.12 3.76 -1.26 -4.96 115.29 127.59 3d6b s HIS 7 Ca 0.31 -1.28 0.12 0.00 -0.15 0.00 0.00 55.06 54.05 3d6b s HIS 7 Cb -0.16 -3.35 0.97 0.00 1.11 0.00 0.00 32.58 31.15 3d6b s HIS 7 CO 0.13 -0.90 2.01 0.11 -0.85 0.00 0.00 174.74 175.24 3d6b h TRP 8 N 8.68 0.46 -0.00 1.40 5.08 -1.96 -1.22 115.95 128.39 3d6b h TRP 8 Ca -0.27 0.01 0.00 0.00 1.08 0.00 0.00 58.89 59.71 3d6b h TRP 8 Cb 1.10 -0.15 0.00 0.00 -3.00 0.00 0.00 29.16 27.10 3d6b h TRP 8 CO 0.66 0.24 -0.40 -0.40 -1.28 0.00 0.00 178.44 177.26 3d6b n ASP 9 N -4.47 0.48 -2.81 0.11 5.75 -1.26 -4.34 116.55 110.00 3d6b n ASP 9 Ca 0.08 -0.21 -0.10 0.00 -0.01 0.00 0.00 54.79 54.54 3d6b n ASP 9 Cb 0.27 0.13 0.05 0.00 -1.03 0.00 0.00 41.12 40.54 3d6b n ASP 9 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 3d6b n ASP 10 N -1.42 -2.21 -0.18 -1.12 2.03 -0.79 -5.04 116.55 107.82 3d6b n ASP 10 Ca 0.06 -3.35 0.07 0.00 0.52 0.00 0.00 54.79 52.09 3d6b n ASP 10 Cb 0.33 1.48 0.36 0.00 -0.72 0.00 0.00 41.12 42.58 3d6b n ASP 10 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3d6b h PRO 11 N 3.63 0.71 -0.60 -0.67 0.11 -1.44 -1.23 132.00 132.51 3d6b h PRO 11 Ca -0.10 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.97 3d6b h PRO 11 Cb 1.03 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3d6b h PRO 11 CO 0.29 0.47 0.00 1.28 -0.21 0.00 0.00 178.00 179.83 3d6b n LEU 12 N -4.48 3.39 -3.76 2.35 4.77 -1.26 -4.79 117.00 113.21 3d6b n LEU 12 Ca 0.11 -1.70 -0.33 0.00 -0.03 0.00 0.00 56.01 54.05 3d6b n LEU 12 Cb 0.24 -0.43 0.03 0.00 -2.33 0.00 0.00 43.42 40.93 3d6b n LEU 12 CO 0.34 0.73 -0.09 0.18 -1.33 0.00 0.00 177.39 177.22 3d6b n LEU 13 N 1.07 -2.28 -0.23 2.23 4.77 -0.46 -4.86 117.00 117.23 3d6b n LEU 13 Ca 0.20 -1.04 0.14 0.00 -0.03 0.00 0.00 56.01 55.27 3d6b n LEU 13 Cb 0.58 -2.17 0.43 0.00 -2.33 0.00 0.00 43.42 39.93 3d6b n LEU 13 CO 0.15 0.48 1.22 0.25 -1.33 0.00 0.00 177.39 178.16 3d6b h LEU 14 N -1.83 0.54 -0.69 2.23 5.85 -1.93 -1.24 115.31 118.24 3d6b h LEU 14 Ca -0.64 0.03 0.15 0.00 0.84 0.00 0.00 57.88 58.26 3d6b h LEU 14 Cb 1.36 -0.07 -0.11 0.00 0.37 0.00 0.00 40.66 42.21 3d6b h LEU 14 CO 0.47 0.27 0.11 -0.78 -0.34 0.00 0.00 178.44 178.17 3d6b h ASP 15 N 0.57 -0.09 0.76 1.25 -0.00 -1.94 0.11 116.42 117.08 3d6b h ASP 15 Ca 0.42 0.15 0.00 0.00 -0.00 0.00 0.00 57.03 57.60 3d6b h ASP 15 Cb 0.80 0.22 0.00 0.00 -0.00 0.00 0.00 39.33 40.35 3d6b h ASP 15 CO -0.17 -0.06 0.00 -0.61 -0.00 0.00 0.00 179.24 178.40 3d6b h GLN 16 N 0.21 0.00 -0.01 0.28 4.15 -1.57 -2.61 115.11 115.56 3d6b h GLN 16 Ca 0.38 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.80 3d6b h GLN 16 Cb 0.63 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.32 3d6b h GLN 16 CO -0.51 0.00 -0.44 1.04 -1.93 0.00 0.00 178.83 176.99 3d6b n GLN 17 N -2.92 0.78 -3.57 1.69 6.02 0.34 -4.91 117.38 114.81 3d6b n GLN 17 Ca 0.00 -0.56 -0.35 0.00 -0.01 0.00 0.00 57.00 56.08 3d6b n GLN 17 Cb 0.24 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 29.96 3d6b n GLN 17 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3d6b s LEU 18 N -2.60 4.37 0.71 1.08 1.43 -0.93 -5.08 118.68 117.65 3d6b s LEU 18 Ca 0.19 0.81 -0.15 0.00 -1.03 0.00 0.00 54.13 53.95 3d6b s LEU 18 Cb 0.18 -2.91 0.03 0.00 0.03 0.00 0.00 46.19 43.52 3d6b s LEU 18 CO 0.60 0.20 1.19 0.00 0.23 0.00 0.00 176.35 178.56 3d6b s ALA 19 N -1.35 2.20 0.22 4.21 0.00 -1.26 -4.81 121.76 120.98 3d6b s ALA 19 Ca 0.31 0.83 -0.08 0.00 0.00 0.00 0.00 51.96 53.02 3d6b s ALA 19 Cb -0.14 -3.44 0.33 0.00 0.00 0.00 0.00 23.12 19.87 3d6b s ALA 19 CO 0.17 -1.73 1.72 -0.44 0.00 0.00 0.00 175.76 175.49 3d6b h ASP 20 N -0.17 0.15 0.22 0.00 3.32 -1.98 0.92 116.42 118.89 3d6b h ASP 20 Ca -0.48 0.10 0.01 0.00 0.02 0.00 0.00 57.03 56.68 3d6b h ASP 20 Cb 1.29 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.91 3d6b h ASP 20 CO 0.51 0.08 -0.28 -0.78 -1.72 0.00 0.00 179.24 177.05 3d6b h ASP 21 N 0.36 -0.77 -0.97 6.45 3.58 -2.01 -2.69 116.42 120.36 3d6b h ASP 21 Ca 0.34 0.08 0.07 0.00 0.42 0.00 0.00 57.03 57.93 3d6b h ASP 21 Cb 0.48 0.27 -0.07 0.00 1.72 0.00 0.00 39.33 41.74 3d6b h ASP 21 CO -0.37 -0.39 0.62 -0.33 -2.88 0.00 0.00 179.24 175.89 3d6b h GLU 22 N -0.56 1.10 0.00 0.28 5.08 -1.85 -2.78 114.58 115.85 3d6b h GLU 22 Ca 0.00 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 3d6b h GLU 22 Cb 0.54 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 3d6b h GLU 22 CO -0.10 0.73 -0.24 0.00 -1.00 0.00 0.00 179.01 178.40 3d6b h ARG 23 N 1.13 0.00 0.14 2.33 3.08 -0.57 -2.42 114.38 118.07 3d6b h ARG 23 Ca 0.42 0.00 -0.29 0.00 0.07 0.00 0.00 59.98 60.19 3d6b h ARG 23 Cb 0.17 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.23 3d6b h ARG 23 CO -0.17 0.24 -1.30 0.00 -1.07 0.00 0.00 179.97 177.66 3d6b h MET 24 N 0.00 0.30 -0.94 0.04 -0.00 -1.21 -3.07 114.93 110.04 3d6b h MET 24 Ca -0.00 -0.51 -0.01 0.00 -0.00 0.00 0.00 59.70 59.18 3d6b h MET 24 Cb 0.45 0.19 -0.05 0.00 -0.00 0.00 0.00 31.60 32.20 3d6b h MET 24 CO 0.03 1.23 0.56 0.28 -0.00 0.00 0.00 176.91 179.02 3d6b h VAL 25 N 0.08 1.26 -0.29 -0.10 2.07 -1.34 0.21 116.25 118.14 3d6b h VAL 25 Ca -0.16 -0.57 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 3d6b h VAL 25 Cb 2.00 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 31.69 3d6b h VAL 25 CO 0.21 0.27 0.09 -0.09 0.02 0.00 0.00 177.57 178.07 3d6b h ARG 26 N 1.30 0.45 0.00 1.57 2.43 -1.54 -0.95 114.38 117.65 3d6b h ARG 26 Ca 0.34 -0.10 -0.04 0.00 -0.81 0.00 0.00 59.98 59.37 3d6b h ARG 26 Cb -0.05 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.43 3d6b h ARG 26 CO -0.06 0.51 -0.19 -0.44 -1.51 0.00 0.00 179.97 178.28 3d6b h ASP 27 N 0.31 0.00 -0.06 -3.80 3.32 -1.38 0.40 116.42 115.20 3d6b h ASP 27 Ca 0.09 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 57.07 3d6b h ASP 27 Cb 0.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.81 3d6b h ASP 27 CO -0.00 0.19 -0.23 0.00 -1.72 0.00 0.00 179.24 177.48 3d6b h ALA 28 N 1.81 0.11 -0.09 3.45 0.00 -0.31 -1.03 119.26 123.19 3d6b h ALA 28 Ca -0.00 -0.40 -0.10 0.00 0.00 0.00 0.00 54.91 54.41 3d6b h ALA 28 Cb 0.63 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3d6b h ALA 28 CO 0.03 0.10 -0.39 0.00 0.00 0.00 0.00 179.25 178.98 3d6b h ALA 29 N 0.43 1.18 -0.04 0.00 0.00 -1.06 -2.17 119.26 117.60 3d6b h ALA 29 Ca -0.01 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 3d6b h ALA 29 Cb 0.87 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3d6b h ALA 29 CO 0.05 0.56 0.00 1.25 0.00 0.00 0.00 179.25 181.11 3d6b h HIS 30 N 0.16 0.07 -0.78 0.00 6.17 -0.94 -0.26 115.15 119.58 3d6b h HIS 30 Ca 0.02 -0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.08 3d6b h HIS 30 Cb 0.77 -0.02 -0.04 0.00 2.52 0.00 0.00 27.41 30.64 3d6b h HIS 30 CO 0.01 0.35 0.48 0.00 0.71 0.00 0.00 177.93 179.48 3d6b h ALA 31 N 0.71 0.99 0.29 5.26 0.00 -1.15 -0.72 119.26 124.64 3d6b h ALA 31 Ca 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3d6b h ALA 31 Cb 0.32 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.80 3d6b h ALA 31 CO 0.00 0.45 -0.14 -0.92 0.00 0.00 0.00 179.25 178.64 3d6b h TYR 32 N 1.06 -0.36 -0.29 0.00 5.03 -1.40 -0.43 116.97 120.58 3d6b h TYR 32 Ca 0.28 -0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.60 3d6b h TYR 32 Cb -0.05 0.12 -0.02 0.00 1.55 0.00 0.00 36.73 38.32 3d6b h TYR 32 CO -0.01 -0.15 0.15 0.00 -1.32 0.00 0.00 178.16 176.83 3d6b h ALA 33 N 0.17 0.36 -0.05 1.82 0.00 -0.88 0.33 119.26 121.01 3d6b h ALA 33 Ca -0.04 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.74 3d6b h ALA 33 Cb 0.38 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3d6b h ALA 33 CO 0.07 -0.24 -0.58 1.96 0.00 0.00 0.00 179.25 180.46 3d6b h GLN 34 N 0.31 0.17 0.04 0.00 1.08 -1.20 -0.38 115.11 115.12 3d6b h GLN 34 Ca 0.12 -0.11 -0.07 0.00 -1.45 0.00 0.00 58.65 57.14 3d6b h GLN 34 Cb 0.04 0.01 0.01 0.00 -0.05 0.00 0.00 27.48 27.49 3d6b h GLN 34 CO -0.08 0.70 -0.30 0.78 -0.95 0.00 0.00 178.83 178.98 3d6b h GLY 35 N 1.53 0.15 0.00 3.46 0.00 -0.53 -3.36 103.07 104.32 3d6b h GLY 35 Ca -0.00 -0.34 -0.31 0.00 0.00 0.00 0.00 47.33 46.67 3d6b h GLY 35 CO 0.08 0.30 -2.17 0.28 0.00 0.00 0.00 176.54 175.03 3d6b n LYS 36 N -4.45 0.99 0.01 4.80 4.76 0.11 -4.64 118.16 119.74 3d6b n LYS 36 Ca -0.11 0.04 -0.22 0.00 -2.87 0.00 0.00 58.31 55.16 3d6b n LYS 36 Cb 0.58 -1.43 -0.14 0.00 -1.84 0.00 0.00 35.03 32.20 3d6b n LYS 36 CO 0.00 0.00 0.00 -0.07 -1.37 0.00 0.00 177.40 175.96 3d6b h LEU 37 N 0.00 0.42 -0.68 -0.35 3.38 -1.33 -3.35 115.31 113.40 3d6b h LEU 37 Ca -0.46 -0.89 0.04 0.00 0.09 0.00 0.00 57.88 56.65 3d6b h LEU 37 Cb 1.91 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 42.48 3d6b h LEU 37 CO -0.01 1.77 0.42 0.00 0.09 0.00 0.00 178.44 180.70 3d6b h ALA 38 N 0.00 0.90 0.00 1.53 0.00 -1.26 -1.32 119.26 119.11 3d6b h ALA 38 Ca -0.38 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3d6b h ALA 38 Cb 1.93 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 19.52 3d6b h ALA 38 CO 0.07 0.17 0.00 -1.35 0.00 0.00 0.00 179.25 178.14 3d6b h PRO 39 N 0.81 0.00 0.05 0.00 0.11 -1.78 -3.18 132.00 128.01 3d6b h PRO 39 Ca 0.28 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 66.10 3d6b h PRO 39 Cb 0.05 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.13 3d6b h PRO 39 CO -0.12 0.00 -1.53 0.00 -0.21 0.00 0.00 178.00 176.14 3d6b h ARG 40 N 0.00 0.11 -0.72 1.05 3.08 -1.40 -3.43 114.38 113.08 3d6b h ARG 40 Ca 0.00 -0.19 -0.05 0.00 0.07 0.00 0.00 59.98 59.81 3d6b h ARG 40 Cb 0.40 0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.49 3d6b h ARG 40 CO 0.00 0.88 0.27 -0.24 -1.07 0.00 0.00 179.97 179.80 3d6b h VAL 41 N 0.03 1.25 0.02 2.04 3.04 -1.31 -2.47 116.25 118.85 3d6b h VAL 41 Ca -0.23 -0.82 0.00 0.00 -1.01 0.00 0.00 66.70 64.64 3d6b h VAL 41 Cb 1.97 0.44 -0.00 0.00 -2.01 0.00 0.00 31.29 31.69 3d6b h VAL 41 CO 0.12 0.33 -0.02 0.74 -1.01 0.00 0.00 177.57 177.73 3d6b h THR 42 N 1.04 0.96 -0.17 3.17 2.02 -1.82 -0.01 112.91 118.09 3d6b h THR 42 Ca 0.24 0.00 -0.17 0.00 0.77 0.00 0.00 66.41 67.25 3d6b h THR 42 Cb 0.24 0.96 -0.00 0.00 -1.74 0.00 0.00 68.15 67.61 3d6b h THR 42 CO -0.02 0.00 -0.59 -0.33 0.37 0.00 0.00 175.52 174.95 3d6b h GLU 43 N -0.04 0.55 -0.32 6.66 4.39 -1.88 -1.83 114.58 122.11 3d6b h GLU 43 Ca 0.00 -0.37 0.00 0.00 0.34 0.00 0.00 59.36 59.33 3d6b h GLU 43 Cb 0.04 0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.73 3d6b h GLU 43 CO -0.01 0.98 0.21 0.00 -1.16 0.00 0.00 179.01 179.03 3d6b h ALA 44 N 0.93 0.40 -0.17 3.43 0.00 -1.16 -1.55 119.26 121.16 3d6b h ALA 44 Ca -0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 3d6b h ALA 44 Cb 1.15 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.81 3d6b h ALA 44 CO 0.11 -0.12 -0.03 0.35 0.00 0.00 0.00 179.25 179.56 3d6b h PHE 45 N 0.43 0.35 -0.59 0.00 3.57 -1.02 0.90 116.94 120.57 3d6b h PHE 45 Ca 0.12 -0.07 0.10 0.00 3.53 0.00 0.00 57.97 61.65 3d6b h PHE 45 Cb -0.03 -0.09 -0.11 0.00 2.79 0.00 0.00 35.95 38.51 3d6b h PHE 45 CO -0.05 0.57 -0.34 -0.09 -2.23 0.00 0.00 178.31 176.17 3d6b h ARG 46 N 0.03 -0.16 -0.29 1.11 2.43 -1.20 -3.03 114.38 113.27 3d6b h ARG 46 Ca 0.04 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3d6b h ARG 46 Cb 0.45 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 30.04 3d6b h ARG 46 CO 0.01 -0.10 0.00 0.72 -1.51 0.00 0.00 179.97 179.09 3d6b n HIS 47 N -5.43 0.38 -3.76 2.20 8.25 -0.60 -4.97 115.22 111.29 3d6b n HIS 47 Ca 0.04 -0.28 -0.27 0.00 -0.26 0.00 0.00 57.72 56.95 3d6b n HIS 47 Cb 0.36 -0.01 0.05 0.00 1.12 0.00 0.00 29.99 31.51 3d6b n HIS 47 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 3d6b n GLU 48 N 0.93 -6.74 -2.62 -0.41 2.13 0.24 -4.93 120.64 109.24 3d6b n GLU 48 Ca 0.13 0.71 -0.38 0.00 0.66 0.00 0.00 57.16 58.29 3d6b n GLU 48 Cb 0.46 -5.69 -0.05 0.00 0.27 0.00 0.00 31.44 26.43 3d6b n GLU 48 CO 0.00 0.00 0.00 -0.08 -0.41 0.00 0.00 177.13 176.64 3d6b s THR 49 N -3.31 3.86 -0.15 6.31 -1.32 -0.78 -4.97 115.64 115.27 3d6b s THR 49 Ca 0.62 1.59 -0.23 0.00 -1.21 0.00 0.00 61.69 62.46 3d6b s THR 49 Cb -0.29 -3.90 -0.02 0.00 -1.51 0.00 0.00 72.50 66.77 3d6b s THR 49 CO 0.78 0.17 0.71 -0.89 -2.21 0.00 0.00 174.62 173.18 3d6b s THR 50 N -1.50 4.99 -0.38 5.08 2.01 -1.26 -4.86 115.64 119.72 3d6b s THR 50 Ca 0.51 1.39 0.01 0.00 0.31 0.00 0.00 61.69 63.91 3d6b s THR 50 Cb -0.23 -4.03 0.14 0.00 0.01 0.00 0.00 72.50 68.39 3d6b s THR 50 CO 0.30 0.12 0.23 -0.62 -0.69 0.00 0.00 174.62 173.95 3d6b s ASP 51 N 1.07 3.07 0.00 3.53 2.15 -1.26 -4.98 116.67 120.25 3d6b s ASP 51 Ca 0.34 -2.34 0.19 0.00 0.43 0.00 0.00 52.55 51.17 3d6b s ASP 51 Cb -0.16 -0.56 0.99 0.00 -0.30 0.00 0.00 42.92 42.89 3d6b s ASP 51 CO 0.13 -0.29 1.60 0.00 -0.17 0.00 0.00 175.17 176.43 3d6b n ALA 52 N 3.85 2.04 0.28 3.66 0.00 -1.26 -3.35 120.51 125.74 3d6b n ALA 52 Ca 0.12 -0.09 0.16 0.00 0.00 0.00 0.00 53.44 53.63 3d6b n ALA 52 Cb 0.37 -1.31 0.92 0.00 0.00 0.00 0.00 19.45 19.43 3d6b n ALA 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d6b h ALA 53 N 2.94 1.54 -0.57 0.00 0.00 -1.99 -2.25 119.26 118.92 3d6b h ALA 53 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 3d6b h ALA 53 Cb 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 3d6b h ALA 53 CO 0.00 -0.06 0.25 0.82 0.00 0.00 0.00 179.25 180.26 3d6b h ILE 54 N 0.00 1.20 -0.17 0.00 2.04 -1.98 0.10 117.51 118.69 3d6b h ILE 54 Ca 0.02 -0.59 -0.02 0.00 1.00 0.00 0.00 64.86 65.27 3d6b h ILE 54 Cb 0.10 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.67 3d6b h ILE 54 CO -0.00 0.24 0.04 -0.26 0.00 0.00 0.00 178.15 178.17 3d6b h PHE 55 N 0.81 0.30 -0.50 1.37 0.04 -1.68 0.25 116.94 117.52 3d6b h PHE 55 Ca 0.20 -0.04 0.09 0.00 2.80 0.00 0.00 57.97 61.02 3d6b h PHE 55 Cb 0.12 -0.08 -0.07 0.00 2.20 0.00 0.00 35.95 38.12 3d6b h PHE 55 CO 0.01 0.42 0.08 -0.09 -0.60 0.00 0.00 178.31 178.14 3d6b h ARG 56 N 0.09 0.21 -0.22 1.51 2.43 -1.53 -0.25 114.38 116.62 3d6b h ARG 56 Ca 0.05 -0.01 -0.14 0.00 -0.81 0.00 0.00 59.98 59.07 3d6b h ARG 56 Cb 0.28 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 3d6b h ARG 56 CO 0.00 0.14 -0.43 0.93 -1.51 0.00 0.00 179.97 179.11 3d6b h GLU 57 N 0.22 0.67 -0.21 0.20 5.08 -0.77 0.18 114.58 119.95 3d6b h GLU 57 Ca 0.25 -0.43 -0.16 0.00 -1.00 0.00 0.00 59.36 58.02 3d6b h GLU 57 Cb 0.34 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 3d6b h GLU 57 CO -0.34 1.05 -0.52 0.52 -1.00 0.00 0.00 179.01 178.73 3d6b h MET 58 N 0.38 0.59 -0.07 2.33 2.86 -0.95 -3.11 114.93 116.95 3d6b h MET 58 Ca 0.01 -0.36 -0.00 0.00 -2.06 0.00 0.00 59.70 57.29 3d6b h MET 58 Cb 1.03 0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.72 3d6b h MET 58 CO 0.09 0.96 0.03 0.78 1.06 0.00 0.00 176.91 179.83 3d6b h GLY 59 N 1.03 0.11 -0.76 8.32 0.00 -0.99 -1.09 103.07 109.70 3d6b h GLY 59 Ca 0.02 -0.06 0.28 0.00 0.00 0.00 0.00 47.33 47.57 3d6b h GLY 59 CO 0.10 0.06 0.21 -2.09 0.00 0.00 0.00 176.54 174.82 3d6b h GLU 60 N -0.06 0.09 -0.59 4.80 4.81 -0.93 -1.81 114.58 120.88 3d6b h GLU 60 Ca 0.02 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 3d6b h GLU 60 Cb 0.18 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.54 3d6b h GLU 60 CO -0.00 0.06 0.00 0.44 -0.73 0.00 0.00 179.01 178.78 3d6b n ILE 61 N -5.33 1.06 -2.52 2.32 -5.35 -1.13 -4.98 119.36 103.42 3d6b n ILE 61 Ca 0.25 -1.02 -0.06 0.00 -0.27 0.00 0.00 62.75 61.65 3d6b n ILE 61 Cb 0.83 0.47 0.01 0.00 -1.74 0.00 0.00 39.64 39.21 3d6b n ILE 61 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3d6b n GLY 62 N 1.21 0.41 1.06 3.28 0.00 -0.68 -4.96 105.19 105.50 3d6b n GLY 62 Ca 0.20 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 45.82 3d6b n GLY 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3d6b n LEU 63 N -1.32 3.23 -4.66 0.99 4.77 -0.46 -4.62 117.00 114.93 3d6b n LEU 63 Ca -0.02 -1.26 -0.35 0.00 -0.03 0.00 0.00 56.01 54.35 3d6b n LEU 63 Cb 0.53 -0.13 -0.09 0.00 -2.33 0.00 0.00 43.42 41.40 3d6b n LEU 63 CO 0.13 0.63 -0.24 -0.76 -1.33 0.00 0.00 177.39 175.81 3d6b s LEU 64 N -1.72 3.87 -1.11 2.23 1.43 -1.26 -4.48 118.68 117.65 3d6b s LEU 64 Ca 0.33 0.12 -0.19 0.00 -1.03 0.00 0.00 54.13 53.37 3d6b s LEU 64 Cb 0.21 -1.97 -0.01 0.00 0.03 0.00 0.00 46.19 44.45 3d6b s LEU 64 CO 0.31 0.20 0.80 0.61 0.23 0.00 0.00 176.35 178.50 3d6b n GLY 65 N 3.33 -1.02 0.21 -3.19 0.00 -1.26 -4.70 105.19 98.56 3d6b n GLY 65 Ca -0.17 0.47 0.15 0.00 0.00 0.00 0.00 46.02 46.47 3d6b n GLY 65 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d6b h PRO 66 N -1.73 0.00 0.00 1.61 0.13 -1.88 -1.66 132.00 128.47 3d6b h PRO 66 Ca -0.64 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 3d6b h PRO 66 Cb 1.35 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.48 3d6b h PRO 66 CO 0.47 0.00 -0.56 0.25 -0.23 0.00 0.00 178.00 177.93 3d6b n THR 67 N -2.74 0.16 -1.87 1.56 -2.24 -1.25 0.08 114.28 107.97 3d6b n THR 67 Ca 0.02 -0.13 -0.42 0.00 -2.27 0.00 0.00 64.05 61.25 3d6b n THR 67 Cb 0.30 0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.55 3d6b n THR 67 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 3d6b s ILE 68 N -3.08 2.47 0.42 2.28 -1.09 -0.62 -4.49 121.20 117.08 3d6b s ILE 68 Ca 0.09 0.32 -0.26 0.00 -2.23 0.00 0.00 60.65 58.57 3d6b s ILE 68 Cb 0.16 -3.21 -0.10 0.00 -1.58 0.00 0.00 42.46 37.73 3d6b s ILE 68 CO 0.71 0.02 1.35 -2.65 -1.23 0.00 0.00 174.94 173.14 3d6b n PRO 69 N 4.05 2.14 -0.03 2.79 -0.02 -1.26 -0.90 135.00 141.76 3d6b n PRO 69 Ca 0.15 0.76 0.24 0.00 -2.02 0.00 0.00 63.50 62.62 3d6b n PRO 69 Cb 0.38 -2.49 0.71 0.00 -0.02 0.00 0.00 33.50 32.08 3d6b n PRO 69 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3d6b h GLU 70 N 2.30 0.00 -0.33 -0.52 5.08 -1.83 0.35 114.58 119.62 3d6b h GLU 70 Ca -0.49 0.00 0.10 0.00 -1.00 0.00 0.00 59.36 57.97 3d6b h GLU 70 Cb 1.28 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 3d6b h GLU 70 CO 0.61 0.00 0.32 0.37 -1.00 0.00 0.00 179.01 179.30 3d6b h GLN 71 N 0.00 0.00 -0.13 2.33 4.15 -1.90 -2.55 115.11 117.01 3d6b h GLN 71 Ca 0.30 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.72 3d6b h GLN 71 Cb 1.45 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.14 3d6b h GLN 71 CO -0.00 0.00 0.00 0.66 -1.93 0.00 0.00 178.83 177.56 3d6b n TYR 72 N -3.92 0.35 0.00 3.99 4.01 0.10 -4.94 117.16 116.75 3d6b n TYR 72 Ca 0.05 -0.78 0.00 0.00 -0.16 0.00 0.00 57.90 57.01 3d6b n TYR 72 Cb 0.48 -0.16 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 3d6b n TYR 72 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3d6b n GLY 73 N -0.66 0.33 3.84 2.72 0.00 -0.96 -2.21 105.19 108.25 3d6b n GLY 73 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 3d6b n GLY 73 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d6b s GLY 74 N -2.08 1.68 0.00 -0.02 0.00 -1.17 -4.82 107.32 100.92 3d6b s GLY 74 Ca 0.00 0.01 0.29 0.00 0.00 0.00 0.00 44.72 45.02 3d6b s GLY 74 CO 0.00 0.30 2.02 -1.55 0.00 0.00 0.00 173.10 173.87 3d6b n PRO 75 N -2.89 0.54 -2.41 2.90 -0.04 -1.21 -3.08 135.00 128.81 3d6b n PRO 75 Ca 0.07 0.01 -0.16 0.00 -0.04 0.00 0.00 63.50 63.38 3d6b n PRO 75 Cb 0.54 -1.50 -0.00 0.00 -0.04 0.00 0.00 33.50 32.50 3d6b n PRO 75 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3d6b n GLY 76 N 1.07 -0.27 3.93 0.55 0.00 -0.08 -4.74 105.19 105.66 3d6b n GLY 76 Ca 0.16 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.73 3d6b n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d6b s LEU 77 N -4.68 3.02 0.00 0.99 1.43 0.11 -4.90 118.68 114.65 3d6b s LEU 77 Ca 0.05 0.49 0.03 0.00 -1.03 0.00 0.00 54.13 53.67 3d6b s LEU 77 Cb -0.02 -3.22 0.06 0.00 0.03 0.00 0.00 46.19 43.04 3d6b s LEU 77 CO 0.06 -1.36 0.48 -0.90 0.23 0.00 0.00 176.35 174.86 3d6b n ASP 78 N -2.73 0.98 -0.01 2.29 5.68 -1.26 -3.92 116.55 117.58 3d6b n ASP 78 Ca 0.07 -1.75 -0.11 0.00 -0.50 0.00 0.00 54.79 52.50 3d6b n ASP 78 Cb 0.59 -0.28 0.02 0.00 -1.14 0.00 0.00 41.12 40.31 3d6b n ASP 78 CO 0.00 0.00 0.00 1.88 -1.33 0.00 0.00 177.20 177.75 3d6b h TYR 79 N -0.17 0.79 -0.84 2.11 0.05 -1.96 -2.03 116.97 114.93 3d6b h TYR 79 Ca -0.16 -0.30 0.06 0.00 0.05 0.00 0.00 58.73 58.38 3d6b h TYR 79 Cb 0.67 -0.14 -0.06 0.00 1.01 0.00 0.00 36.73 38.21 3d6b h TYR 79 CO 0.00 1.07 0.52 0.28 -1.05 0.00 0.00 178.16 178.98 3d6b h VAL 80 N 0.46 1.05 -0.39 -2.88 2.07 -1.93 -1.32 116.25 113.31 3d6b h VAL 80 Ca -0.01 -0.33 -0.09 0.00 0.82 0.00 0.00 66.70 67.10 3d6b h VAL 80 Cb 1.18 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 3d6b h VAL 80 CO 0.12 0.18 -0.09 0.28 0.02 0.00 0.00 177.57 178.07 3d6b h SER 81 N 0.96 0.75 -0.49 0.57 0.02 -1.88 -1.44 113.55 112.05 3d6b h SER 81 Ca 0.36 -0.36 0.06 0.00 -0.84 0.00 0.00 61.79 61.01 3d6b h SER 81 Cb 0.14 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 62.43 3d6b h SER 81 CO -0.16 0.94 0.20 0.22 -1.14 0.00 0.00 176.83 176.89 3d6b h TYR 82 N 0.56 0.36 -0.55 3.45 -0.00 -1.02 -2.48 116.97 117.29 3d6b h TYR 82 Ca 0.10 0.02 -0.04 0.00 -0.00 0.00 0.00 58.73 58.81 3d6b h TYR 82 Cb 0.61 -0.09 -0.02 0.00 -0.00 0.00 0.00 36.73 37.22 3d6b h TYR 82 CO 0.05 0.14 0.17 0.78 -0.00 0.00 0.00 178.16 179.30 3d6b h GLY 83 N 0.40 0.92 1.13 1.82 0.00 -1.08 -2.20 103.07 104.05 3d6b h GLY 83 Ca 0.23 -0.54 0.06 0.00 0.00 0.00 0.00 47.33 47.07 3d6b h GLY 83 CO -0.20 0.51 0.44 1.41 0.00 0.00 0.00 176.54 178.69 3d6b h LEU 84 N 0.76 0.60 0.60 3.11 3.38 -1.05 -0.50 115.31 122.21 3d6b h LEU 84 Ca 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.12 3d6b h LEU 84 Cb 0.28 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.91 3d6b h LEU 84 CO -0.01 0.40 -0.29 0.40 0.09 0.00 0.00 178.44 179.04 3d6b h ILE 85 N 0.69 0.04 -0.78 1.22 2.04 -1.22 -1.72 117.51 117.79 3d6b h ILE 85 Ca 0.28 -0.41 0.18 0.00 1.00 0.00 0.00 64.86 65.91 3d6b h ILE 85 Cb 0.23 0.06 -0.13 0.00 -0.74 0.00 0.00 36.82 36.25 3d6b h ILE 85 CO -0.09 0.01 0.13 0.00 0.00 0.00 0.00 178.15 178.20 3d6b h ALA 86 N -1.17 0.98 -0.76 1.87 0.00 -1.15 -0.14 119.26 118.88 3d6b h ALA 86 Ca -0.08 0.21 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3d6b h ALA 86 Cb 0.63 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 3d6b h ALA 86 CO 0.13 -0.40 0.29 -0.09 0.00 0.00 0.00 179.25 179.18 3d6b h ARG 87 N 0.19 1.14 -0.38 0.00 2.43 -1.13 0.14 114.38 116.76 3d6b h ARG 87 Ca 0.45 -0.21 -0.13 0.00 -0.81 0.00 0.00 59.98 59.28 3d6b h ARG 87 Cb 0.82 -0.18 -0.01 0.00 -0.42 0.00 0.00 29.97 30.18 3d6b h ARG 87 CO -0.61 0.94 -0.29 0.93 -1.51 0.00 0.00 179.97 179.43 3d6b h GLU 88 N 1.11 0.82 -0.04 0.20 4.39 -0.20 -2.04 114.58 118.82 3d6b h GLU 88 Ca 0.25 -0.37 -0.03 0.00 0.34 0.00 0.00 59.36 59.55 3d6b h GLU 88 Cb 0.24 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 3d6b h GLU 88 CO -0.02 1.00 -0.09 0.28 -1.16 0.00 0.00 179.01 179.02 3d6b h VAL 89 N 0.70 1.44 0.00 3.13 2.07 -0.88 -3.22 116.25 119.48 3d6b h VAL 89 Ca 0.08 -1.44 -0.04 0.00 0.82 0.00 0.00 66.70 66.12 3d6b h VAL 89 Cb 0.83 2.29 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 3d6b h VAL 89 CO 0.07 0.39 -0.21 -0.08 0.02 0.00 0.00 177.57 177.76 3d6b h GLU 90 N -0.39 0.00 -1.02 1.57 4.81 -0.81 -1.69 114.58 117.05 3d6b h GLU 90 Ca 0.00 0.00 0.28 0.00 -0.13 0.00 0.00 59.36 59.51 3d6b h GLU 90 Cb 0.68 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.00 3d6b h GLU 90 CO 0.02 0.21 0.70 -0.09 -0.73 0.00 0.00 179.01 179.12 3d6b h ARG 91 N 0.00 0.16 0.00 1.92 2.43 -1.37 -2.11 114.38 115.41 3d6b h ARG 91 Ca -0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3d6b h ARG 91 Cb 0.38 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 29.90 3d6b h ARG 91 CO 0.03 0.11 -0.22 0.28 -1.51 0.00 0.00 179.97 178.65 3d6b h VAL 92 N 0.17 0.07 -2.20 0.20 2.07 -1.42 -3.44 116.25 111.71 3d6b h VAL 92 Ca 0.52 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 3d6b h VAL 92 Cb 1.73 0.14 -0.22 0.00 -1.52 0.00 0.00 31.29 31.42 3d6b h VAL 92 CO -0.11 0.02 -0.02 -0.62 0.02 0.00 0.00 177.57 176.87 3d6b s ASP 93 N -5.67 -0.74 0.37 0.57 -1.08 -0.79 -4.99 116.67 104.34 3d6b s ASP 93 Ca -0.07 1.31 0.04 0.00 -0.52 0.00 0.00 52.55 53.31 3d6b s ASP 93 Cb 0.01 1.26 0.72 0.00 -1.46 0.00 0.00 42.92 43.45 3d6b s ASP 93 CO 0.12 -0.22 2.02 0.28 0.52 0.00 0.00 175.17 177.88 3d6b h SER 94 N 6.01 0.60 -0.84 -0.34 0.02 -1.84 -2.77 113.55 114.40 3d6b h SER 94 Ca -0.30 -0.03 -0.02 0.00 -0.84 0.00 0.00 61.79 60.61 3d6b h SER 94 Cb 1.19 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 63.54 3d6b h SER 94 CO 0.15 0.46 0.45 1.23 -1.14 0.00 0.00 176.83 177.98 3d6b h GLY 95 N 0.73 1.25 0.95 -3.77 0.00 -1.94 -0.54 103.07 99.75 3d6b h GLY 95 Ca 0.18 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 3d6b h GLY 95 CO -0.04 0.55 -0.02 -0.97 0.00 0.00 0.00 176.54 176.07 3d6b h TYR 96 N 1.17 -0.04 -0.67 5.60 0.99 -1.80 -2.58 116.97 119.64 3d6b h TYR 96 Ca 0.29 -0.00 0.03 0.00 2.00 0.00 0.00 58.73 61.06 3d6b h TYR 96 Cb 0.04 0.01 -0.04 0.00 1.00 0.00 0.00 36.73 37.74 3d6b h TYR 96 CO 0.01 0.02 0.44 -0.09 -0.00 0.00 0.00 178.16 178.54 3d6b h ARG 97 N -0.10 0.77 -0.21 4.88 1.12 -1.26 -2.42 114.38 117.17 3d6b h ARG 97 Ca -0.00 -0.05 -0.01 0.00 -1.11 0.00 0.00 59.98 58.81 3d6b h ARG 97 Cb 0.09 -0.17 -0.01 0.00 -0.01 0.00 0.00 29.97 29.86 3d6b h ARG 97 CO 0.01 0.51 0.09 1.03 -3.11 0.00 0.00 179.97 178.50 3d6b h SER 98 N 0.79 0.28 -0.52 -3.80 0.87 -0.90 0.63 113.55 110.91 3d6b h SER 98 Ca 0.27 -0.15 0.07 0.00 -1.23 0.00 0.00 61.79 60.75 3d6b h SER 98 Cb 0.08 -0.07 -0.06 0.00 -0.44 0.00 0.00 62.40 61.91 3d6b h SER 98 CO -0.07 0.35 0.20 0.24 -0.53 0.00 0.00 176.83 177.01 3d6b h MET 99 N 0.19 0.37 -0.17 2.24 2.86 -1.05 -1.89 114.93 117.48 3d6b h MET 99 Ca 0.07 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.68 3d6b h MET 99 Cb 0.15 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 3d6b h MET 99 CO -0.01 0.25 0.06 1.98 1.06 0.00 0.00 176.91 180.25 3d6b h MET 100 N 0.38 0.26 0.00 1.72 1.85 -1.22 -2.81 114.93 115.11 3d6b h MET 100 Ca 0.25 -0.05 -0.01 0.00 -0.61 0.00 0.00 59.70 59.28 3d6b h MET 100 Cb 0.26 -0.04 -0.00 0.00 0.43 0.00 0.00 31.60 32.25 3d6b h MET 100 CO -0.24 0.34 -0.05 0.66 -0.40 0.00 0.00 176.91 177.22 3d6b h SER 101 N 0.12 0.00 0.20 1.39 4.64 -0.70 0.51 113.55 119.71 3d6b h SER 101 Ca 0.06 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.37 3d6b h SER 101 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 3d6b h SER 101 CO -0.00 0.05 -0.10 0.58 -0.87 0.00 0.00 176.83 176.49 3d6b h VAL 102 N 0.00 0.89 0.09 0.95 2.07 -1.32 -0.93 116.25 118.00 3d6b h VAL 102 Ca -0.00 -0.60 0.02 0.00 0.82 0.00 0.00 66.70 66.95 3d6b h VAL 102 Cb 0.72 1.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.69 3d6b h VAL 102 CO 0.01 0.13 -0.28 1.56 0.02 0.00 0.00 177.57 179.01 3d6b h GLN 103 N -0.57 -0.46 0.28 1.57 1.08 -1.13 -0.67 115.11 115.22 3d6b h GLN 103 Ca -0.03 0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.19 3d6b h GLN 103 Cb 0.42 0.10 0.00 0.00 -0.05 0.00 0.00 27.48 27.96 3d6b h GLN 103 CO 0.04 -0.31 -0.14 0.77 -0.95 0.00 0.00 178.83 178.25 3d6b h SER 104 N -0.48 -0.32 0.35 1.46 0.02 -1.01 -0.64 113.55 112.93 3d6b h SER 104 Ca 0.04 -0.20 -0.32 0.00 -0.84 0.00 0.00 61.79 60.47 3d6b h SER 104 Cb 0.52 0.08 -0.05 0.00 0.14 0.00 0.00 62.40 63.09 3d6b h SER 104 CO -0.18 0.15 -1.88 -1.20 -1.14 0.00 0.00 176.83 172.58 3d6b n SER 105 N -5.04 0.93 -0.08 3.07 7.64 -0.37 -2.23 113.62 117.54 3d6b n SER 105 Ca -0.08 0.30 0.08 0.00 1.01 0.00 0.00 58.87 60.19 3d6b n SER 105 Cb 0.25 -0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.37 3d6b n SER 105 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3d6b n LEU 106 N -3.06 1.01 0.06 -3.43 4.77 -0.71 -4.31 117.00 111.33 3d6b n LEU 106 Ca -0.22 -0.55 0.00 0.00 -0.03 0.00 0.00 56.01 55.21 3d6b n LEU 106 Cb 1.07 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.16 3d6b n LEU 106 CO 0.44 0.23 -0.07 0.52 -1.33 0.00 0.00 177.39 177.18 3d6b n VAL 107 N -1.17 0.79 0.16 4.08 0.31 -0.34 -4.61 118.33 117.54 3d6b n VAL 107 Ca 0.04 0.26 0.01 0.00 -0.01 0.00 0.00 64.34 64.64 3d6b n VAL 107 Cb 0.30 -1.33 0.25 0.00 -0.91 0.00 0.00 33.84 32.15 3d6b n VAL 107 CO 0.00 0.00 0.00 0.24 -1.32 0.00 0.00 176.83 175.75 3d6b h MET 108 N 0.00 0.00 0.05 5.55 2.86 -1.16 -2.89 114.93 119.33 3d6b h MET 108 Ca 0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3d6b h MET 108 Cb 0.14 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.80 3d6b h MET 108 CO 0.00 0.52 -0.02 0.28 1.06 0.00 0.00 176.91 178.74 3d6b h VAL 109 N 0.00 1.30 -0.70 -2.22 2.07 -1.63 -1.80 116.25 113.26 3d6b h VAL 109 Ca -0.01 -1.26 -0.00 0.00 0.82 0.00 0.00 66.70 66.25 3d6b h VAL 109 Cb 0.96 2.11 -0.03 0.00 -1.52 0.00 0.00 31.29 32.81 3d6b h VAL 109 CO 0.07 0.31 0.42 1.55 0.02 0.00 0.00 177.57 179.94 3d6b h PRO 110 N -0.64 0.94 0.19 1.57 0.13 -1.77 0.35 132.00 132.77 3d6b h PRO 110 Ca -0.01 -0.08 -0.01 0.00 -0.87 0.00 0.00 66.00 65.03 3d6b h PRO 110 Cb 0.56 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 31.49 3d6b h PRO 110 CO 0.01 0.66 -0.09 0.82 -0.23 0.00 0.00 178.00 179.17 3d6b h ILE 111 N 0.96 0.87 -0.56 -3.56 2.04 -1.59 -0.30 117.51 115.38 3d6b h ILE 111 Ca 0.25 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.84 3d6b h ILE 111 Cb -0.03 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.06 3d6b h ILE 111 CO -0.05 0.06 0.37 0.15 0.00 0.00 0.00 178.15 178.68 3d6b h PHE 112 N -0.39 0.71 0.07 1.37 3.57 -1.01 0.29 116.94 121.56 3d6b h PHE 112 Ca -0.03 0.01 -0.25 0.00 3.53 0.00 0.00 57.97 61.24 3d6b h PHE 112 Cb 0.30 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.79 3d6b h PHE 112 CO -0.03 0.45 -1.15 1.49 -2.23 0.00 0.00 178.31 176.85 3d6b h GLU 113 N 0.76 0.16 0.00 1.11 4.57 -0.29 -3.37 114.58 117.51 3d6b h GLU 113 Ca 0.20 -0.27 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 3d6b h GLU 113 Cb -0.08 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 3d6b h GLU 113 CO -0.04 1.13 0.00 1.19 -1.18 0.00 0.00 179.01 180.10 3d6b n PHE 114 N -3.45 0.00 -1.55 0.92 3.72 -0.13 -4.98 117.46 111.99 3d6b n PHE 114 Ca -0.05 0.00 -0.29 0.00 -0.05 0.00 0.00 57.45 57.06 3d6b n PHE 114 Cb 0.99 0.00 0.16 0.00 -0.94 0.00 0.00 39.48 39.69 3d6b n PHE 114 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 3d6b s GLY 115 N -0.30 1.61 0.66 1.37 0.00 0.10 -3.02 107.32 107.75 3d6b s GLY 115 Ca 0.00 -0.72 -0.04 0.00 0.00 0.00 0.00 44.72 43.95 3d6b s GLY 115 CO 0.00 -0.08 0.94 -1.35 0.00 0.00 0.00 173.10 172.62 3d6b s SER 116 N -4.19 4.97 0.15 1.64 1.04 -1.26 -4.79 113.70 111.26 3d6b s SER 116 Ca 0.67 0.33 -0.17 0.00 0.48 0.00 0.00 55.95 57.25 3d6b s SER 116 Cb -0.12 -1.06 0.05 0.00 0.10 0.00 0.00 66.02 64.99 3d6b s SER 116 CO 0.53 -1.45 1.72 0.44 0.98 0.00 0.00 173.24 175.47 3d6b h ASP 117 N -0.39 -0.04 -0.39 7.02 3.32 -1.98 -0.31 116.42 123.65 3d6b h ASP 117 Ca -0.44 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 56.64 3d6b h ASP 117 Cb 1.31 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.93 3d6b h ASP 117 CO 0.58 0.02 0.13 0.00 -1.72 0.00 0.00 179.24 178.25 3d6b h ALA 118 N 1.25 0.51 -0.55 3.45 0.00 -1.98 -1.16 119.26 120.78 3d6b h ALA 118 Ca 0.15 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.94 3d6b h ALA 118 Cb 0.18 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 3d6b h ALA 118 CO -0.22 0.14 0.32 1.96 0.00 0.00 0.00 179.25 181.45 3d6b h GLN 119 N 0.48 0.60 -0.62 0.00 4.20 -1.83 -0.24 115.11 117.71 3d6b h GLN 119 Ca 0.13 -0.04 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 3d6b h GLN 119 Cb 0.24 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 27.86 3d6b h GLN 119 CO -0.01 0.40 0.07 0.87 -0.67 0.00 0.00 178.83 179.50 3d6b h LYS 120 N 0.62 1.05 -0.20 1.46 1.57 -0.89 -1.83 116.57 118.36 3d6b h LYS 120 Ca 0.23 -0.30 -0.13 0.00 -1.87 0.00 0.00 60.65 58.58 3d6b h LYS 120 Cb 0.06 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 3d6b h LYS 120 CO -0.12 0.99 -0.42 0.93 -0.57 0.00 0.00 179.45 180.26 3d6b h GLU 121 N 0.95 0.47 0.05 3.15 5.08 -0.97 -2.98 114.58 120.33 3d6b h GLU 121 Ca 0.19 -0.24 -0.23 0.00 -1.00 0.00 0.00 59.36 58.07 3d6b h GLU 121 Cb 0.47 0.01 0.02 0.00 0.50 0.00 0.00 28.75 29.74 3d6b h GLU 121 CO 0.02 0.81 -0.94 -0.22 -1.00 0.00 0.00 179.01 177.68 3d6b h LYS 122 N 0.39 0.56 0.00 2.33 3.64 -0.95 -3.42 116.57 119.12 3d6b h LYS 122 Ca 0.03 -0.66 -0.38 0.00 -1.27 0.00 0.00 60.65 58.37 3d6b h LYS 122 Cb 0.90 0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 32.86 3d6b h LYS 122 CO 0.08 1.27 -2.36 0.66 -2.27 0.00 0.00 179.45 176.82 3d6b n TYR 123 N -3.98 0.00 0.00 1.91 4.01 -0.70 -4.67 117.16 113.73 3d6b n TYR 123 Ca -0.12 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.52 3d6b n TYR 123 Cb 0.84 -0.90 -0.04 0.00 -0.31 0.00 0.00 39.34 38.94 3d6b n TYR 123 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3d6b h LEU 124 N -0.39 -0.89 -1.50 7.72 3.38 -1.71 -1.71 115.31 120.21 3d6b h LEU 124 Ca -0.57 0.14 0.08 0.00 0.09 0.00 0.00 57.88 57.61 3d6b h LEU 124 Cb 1.70 0.38 -0.04 0.00 0.09 0.00 0.00 40.66 42.79 3d6b h LEU 124 CO -0.21 -0.33 0.44 -0.65 0.09 0.00 0.00 178.44 177.77 3d6b h PRO 125 N -0.36 0.57 0.00 1.13 0.11 -1.65 0.10 132.00 131.90 3d6b h PRO 125 Ca 0.10 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.98 3d6b h PRO 125 Cb 0.51 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.46 3d6b h PRO 125 CO -0.33 0.38 -1.07 0.87 -0.21 0.00 0.00 178.00 177.63 3d6b h LYS 126 N 0.59 0.00 -0.24 1.05 1.57 -1.77 -3.00 116.57 114.76 3d6b h LYS 126 Ca 0.30 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.95 3d6b h LYS 126 Cb 0.39 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 3d6b h LYS 126 CO -0.09 0.71 -0.37 -0.07 -0.57 0.00 0.00 179.45 179.05 3d6b h LEU 127 N 0.00 0.58 -0.79 2.94 3.38 -0.33 0.24 115.31 121.33 3d6b h LEU 127 Ca -0.08 -0.24 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 3d6b h LEU 127 Cb 1.71 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.26 3d6b h LEU 127 CO 0.10 0.90 0.29 0.00 0.09 0.00 0.00 178.44 179.81 3d6b h ALA 128 N 1.14 1.03 0.00 1.53 0.00 -0.84 -2.88 119.26 119.23 3d6b h ALA 128 Ca 0.05 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3d6b h ALA 128 Cb 0.86 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3d6b h ALA 128 CO 0.07 0.67 -0.32 0.25 0.00 0.00 0.00 179.25 179.93 3d6b n THR 129 N -4.26 0.10 -0.71 0.00 -2.24 -1.14 -4.22 114.28 101.81 3d6b n THR 129 Ca 0.07 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3d6b n THR 129 Cb 0.20 -0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 3d6b n THR 129 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d6b n GLY 130 N 1.46 0.68 0.13 3.38 0.00 -0.96 -3.55 105.19 106.34 3d6b n GLY 130 Ca 0.06 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.97 3d6b n GLY 130 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3d6b h GLU 131 N 2.19 0.32 -5.49 1.61 4.81 -1.26 -3.35 114.58 113.41 3d6b h GLU 131 Ca 0.00 -0.08 -0.64 0.00 -0.13 0.00 0.00 59.36 58.51 3d6b h GLU 131 Cb 0.00 -0.04 -0.10 0.00 0.63 0.00 0.00 28.75 29.24 3d6b h GLU 131 CO 0.00 0.46 -0.49 -1.58 -0.73 0.00 0.00 179.01 176.66 3d6b s TRP 132 N -5.25 3.49 -0.18 0.92 0.51 -0.67 -5.01 118.94 112.76 3d6b s TRP 132 Ca -0.14 0.41 -0.08 0.00 -2.12 0.00 0.00 56.10 54.17 3d6b s TRP 132 Cb 0.07 -2.03 -0.05 0.00 -0.81 0.00 0.00 33.47 30.66 3d6b s TRP 132 CO 0.72 0.52 0.11 0.42 -0.51 0.00 0.00 176.95 178.21 3d6b s ILE 133 N -0.41 5.19 0.22 2.03 1.01 -1.26 -4.27 121.20 123.70 3d6b s ILE 133 Ca 0.12 0.11 0.07 0.00 0.00 0.00 0.00 60.65 60.94 3d6b s ILE 133 Cb -0.12 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 3d6b s ILE 133 CO 0.01 0.48 0.11 -0.83 0.00 0.00 0.00 174.94 174.71 3d6b s GLY 134 N 0.11 1.58 0.15 6.18 0.00 -1.26 0.13 107.32 114.21 3d6b s GLY 134 Ca 0.08 -1.40 0.01 0.00 0.00 0.00 0.00 44.72 43.40 3d6b s GLY 134 CO -0.00 -1.44 0.02 0.00 0.00 0.00 0.00 173.10 171.68 3d6b s PHE 136 N -3.80 2.75 -0.77 0.00 2.19 -1.26 -0.79 117.98 116.29 3d6b s PHE 136 Ca 0.23 -1.23 0.01 0.00 0.33 0.00 0.00 56.93 56.26 3d6b s PHE 136 Cb 0.07 -1.88 0.19 0.00 -1.31 0.00 0.00 43.02 40.09 3d6b s PHE 136 CO 0.02 -0.58 0.61 0.20 1.83 0.00 0.00 175.22 177.30 3d6b s GLY 137 N 0.92 2.91 -0.10 13.12 0.00 0.46 -4.79 107.32 119.83 3d6b s GLY 137 Ca -0.04 -3.72 -0.05 0.00 0.00 0.00 0.00 44.72 40.91 3d6b s GLY 137 CO -0.03 1.13 -0.13 -0.10 0.00 0.00 0.00 173.10 173.97 3d6b n LEU 138 N 2.45 0.75 -4.73 0.66 7.94 -1.26 -1.35 117.00 121.45 3d6b n LEU 138 Ca 0.18 0.12 -0.41 0.00 -1.11 0.00 0.00 56.01 54.79 3d6b n LEU 138 Cb 0.36 -0.30 -0.04 0.00 0.53 0.00 0.00 43.42 43.97 3d6b n LEU 138 CO 0.33 0.22 0.77 -0.89 -1.11 0.00 0.00 177.39 176.71 3d6b s THR 139 N -2.19 4.11 0.30 1.96 2.01 -1.26 -4.95 115.64 115.61 3d6b s THR 139 Ca -0.14 1.72 0.11 0.00 0.31 0.00 0.00 61.69 63.69 3d6b s THR 139 Cb 0.06 -4.10 -0.05 0.00 0.01 0.00 0.00 72.50 68.41 3d6b s THR 139 CO 0.18 0.25 -0.13 -1.61 -0.69 0.00 0.00 174.62 172.62 3d6b s GLU 140 N 0.05 1.84 0.00 4.92 2.02 -1.26 0.51 118.70 126.78 3d6b s GLU 140 Ca 0.51 -1.75 0.10 0.00 0.02 0.00 0.00 54.97 53.84 3d6b s GLU 140 Cb -0.27 -1.83 0.59 0.00 0.10 0.00 0.00 34.13 32.72 3d6b s GLU 140 CO 0.32 0.28 1.10 -2.30 0.02 0.00 0.00 175.26 174.68 3d6b n PRO 141 N -0.73 0.62 -4.95 0.39 -0.02 -1.26 -4.73 135.00 124.33 3d6b n PRO 141 Ca -0.05 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.10 3d6b n PRO 141 Cb 0.61 -1.25 -0.14 0.00 -0.02 0.00 0.00 33.50 32.70 3d6b n PRO 141 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d6b s MET 150 N -2.00 2.69 0.05 -0.52 0.00 -1.26 -5.11 119.30 113.15 3d6b s MET 150 Ca 0.15 -0.74 0.17 0.00 0.00 0.00 0.00 55.69 55.27 3d6b s MET 150 Cb 0.07 -2.38 -0.15 0.00 0.00 0.00 0.00 34.83 32.37 3d6b s MET 150 CO 0.12 0.49 0.78 1.33 0.00 0.00 0.00 175.02 177.74 3d6b n VAL 151 N 2.69 1.16 -1.65 5.16 0.24 -1.26 -4.86 118.33 119.81 3d6b n VAL 151 Ca -0.17 -0.69 -0.42 0.00 -2.04 0.00 0.00 64.34 61.01 3d6b n VAL 151 Cb 0.52 -0.70 -0.03 0.00 -1.47 0.00 0.00 33.84 32.16 3d6b n VAL 151 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 3d6b n THR 152 N -2.86 0.70 -4.56 3.34 -1.04 -1.26 -4.92 114.28 103.68 3d6b n THR 152 Ca -0.10 -0.19 -0.31 0.00 -2.04 0.00 0.00 64.05 61.40 3d6b n THR 152 Cb 0.84 -2.35 -0.12 0.00 -1.82 0.00 0.00 70.33 66.88 3d6b n THR 152 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 3d6b s ARG 153 N 4.79 2.11 -0.17 -2.82 0.52 -0.88 -1.31 118.95 121.19 3d6b s ARG 153 Ca 0.91 -0.97 -0.13 0.00 -0.52 0.00 0.00 55.73 55.02 3d6b s ARG 153 Cb -0.43 -2.23 -0.05 0.00 0.52 0.00 0.00 34.95 32.76 3d6b s ARG 153 CO 0.41 0.54 0.27 0.00 0.02 0.00 0.00 175.30 176.54 3d6b s ALA 154 N -0.98 3.60 -0.23 2.13 0.00 0.10 -2.09 121.76 124.29 3d6b s ALA 154 Ca 0.16 -0.50 0.02 0.00 0.00 0.00 0.00 51.96 51.64 3d6b s ALA 154 Cb -0.11 -2.36 0.05 0.00 0.00 0.00 0.00 23.12 20.70 3d6b s ALA 154 CO 0.07 0.09 -0.13 0.50 0.00 0.00 0.00 175.76 176.28 3d6b s ARG 155 N 0.48 2.42 0.57 0.00 3.52 -1.12 -4.66 118.95 120.17 3d6b s ARG 155 Ca 0.15 -1.14 -0.21 0.00 -0.13 0.00 0.00 55.73 54.40 3d6b s ARG 155 Cb -0.13 -2.75 -0.04 0.00 -1.56 0.00 0.00 34.95 30.48 3d6b s ARG 155 CO 0.03 -0.45 1.32 1.63 -0.81 0.00 0.00 175.30 177.02 3d6b n LYS 156 N 4.51 1.52 0.00 5.12 5.02 -1.26 0.64 118.16 133.71 3d6b n LYS 156 Ca -0.16 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.70 3d6b n LYS 156 Cb 0.45 -2.54 0.00 0.00 -0.02 0.00 0.00 35.03 32.91 3d6b n LYS 156 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 3d6b n VAL 157 N -1.26 0.00 0.00 -0.18 0.24 -1.23 -4.80 118.33 111.09 3d6b n VAL 157 Ca 0.12 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.42 3d6b n VAL 157 Cb 0.45 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.82 3d6b n VAL 157 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 3d6b n PRO 158 N 0.00 0.00 0.00 7.34 -0.01 -1.26 -5.06 135.00 136.01 3d6b n PRO 158 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.49 3d6b n PRO 158 Cb 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 33.50 33.49 3d6b n PRO 158 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 175.50 175.90 3d6b n GLY 159 N 0.00 0.00 0.00 -1.23 0.00 -1.26 -4.80 105.19 97.90 3d6b n GLY 159 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3d6b n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d6b n GLY 160 N 0.00 1.25 3.07 -0.02 0.00 -1.26 -4.57 105.19 103.66 3d6b n GLY 160 Ca 0.00 -2.18 -0.08 0.00 0.00 0.00 0.00 46.02 43.76 3d6b n GLY 160 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d6b s TYR 161 N -1.42 0.35 -0.57 1.61 2.02 0.28 -3.56 117.35 116.06 3d6b s TYR 161 Ca 0.00 -0.76 -0.00 0.00 -0.37 0.00 0.00 57.07 55.94 3d6b s TYR 161 Cb 0.00 -0.26 0.15 0.00 -0.40 0.00 0.00 41.96 41.45 3d6b s TYR 161 CO 0.00 -0.33 0.36 0.45 -1.57 0.00 0.00 175.55 174.46 3d6b s SER 162 N -2.30 4.90 0.22 2.29 0.15 0.21 -0.27 113.70 118.90 3d6b s SER 162 Ca -0.03 -2.86 -0.30 0.00 0.70 0.00 0.00 55.95 53.46 3d6b s SER 162 Cb 0.00 -1.77 -0.08 0.00 -1.71 0.00 0.00 66.02 62.46 3d6b s SER 162 CO -0.06 -0.33 0.98 -0.76 1.20 0.00 0.00 173.24 174.27 3d6b s LEU 163 N -0.08 4.60 -0.03 3.45 1.02 -0.74 -2.79 118.68 124.11 3d6b s LEU 163 Ca 0.16 1.98 -0.02 0.00 0.02 0.00 0.00 54.13 56.28 3d6b s LEU 163 Cb -0.22 -3.61 0.01 0.00 0.02 0.00 0.00 46.19 42.39 3d6b s LEU 163 CO -0.02 0.04 0.07 -0.55 0.02 0.00 0.00 176.35 175.91 3d6b s SER 164 N -0.84 -0.06 0.00 2.29 0.15 -0.89 -0.72 113.70 113.62 3d6b s SER 164 Ca 0.43 0.13 0.00 0.00 0.70 0.00 0.00 55.95 57.22 3d6b s SER 164 Cb -0.27 0.13 0.00 0.00 -1.71 0.00 0.00 66.02 64.17 3d6b s SER 164 CO 0.33 -0.03 0.00 0.61 1.20 0.00 0.00 173.24 175.35 3d6b n GLY 165 N 3.14 -0.59 2.90 9.45 0.00 0.80 -2.07 105.19 118.82 3d6b n GLY 165 Ca -0.13 -1.40 -0.14 0.00 0.00 0.00 0.00 46.02 44.35 3d6b n GLY 165 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3d6b s SER 166 N -4.00 -0.07 0.02 1.61 0.01 -1.26 -0.57 113.70 109.44 3d6b s SER 166 Ca 0.00 0.22 0.03 0.00 1.31 0.00 0.00 55.95 57.51 3d6b s SER 166 Cb 0.00 0.14 -0.04 0.00 0.21 0.00 0.00 66.02 66.33 3d6b s SER 166 CO 0.00 -0.12 -0.04 -0.54 0.41 0.00 0.00 173.24 172.95 3d6b s LYS 167 N 0.89 2.61 0.05 12.44 -0.14 0.40 -4.26 119.74 131.75 3d6b s LYS 167 Ca -0.07 -0.71 0.06 0.00 -1.36 0.00 0.00 55.97 53.89 3d6b s LYS 167 Cb -0.09 -2.56 -0.03 0.00 -1.68 0.00 0.00 37.83 33.47 3d6b s LYS 167 CO -0.04 0.60 -0.18 1.41 -0.76 0.00 0.00 175.35 176.38 3d6b s MET 168 N -1.60 1.13 -1.00 1.68 1.75 0.18 -1.26 119.30 120.18 3d6b s MET 168 Ca 0.19 -0.92 -0.01 0.00 -1.25 0.00 0.00 55.69 53.71 3d6b s MET 168 Cb -0.11 -1.22 -0.01 0.00 2.84 0.00 0.00 34.83 36.33 3d6b s MET 168 CO 0.10 0.30 0.84 0.91 -0.65 0.00 0.00 175.02 176.52 3d6b n TRP 169 N 1.68 -1.90 -3.39 4.11 7.02 -1.20 -4.57 117.44 119.20 3d6b n TRP 169 Ca -0.18 0.79 -0.44 0.00 -1.02 0.00 0.00 57.50 56.65 3d6b n TRP 169 Cb 0.54 -4.51 -0.08 0.00 -2.42 0.00 0.00 31.31 24.84 3d6b n TRP 169 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3d6b s ILE 170 N -3.31 5.21 0.24 -0.99 -1.09 0.14 -4.89 121.20 116.50 3d6b s ILE 170 Ca 0.06 -0.89 -0.30 0.00 -2.23 0.00 0.00 60.65 57.29 3d6b s ILE 170 Cb -0.01 -4.09 -0.09 0.00 -1.58 0.00 0.00 42.46 36.70 3d6b s ILE 170 CO 0.62 -0.52 1.26 0.28 -1.23 0.00 0.00 174.94 175.35 3d6b s THR 171 N 1.74 3.19 0.00 2.92 -1.32 -1.26 -1.05 115.64 119.86 3d6b s THR 171 Ca 0.05 1.06 0.00 0.00 -1.21 0.00 0.00 61.69 61.59 3d6b s THR 171 Cb -0.22 -3.67 0.00 0.00 -1.51 0.00 0.00 72.50 67.09 3d6b s THR 171 CO 0.08 0.20 0.00 0.59 -2.21 0.00 0.00 174.62 173.28 3d6b n ASN 172 N 1.98 0.00 -0.30 8.08 3.02 0.11 -4.53 115.26 123.62 3d6b n ASN 172 Ca 0.03 0.00 0.10 0.00 -0.03 0.00 0.00 54.58 54.68 3d6b n ASN 172 Cb 0.43 0.00 0.26 0.00 -0.61 0.00 0.00 39.78 39.86 3d6b n ASN 172 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3d6b h SER 173 N 0.00 0.48 0.31 6.41 4.64 -1.77 0.12 113.55 123.75 3d6b h SER 173 Ca 0.00 0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 3d6b h SER 173 Cb 0.00 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 3d6b h SER 173 CO 0.00 0.15 0.00 -0.65 -0.87 0.00 0.00 176.83 175.46 3d6b h PRO 174 N 0.56 0.00 0.00 4.77 0.11 -1.84 -2.92 132.00 132.68 3d6b h PRO 174 Ca 0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.62 3d6b h PRO 174 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 3d6b h PRO 174 CO -0.42 0.00 0.00 0.44 -0.21 0.00 0.00 178.00 177.81 3d6b n ILE 175 N -2.32 0.49 -2.53 4.15 -5.35 -0.06 -5.01 119.36 108.73 3d6b n ILE 175 Ca -0.00 -0.69 -0.39 0.00 -0.27 0.00 0.00 62.75 61.40 3d6b n ILE 175 Cb 0.12 0.81 -0.04 0.00 -1.74 0.00 0.00 39.64 38.78 3d6b n ILE 175 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3d6b s ALA 176 N -0.49 3.28 -0.13 -1.28 0.00 -0.64 -4.74 121.76 117.76 3d6b s ALA 176 Ca 0.00 0.79 0.02 0.00 0.00 0.00 0.00 51.96 52.78 3d6b s ALA 176 Cb 0.00 -3.29 -0.24 0.00 0.00 0.00 0.00 23.12 19.59 3d6b s ALA 176 CO 0.00 -0.14 0.30 -0.25 0.00 0.00 0.00 175.76 175.67 3d6b n ASP 177 N 0.75 1.56 -4.26 0.00 9.92 0.34 -4.57 116.55 120.28 3d6b n ASP 177 Ca 0.01 0.18 -0.33 0.00 -0.53 0.00 0.00 54.79 54.12 3d6b n ASP 177 Cb 0.47 -0.38 -0.16 0.00 -0.64 0.00 0.00 41.12 40.41 3d6b n ASP 177 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 3d6b s VAL 178 N -2.55 2.47 -0.25 2.53 1.01 -0.01 -1.63 120.40 121.95 3d6b s VAL 178 Ca -0.19 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 60.92 3d6b s VAL 178 Cb 0.07 -2.00 0.03 0.00 0.00 0.00 0.00 36.38 34.48 3d6b s VAL 178 CO 0.76 0.54 -0.06 -0.36 0.00 0.00 0.00 175.10 175.97 3d6b s PHE 179 N 0.53 3.10 -0.74 5.22 0.08 -0.38 -0.69 117.98 125.09 3d6b s PHE 179 Ca -0.12 -1.67 -0.17 0.00 0.12 0.00 0.00 56.93 55.09 3d6b s PHE 179 Cb -0.16 -2.05 0.14 0.00 -0.57 0.00 0.00 43.02 40.38 3d6b s PHE 179 CO 0.04 -0.76 0.82 0.08 -0.10 0.00 0.00 175.22 175.31 3d6b s VAL 180 N 1.29 5.03 -0.19 -0.44 1.01 0.03 -1.25 120.40 125.88 3d6b s VAL 180 Ca -0.01 -1.56 -0.08 0.00 0.00 0.00 0.00 61.98 60.32 3d6b s VAL 180 Cb -0.17 -4.55 -0.04 0.00 0.00 0.00 0.00 36.38 31.61 3d6b s VAL 180 CO -0.04 -1.19 0.09 -0.69 0.00 0.00 0.00 175.10 173.26 3d6b s VAL 181 N 1.96 5.03 -0.25 2.92 1.01 -0.26 -0.41 120.40 130.41 3d6b s VAL 181 Ca 0.18 0.05 -0.10 0.00 0.00 0.00 0.00 61.98 62.12 3d6b s VAL 181 Cb -0.16 -3.28 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 3d6b s VAL 181 CO -0.02 0.45 0.15 0.26 0.00 0.00 0.00 175.10 175.94 3d6b s TRP 182 N 0.36 3.23 0.10 5.22 0.52 -0.46 -0.66 118.94 127.26 3d6b s TRP 182 Ca 0.05 0.06 -0.01 0.00 0.02 0.00 0.00 56.10 56.21 3d6b s TRP 182 Cb -0.12 -2.29 -0.04 0.00 -1.15 0.00 0.00 33.47 29.88 3d6b s TRP 182 CO -0.01 -0.09 0.03 0.00 0.02 0.00 0.00 176.95 176.91 3d6b s ALA 183 N 1.35 0.67 0.06 0.98 0.00 -0.60 -4.82 121.76 119.40 3d6b s ALA 183 Ca 0.07 -1.33 -0.13 0.00 0.00 0.00 0.00 51.96 50.56 3d6b s ALA 183 Cb -0.15 0.63 -0.06 0.00 0.00 0.00 0.00 23.12 23.55 3d6b s ALA 183 CO 0.06 -0.45 0.44 0.15 0.00 0.00 0.00 175.76 175.96 3d6b s LYS 184 N -3.99 3.89 -0.06 0.00 1.02 -0.43 0.24 119.74 120.41 3d6b s LYS 184 Ca 0.17 0.36 -0.02 0.00 0.02 0.00 0.00 55.97 56.50 3d6b s LYS 184 Cb 0.07 -3.10 0.04 0.00 -0.52 0.00 0.00 37.83 34.33 3d6b s LYS 184 CO -0.03 0.61 0.12 -1.17 -0.92 0.00 0.00 175.35 173.95 3d6b s LEU 185 N -1.51 0.70 0.21 3.17 2.96 0.96 0.03 118.68 125.18 3d6b s LEU 185 Ca 0.30 0.23 -0.01 0.00 -0.22 0.00 0.00 54.13 54.43 3d6b s LEU 185 Cb -0.16 0.23 -0.04 0.00 0.50 0.00 0.00 46.19 46.72 3d6b s LEU 185 CO 0.16 -0.16 0.40 1.51 -1.32 0.00 0.00 176.35 176.95 3d6b s ASP 186 N 1.31 6.39 -0.04 3.68 -4.77 -1.26 -0.24 116.67 121.74 3d6b s ASP 186 Ca -0.07 0.42 0.20 0.00 -3.30 0.00 0.00 52.55 49.80 3d6b s ASP 186 Cb -0.12 -2.02 -0.31 0.00 -1.09 0.00 0.00 42.92 39.39 3d6b s ASP 186 CO -0.05 -0.05 0.41 -0.62 0.70 0.00 0.00 175.17 175.56 3d6b n GLU 187 N -0.67 0.63 -3.75 2.11 1.02 -1.26 -4.99 120.64 113.74 3d6b n GLU 187 Ca -0.04 -0.17 -0.38 0.00 -0.02 0.00 0.00 57.16 56.55 3d6b n GLU 187 Cb 0.54 -1.48 -0.12 0.00 -0.02 0.00 0.00 31.44 30.36 3d6b n GLU 187 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3d6b s ASP 191 N -4.39 5.33 0.05 1.62 1.01 -1.25 -5.33 116.67 113.71 3d6b s ASP 191 Ca -0.07 -1.15 0.05 0.00 0.71 0.00 0.00 52.55 52.09 3d6b s ASP 191 Cb 0.12 -1.87 -0.03 0.00 1.01 0.00 0.00 42.92 42.15 3d6b s ASP 191 CO 0.83 -0.33 -0.15 -1.61 0.21 0.00 0.00 175.17 174.12 3d6b s GLU 192 N 1.40 0.95 -0.02 8.23 2.02 0.66 -4.88 118.70 127.07 3d6b s GLU 192 Ca -0.01 -0.87 -0.30 0.00 0.02 0.00 0.00 54.97 53.81 3d6b s GLU 192 Cb -0.20 -0.99 -0.03 0.00 0.10 0.00 0.00 34.13 33.01 3d6b s GLU 192 CO 0.03 0.24 1.08 0.42 0.02 0.00 0.00 175.26 177.04 3d6b s ILE 193 N -1.00 4.54 0.25 -1.63 1.01 -1.26 -0.03 121.20 123.08 3d6b s ILE 193 Ca 0.01 1.83 0.11 0.00 0.00 0.00 0.00 60.65 62.60 3d6b s ILE 193 Cb -0.09 -4.17 -0.05 0.00 0.01 0.00 0.00 42.46 38.16 3d6b s ILE 193 CO 0.02 0.09 -0.19 -0.13 0.00 0.00 0.00 174.94 174.72 3d6b s ARG 194 N 1.44 1.58 -0.10 2.79 1.81 0.14 0.37 118.95 126.98 3d6b s ARG 194 Ca 0.54 -1.69 -0.06 0.00 -1.72 0.00 0.00 55.73 52.80 3d6b s ARG 194 Cb -0.23 -1.65 -0.04 0.00 -0.45 0.00 0.00 34.95 32.58 3d6b s ARG 194 CO 0.25 0.31 0.14 0.20 -0.68 0.00 0.00 175.30 175.53 3d6b s GLY 195 N -3.33 2.15 0.02 -3.53 0.00 -1.26 -1.56 107.32 99.81 3d6b s GLY 195 Ca 0.27 -0.67 0.04 0.00 0.00 0.00 0.00 44.72 44.36 3d6b s GLY 195 CO 0.13 -0.43 -0.12 -1.36 0.00 0.00 0.00 173.10 171.31 3d6b s PHE 196 N -1.08 1.09 -0.15 1.90 0.08 0.17 -1.33 117.98 118.66 3d6b s PHE 196 Ca 0.17 -0.28 -0.04 0.00 0.12 0.00 0.00 56.93 56.90 3d6b s PHE 196 Cb -0.12 -0.67 -0.03 0.00 -0.57 0.00 0.00 43.02 41.63 3d6b s PHE 196 CO 0.06 0.00 -0.03 0.42 -0.10 0.00 0.00 175.22 175.58 3d6b s ILE 197 N -0.59 3.95 0.21 0.64 1.01 -0.63 -1.10 121.20 124.69 3d6b s ILE 197 Ca 0.02 -0.34 0.05 0.00 0.00 0.00 0.00 60.65 60.38 3d6b s ILE 197 Cb -0.06 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.64 3d6b s ILE 197 CO 0.00 0.50 -0.07 -0.76 0.00 0.00 0.00 174.94 174.62 3d6b s LEU 198 N 0.24 2.42 0.01 2.97 1.02 -0.38 -4.87 118.68 120.08 3d6b s LEU 198 Ca -0.02 -1.11 0.03 0.00 0.02 0.00 0.00 54.13 53.04 3d6b s LEU 198 Cb -0.14 -0.45 -0.01 0.00 0.02 0.00 0.00 46.19 45.61 3d6b s LEU 198 CO 0.03 -0.36 -0.09 -1.61 0.02 0.00 0.00 176.35 174.34 3d6b s GLU 199 N -3.76 0.66 0.15 1.70 2.02 -1.26 -1.25 118.70 116.96 3d6b s GLU 199 Ca 0.24 -0.48 -0.34 0.00 0.02 0.00 0.00 54.97 54.41 3d6b s GLU 199 Cb 0.03 -0.60 -0.14 0.00 0.10 0.00 0.00 34.13 33.52 3d6b s GLU 199 CO 0.07 0.15 1.60 1.17 0.02 0.00 0.00 175.26 178.27 3d6b n LYS 200 N 2.36 2.18 0.00 1.61 4.81 -0.65 -1.72 118.16 126.76 3d6b n LYS 200 Ca -0.16 0.79 0.00 0.00 -0.87 0.00 0.00 58.31 58.07 3d6b n LYS 200 Cb 0.56 -2.57 0.00 0.00 0.02 0.00 0.00 35.03 33.05 3d6b n LYS 200 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3d6b n GLY 201 N 3.49 1.48 3.55 3.14 0.00 -1.26 -5.08 105.19 110.51 3d6b n GLY 201 Ca 0.17 0.00 -0.56 0.00 0.00 0.00 0.00 46.02 45.63 3d6b n GLY 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d6b s LYS 203 N 0.40 4.60 0.00 0.00 1.02 -1.26 -2.76 119.74 121.74 3d6b s LYS 203 Ca 0.89 1.59 0.00 0.00 0.02 0.00 0.00 55.97 58.47 3d6b s LYS 203 Cb -1.14 -3.35 0.00 0.00 -0.52 0.00 0.00 37.83 32.82 3d6b s LYS 203 CO 0.54 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 175.43 3d6b n GLY 204 N 2.43 2.34 3.75 -3.33 0.00 -1.26 -3.81 105.19 105.31 3d6b n GLY 204 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 3d6b n GLY 204 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3d6b s LEU 205 N 0.00 4.28 0.02 0.99 2.96 -1.11 -0.03 118.68 125.79 3d6b s LEU 205 Ca 0.00 0.62 -0.10 0.00 -0.22 0.00 0.00 54.13 54.44 3d6b s LEU 205 Cb 0.00 -2.45 0.01 0.00 0.50 0.00 0.00 46.19 44.25 3d6b s LEU 205 CO 0.00 0.12 0.19 -0.94 -1.32 0.00 0.00 176.35 174.40 3d6b s SER 206 N 0.24 0.00 -0.41 3.68 1.04 -0.51 -4.83 113.70 112.91 3d6b s SER 206 Ca 0.19 -0.26 0.07 0.00 0.48 0.00 0.00 55.95 56.43 3d6b s SER 206 Cb -0.14 0.26 0.22 0.00 0.10 0.00 0.00 66.02 66.47 3d6b s SER 206 CO 0.06 -0.48 0.51 0.00 0.98 0.00 0.00 173.24 174.31 3d6b n ALA 207 N 1.01 2.01 -1.77 5.32 0.00 -1.26 -0.32 120.51 125.49 3d6b n ALA 207 Ca -0.20 -3.02 -0.38 0.00 0.00 0.00 0.00 53.44 49.83 3d6b n ALA 207 Cb 0.57 -0.87 -0.03 0.00 0.00 0.00 0.00 19.45 19.13 3d6b n ALA 207 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3d6b s PRO 208 N -0.56 4.10 0.88 0.00 0.04 -1.26 -3.98 135.00 134.22 3d6b s PRO 208 Ca 0.34 1.72 -0.11 0.00 0.04 0.00 0.00 61.00 62.99 3d6b s PRO 208 Cb 0.13 -2.64 0.12 0.00 0.04 0.00 0.00 34.50 32.15 3d6b s PRO 208 CO -0.15 -0.25 1.09 0.00 0.04 0.00 0.00 177.00 177.73 3d6b s ALA 209 N -1.49 1.66 -0.15 8.56 0.00 -1.26 -1.74 121.76 127.33 3d6b s ALA 209 Ca 0.57 -0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.51 3d6b s ALA 209 Cb -0.28 -3.20 0.02 0.00 0.00 0.00 0.00 23.12 19.67 3d6b s ALA 209 CO 0.35 -2.26 -0.14 0.42 0.00 0.00 0.00 175.76 174.13 3d6b s ILE 210 N -2.94 1.62 0.37 0.00 1.01 -0.23 -4.81 121.20 116.23 3d6b s ILE 210 Ca 0.63 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.67 3d6b s ILE 210 Cb -0.18 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.73 3d6b s ILE 210 CO 0.57 0.45 0.22 -1.00 0.00 0.00 0.00 174.94 175.18 3d6b s HIS 211 N 1.46 2.71 -0.48 3.97 3.76 -1.26 -4.63 115.29 120.83 3d6b s HIS 211 Ca 0.05 -0.44 -0.03 0.00 -0.15 0.00 0.00 55.06 54.49 3d6b s HIS 211 Cb -0.13 -1.85 0.00 0.00 1.11 0.00 0.00 32.58 31.72 3d6b s HIS 211 CO -0.11 0.18 0.41 0.41 -0.85 0.00 0.00 174.74 174.79 3d6b n GLY 212 N -1.29 0.38 3.83 -2.22 0.00 -1.26 -5.04 105.19 99.58 3d6b n GLY 212 Ca -0.01 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.35 3d6b n GLY 212 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3d6b s LYS 213 N -5.30 3.69 -0.14 1.61 1.02 -1.26 -5.03 119.74 114.33 3d6b s LYS 213 Ca 0.17 1.04 -0.09 0.00 0.02 0.00 0.00 55.97 57.11 3d6b s LYS 213 Cb -0.08 -2.09 -0.05 0.00 -0.52 0.00 0.00 37.83 35.09 3d6b s LYS 213 CO 0.26 -0.49 -0.07 0.28 -0.92 0.00 0.00 175.35 174.41 3d6b h VAL 214 N 0.67 0.14 -1.17 3.17 2.07 -1.97 -3.46 116.25 115.70 3d6b h VAL 214 Ca -0.47 -1.15 -0.53 0.00 0.82 0.00 0.00 66.70 65.37 3d6b h VAL 214 Cb 1.20 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 31.25 3d6b h VAL 214 CO 0.60 0.05 -0.34 -0.83 0.02 0.00 0.00 177.57 177.06 3d6b s GLY 215 N -4.13 2.20 -1.36 2.17 0.00 -1.26 -4.64 107.32 100.30 3d6b s GLY 215 Ca -0.13 -1.73 -0.03 0.00 0.00 0.00 0.00 44.72 42.84 3d6b s GLY 215 CO 0.21 -1.79 0.20 1.04 0.00 0.00 0.00 173.10 172.76 3d6b n LEU 216 N -1.64 -1.70 0.27 0.66 4.77 -1.26 -4.88 117.00 113.22 3d6b n LEU 216 Ca 0.02 -0.05 0.13 0.00 -0.03 0.00 0.00 56.01 56.08 3d6b n LEU 216 Cb 0.63 -2.49 0.79 0.00 -2.33 0.00 0.00 43.42 40.01 3d6b n LEU 216 CO 0.41 -0.03 1.04 0.03 -1.33 0.00 0.00 177.39 177.52 3d6b h ARG 217 N -0.44 0.00 0.00 3.23 3.08 -1.87 -2.53 114.38 115.85 3d6b h ARG 217 Ca -0.41 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.62 3d6b h ARG 217 Cb 1.29 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.34 3d6b h ARG 217 CO 0.48 0.06 -0.07 0.00 -1.07 0.00 0.00 179.97 179.37 3d6b h ALA 218 N 1.94 0.98 -2.52 0.04 0.00 -1.84 -3.39 119.26 114.46 3d6b h ALA 218 Ca -0.00 -0.07 -0.54 0.00 0.00 0.00 0.00 54.91 54.31 3d6b h ALA 218 Cb 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 3d6b h ALA 218 CO 0.01 0.09 -0.11 -1.54 0.00 0.00 0.00 179.25 177.69 3d6b s SER 219 N -6.01 6.63 -0.03 0.00 1.04 -0.95 -4.77 113.70 109.61 3d6b s SER 219 Ca 0.03 0.93 -0.16 0.00 0.48 0.00 0.00 55.95 57.23 3d6b s SER 219 Cb 0.08 -2.23 -0.05 0.00 0.10 0.00 0.00 66.02 63.91 3d6b s SER 219 CO 0.62 -0.07 0.44 -0.51 0.98 0.00 0.00 173.24 174.70 3d6b s ILE 220 N -1.80 5.04 0.03 -1.02 2.07 -1.26 -5.00 121.20 119.25 3d6b s ILE 220 Ca 0.47 0.91 0.02 0.00 -1.41 0.00 0.00 60.65 60.64 3d6b s ILE 220 Cb -0.11 -3.76 -0.02 0.00 0.13 0.00 0.00 42.46 38.69 3d6b s ILE 220 CO 0.21 0.50 -0.06 -0.89 -1.91 0.00 0.00 174.94 172.79 3d6b s THR 221 N -0.59 0.41 0.00 4.00 2.01 -1.26 -0.71 115.64 119.50 3d6b s THR 221 Ca 0.25 -0.93 0.00 0.00 0.31 0.00 0.00 61.69 61.32 3d6b s THR 221 Cb -0.17 -0.49 0.00 0.00 0.01 0.00 0.00 72.50 71.86 3d6b s THR 221 CO 0.13 -0.35 0.00 0.61 -0.69 0.00 0.00 174.62 174.32 3d6b n GLY 222 N 1.67 2.76 3.86 4.40 0.00 -0.22 -1.07 105.19 116.61 3d6b n GLY 222 Ca -0.22 -0.96 -0.23 0.00 0.00 0.00 0.00 46.02 44.62 3d6b n GLY 222 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3d6b s GLU 223 N -0.47 2.41 -0.28 1.61 -1.05 -0.71 0.23 118.70 120.44 3d6b s GLU 223 Ca 0.00 -1.70 0.03 0.00 -0.15 0.00 0.00 54.97 53.14 3d6b s GLU 223 Cb 0.00 -2.26 0.07 0.00 -0.44 0.00 0.00 34.13 31.51 3d6b s GLU 223 CO 0.00 -0.30 -0.05 0.42 0.95 0.00 0.00 175.26 176.28 3d6b s ILE 224 N -2.57 2.02 -0.37 1.83 1.01 -0.39 -4.11 121.20 118.64 3d6b s ILE 224 Ca 0.44 -1.72 -0.14 0.00 0.00 0.00 0.00 60.65 59.23 3d6b s ILE 224 Cb -0.02 -2.26 -0.00 0.00 0.01 0.00 0.00 42.46 40.19 3d6b s ILE 224 CO 0.26 -0.20 0.30 -0.69 0.00 0.00 0.00 174.94 174.61 3d6b s VAL 225 N 1.13 5.23 -0.40 2.92 1.01 0.56 -0.45 120.40 130.40 3d6b s VAL 225 Ca -0.03 -0.27 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 3d6b s VAL 225 Cb -0.19 -3.82 0.06 0.00 0.00 0.00 0.00 36.38 32.42 3d6b s VAL 225 CO -0.07 -0.14 0.22 -0.76 0.00 0.00 0.00 175.10 174.36 3d6b s LEU 226 N 1.82 4.93 -0.80 3.92 1.43 0.27 -1.42 118.68 128.82 3d6b s LEU 226 Ca 0.08 -1.33 -0.02 0.00 -1.03 0.00 0.00 54.13 51.83 3d6b s LEU 226 Cb -0.18 -1.98 0.20 0.00 0.03 0.00 0.00 46.19 44.26 3d6b s LEU 226 CO 0.11 -0.47 0.66 -0.62 0.23 0.00 0.00 176.35 176.26 3d6b s ASP 227 N 1.87 5.72 -0.99 2.29 2.15 0.95 -0.14 116.67 128.52 3d6b s ASP 227 Ca 0.02 -3.41 -0.14 0.00 0.43 0.00 0.00 52.55 49.45 3d6b s ASP 227 Cb -0.22 -1.89 0.01 0.00 -0.30 0.00 0.00 42.92 40.52 3d6b s ASP 227 CO 0.03 -0.25 0.69 -0.62 -0.17 0.00 0.00 175.17 174.85 3d6b n GLU 228 N 2.76 -1.11 -3.04 4.34 1.02 -0.89 -4.41 120.64 119.30 3d6b n GLU 228 Ca 0.17 0.61 -0.40 0.00 -0.02 0.00 0.00 57.16 57.52 3d6b n GLU 228 Cb 0.38 -3.29 -0.05 0.00 -0.02 0.00 0.00 31.44 28.46 3d6b n GLU 228 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3d6b s ALA 229 N -3.25 3.35 0.01 0.62 0.00 0.10 -4.65 121.76 117.95 3d6b s ALA 229 Ca 0.25 0.11 -0.30 0.00 0.00 0.00 0.00 51.96 52.02 3d6b s ALA 229 Cb -0.11 -2.97 -0.03 0.00 0.00 0.00 0.00 23.12 20.00 3d6b s ALA 229 CO 0.89 -0.15 0.99 0.12 0.00 0.00 0.00 175.76 177.61 3d6b s PHE 230 N 0.91 3.65 -0.26 0.00 5.36 -1.25 -1.80 117.98 124.60 3d6b s PHE 230 Ca 0.37 1.68 -0.00 0.00 -0.96 0.00 0.00 56.93 58.02 3d6b s PHE 230 Cb -0.18 -3.14 0.08 0.00 -0.34 0.00 0.00 43.02 39.45 3d6b s PHE 230 CO 0.18 -0.08 0.03 0.08 -1.46 0.00 0.00 175.22 173.96 3d6b s VAL 231 N 0.95 1.13 0.54 3.12 1.01 0.62 -4.93 120.40 122.85 3d6b s VAL 231 Ca 0.52 -1.25 -0.19 0.00 0.00 0.00 0.00 61.98 61.06 3d6b s VAL 231 Cb -0.22 -1.66 -0.09 0.00 0.00 0.00 0.00 36.38 34.41 3d6b s VAL 231 CO 0.28 -0.39 0.63 -0.81 0.00 0.00 0.00 175.10 174.82 3d6b n PRO 232 N 4.78 0.65 0.22 2.72 -0.04 -1.26 0.99 135.00 143.06 3d6b n PRO 232 Ca -0.06 0.25 0.15 0.00 -0.04 0.00 0.00 63.50 63.80 3d6b n PRO 232 Cb 0.44 -1.77 0.74 0.00 -0.04 0.00 0.00 33.50 32.88 3d6b n PRO 232 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 3d6b h GLU 233 N 0.49 0.00 -0.29 0.54 5.08 -1.85 -0.11 114.58 118.44 3d6b h GLU 233 Ca -0.45 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 3d6b h GLU 233 Cb 1.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.64 3d6b h GLU 233 CO 0.49 0.00 0.00 0.39 -1.00 0.00 0.00 179.01 178.89 3d6b n GLU 234 N -2.59 1.35 -0.00 2.33 1.02 -1.26 -3.60 120.64 117.89 3d6b n GLU 234 Ca -0.01 -0.45 0.01 0.00 -0.02 0.00 0.00 57.16 56.70 3d6b n GLU 234 Cb 0.13 -1.20 -0.01 0.00 -0.02 0.00 0.00 31.44 30.33 3d6b n GLU 234 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3d6b n ASN 235 N -0.10 2.11 -4.79 1.62 4.13 -0.05 -4.82 115.26 113.35 3d6b n ASN 235 Ca 0.04 -0.30 -0.35 0.00 1.68 0.00 0.00 54.58 55.65 3d6b n ASN 235 Cb 0.16 1.05 -0.05 0.00 -1.54 0.00 0.00 39.78 39.40 3d6b n ASN 235 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 3d6b s ILE 236 N -1.63 3.95 -0.38 2.41 2.07 -1.24 -1.61 121.20 124.78 3d6b s ILE 236 Ca 0.00 1.36 -0.26 0.00 -1.41 0.00 0.00 60.65 60.35 3d6b s ILE 236 Cb 0.02 -3.64 0.02 0.00 0.13 0.00 0.00 42.46 38.98 3d6b s ILE 236 CO 0.09 -0.12 0.92 -0.76 -1.91 0.00 0.00 174.94 173.16 3d6b s LEU 237 N -2.93 4.00 0.11 8.50 1.02 -0.45 -4.84 118.68 124.10 3d6b s LEU 237 Ca 0.60 0.51 -0.13 0.00 0.02 0.00 0.00 54.13 55.14 3d6b s LEU 237 Cb -0.17 -3.24 -0.12 0.00 0.02 0.00 0.00 46.19 42.68 3d6b s LEU 237 CO 0.22 -0.87 1.35 -0.65 0.02 0.00 0.00 176.35 176.42 3d6b h PRO 238 N 8.55 0.82 -0.95 1.29 0.11 -1.87 -3.32 132.00 136.63 3d6b h PRO 238 Ca -0.23 -0.58 -0.30 0.00 0.11 0.00 0.00 66.00 64.99 3d6b h PRO 238 Cb 1.08 0.09 -0.18 0.00 0.11 0.00 0.00 31.00 32.10 3d6b h PRO 238 CO 0.98 1.21 0.38 0.72 -0.21 0.00 0.00 178.00 181.08 3d6b n HIS 239 N -4.01 2.03 -3.74 0.65 8.25 -1.17 -4.81 115.22 112.44 3d6b n HIS 239 Ca -0.06 -1.29 -0.12 0.00 -0.26 0.00 0.00 57.72 55.99 3d6b n HIS 239 Cb 0.67 -0.68 -0.12 0.00 1.12 0.00 0.00 29.99 30.98 3d6b n HIS 239 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3d6b s VAL 240 N -2.29 -0.02 -0.10 1.59 0.11 -1.25 -4.83 120.40 113.61 3d6b s VAL 240 Ca 0.39 0.08 -0.13 0.00 -2.93 0.00 0.00 61.98 59.40 3d6b s VAL 240 Cb 0.33 -0.44 0.03 0.00 -1.53 0.00 0.00 36.38 34.77 3d6b s VAL 240 CO 0.08 0.03 0.33 -1.59 -3.33 0.00 0.00 175.10 170.63 3d6b s LYS 241 N 0.90 0.47 1.63 1.54 -2.85 -1.26 -4.64 119.74 115.52 3d6b s LYS 241 Ca -0.06 0.30 0.00 0.00 -1.00 0.00 0.00 55.97 55.21 3d6b s LYS 241 Cb -0.07 0.22 0.00 0.00 -2.06 0.00 0.00 37.83 35.92 3d6b s LYS 241 CO -0.06 -0.08 0.00 0.41 0.10 0.00 0.00 175.35 175.72 3d6b n GLY 242 N 2.48 0.37 0.14 0.59 0.00 0.16 -4.54 105.19 104.39 3d6b n GLY 242 Ca -0.15 -1.39 -0.23 0.00 0.00 0.00 0.00 46.02 44.25 3d6b n GLY 242 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3d6b h LEU 243 N 0.00 0.75 -1.21 0.99 5.85 -2.00 -3.29 115.31 116.39 3d6b h LEU 243 Ca 0.00 -0.81 0.00 0.00 0.84 0.00 0.00 57.88 57.91 3d6b h LEU 243 Cb 0.00 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.79 3d6b h LEU 243 CO 0.00 1.64 0.01 -1.14 -0.34 0.00 0.00 178.44 178.61 3d6b n ARG 244 N -3.67 0.12 0.00 1.25 0.00 -1.26 -2.49 116.66 110.60 3d6b n ARG 244 Ca -0.15 0.61 0.00 0.00 -0.00 0.00 0.00 57.85 58.31 3d6b n ARG 244 Cb 1.09 -1.90 0.00 0.00 0.00 0.00 0.00 32.46 31.65 3d6b n ARG 244 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3d6b n GLY 245 N -1.33 -1.69 0.30 5.14 0.00 -1.24 -2.01 105.19 104.36 3d6b n GLY 245 Ca -0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.11 3d6b n GLY 245 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3d6b h PRO 246 N 0.00 0.42 -0.85 1.61 0.11 -1.79 -2.52 132.00 128.98 3d6b h PRO 246 Ca 0.00 -0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.11 3d6b h PRO 246 Cb 0.00 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 30.97 3d6b h PRO 246 CO 0.00 0.28 0.55 0.35 -0.21 0.00 0.00 178.00 178.97 3d6b h PHE 247 N 0.43 1.04 -0.96 0.65 3.57 -1.60 -0.41 116.94 119.67 3d6b h PHE 247 Ca 0.51 0.03 0.04 0.00 3.53 0.00 0.00 57.97 62.07 3d6b h PHE 247 Cb 0.90 -0.35 -0.06 0.00 2.79 0.00 0.00 35.95 39.24 3d6b h PHE 247 CO -0.15 0.61 0.63 1.15 -2.23 0.00 0.00 178.31 178.32 3d6b h THR 248 N 1.09 1.17 0.13 4.41 2.02 -0.95 0.75 112.91 121.52 3d6b h THR 248 Ca 0.33 -0.42 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 3d6b h THR 248 Cb -0.02 -0.16 0.00 0.00 -1.74 0.00 0.00 68.15 66.23 3d6b h THR 248 CO -0.11 0.22 -0.06 0.00 0.37 0.00 0.00 175.52 175.95 3d6b h LEU 250 N -0.51 0.48 -1.25 0.00 3.38 -0.91 0.00 115.31 116.50 3d6b h LEU 250 Ca -0.02 0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.99 3d6b h LEU 250 Cb 0.41 -0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 3d6b h LEU 250 CO 0.03 0.33 0.52 -1.13 0.09 0.00 0.00 178.44 178.27 3d6b h ASN 251 N 0.61 0.87 -0.22 -0.43 -1.24 -0.89 0.30 115.58 114.57 3d6b h ASN 251 Ca 0.24 -0.02 -0.02 0.00 0.71 0.00 0.00 56.30 57.21 3d6b h ASN 251 Cb 0.10 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 38.93 3d6b h ASN 251 CO -0.14 0.61 0.04 -1.28 -1.29 0.00 0.00 177.43 175.38 3d6b h SER 252 N 1.02 0.34 -0.10 1.15 0.87 -0.77 -2.55 113.55 113.51 3d6b h SER 252 Ca 0.30 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 60.59 3d6b h SER 252 Cb -0.05 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 61.81 3d6b h SER 252 CO -0.07 0.50 0.00 0.00 -0.53 0.00 0.00 176.83 176.73 3d6b h ALA 253 N 0.85 0.13 -0.82 6.23 0.00 -0.49 -2.84 119.26 122.32 3d6b h ALA 253 Ca 0.07 -0.18 0.18 0.00 0.00 0.00 0.00 54.91 54.98 3d6b h ALA 253 Cb 0.30 -0.04 -0.11 0.00 0.00 0.00 0.00 17.79 17.95 3d6b h ALA 253 CO 0.00 -0.19 0.33 0.00 0.00 0.00 0.00 179.25 179.39 3d6b h ARG 254 N -0.10 0.41 -0.77 0.00 3.08 -0.49 0.22 114.38 116.71 3d6b h ARG 254 Ca 0.03 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.10 3d6b h ARG 254 Cb 0.34 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 30.25 3d6b h ARG 254 CO 0.00 0.27 0.47 -0.92 -1.07 0.00 0.00 179.97 178.72 3d6b h TYR 255 N 0.42 0.87 -0.33 3.04 5.03 -1.31 -1.42 116.97 123.28 3d6b h TYR 255 Ca 0.48 0.03 -0.14 0.00 2.58 0.00 0.00 58.73 61.67 3d6b h TYR 255 Cb 0.81 -0.28 -0.00 0.00 1.55 0.00 0.00 36.73 38.81 3d6b h TYR 255 CO -0.17 0.46 -0.36 0.78 -1.32 0.00 0.00 178.16 177.55 3d6b h GLY 256 N 0.88 0.89 1.46 1.82 0.00 -0.45 -3.08 103.07 104.59 3d6b h GLY 256 Ca 0.33 -0.94 -0.01 0.00 0.00 0.00 0.00 47.33 46.71 3d6b h GLY 256 CO -0.15 0.84 0.28 -2.22 0.00 0.00 0.00 176.54 175.29 3d6b h ILE 257 N 0.60 1.16 -0.72 2.60 2.04 -0.73 -0.54 117.51 121.91 3d6b h ILE 257 Ca 0.05 -0.41 -0.01 0.00 1.00 0.00 0.00 64.86 65.49 3d6b h ILE 257 Cb 0.95 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 37.45 3d6b h ILE 257 CO 0.09 0.18 0.43 0.00 0.00 0.00 0.00 178.15 178.85 3d6b h ALA 258 N 1.59 1.39 -0.09 1.87 0.00 -1.18 0.18 119.26 123.02 3d6b h ALA 258 Ca 0.19 -0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.85 3d6b h ALA 258 Cb 0.03 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.53 3d6b h ALA 258 CO -0.03 0.52 -0.56 -1.49 0.00 0.00 0.00 179.25 177.69 3d6b h TRP 259 N 1.00 0.74 0.10 0.00 4.06 -1.46 -3.36 115.95 117.03 3d6b h TRP 259 Ca 0.26 -0.34 -0.00 0.00 2.06 0.00 0.00 58.89 60.87 3d6b h TRP 259 Cb -0.03 -0.11 0.00 0.00 -1.00 0.00 0.00 29.16 28.02 3d6b h TRP 259 CO 0.00 1.13 -0.05 0.78 -3.56 0.00 0.00 178.44 176.74 3d6b h GLY 260 N 0.15 -0.14 0.24 1.49 0.00 -0.37 -2.80 103.07 101.64 3d6b h GLY 260 Ca -0.04 0.05 0.22 0.00 0.00 0.00 0.00 47.33 47.56 3d6b h GLY 260 CO 0.12 -0.05 0.61 0.00 0.00 0.00 0.00 176.54 177.22 3d6b h ALA 261 N 0.68 2.34 -0.13 3.60 0.00 -0.85 0.35 119.26 125.24 3d6b h ALA 261 Ca -0.01 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.80 3d6b h ALA 261 Cb 0.18 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3d6b h ALA 261 CO 0.02 -0.63 -0.41 -0.07 0.00 0.00 0.00 179.25 178.16 3d6b h LEU 262 N 0.32 0.31 -0.19 0.00 3.38 -1.64 0.11 115.31 117.60 3d6b h LEU 262 Ca 0.47 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 3d6b h LEU 262 Cb 1.32 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 3d6b h LEU 262 CO -0.15 0.70 0.04 1.23 0.09 0.00 0.00 178.44 180.34 3d6b h GLY 263 N 1.20 0.34 1.00 0.83 0.00 -0.22 -0.27 103.07 105.95 3d6b h GLY 263 Ca 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 47.33 47.14 3d6b h GLY 263 CO 0.07 0.20 0.38 0.00 0.00 0.00 0.00 176.54 177.18 3d6b h ALA 264 N 0.85 0.74 -0.76 3.60 0.00 -1.35 -1.20 119.26 121.15 3d6b h ALA 264 Ca 0.06 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.02 3d6b h ALA 264 Cb 0.28 -0.24 -0.08 0.00 0.00 0.00 0.00 17.79 17.76 3d6b h ALA 264 CO 0.00 0.19 0.39 0.00 0.00 0.00 0.00 179.25 179.83 3d6b h ALA 265 N 1.20 1.07 -0.56 0.00 0.00 -0.81 -2.50 119.26 117.66 3d6b h ALA 265 Ca 0.21 0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.10 3d6b h ALA 265 Cb -0.07 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 3d6b h ALA 265 CO -0.04 -0.03 0.05 0.93 0.00 0.00 0.00 179.25 180.16 3d6b h GLU 266 N 0.64 0.95 -0.31 0.00 5.08 -0.12 -1.31 114.58 119.50 3d6b h GLU 266 Ca 0.38 -0.28 0.06 0.00 -1.00 0.00 0.00 59.36 58.52 3d6b h GLU 266 Cb 0.42 -0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 3d6b h GLU 266 CO -0.28 0.93 -0.06 0.77 -1.00 0.00 0.00 179.01 179.36 3d6b h SER 267 N 0.84 -0.26 -0.33 1.42 0.02 -0.98 -0.35 113.55 113.90 3d6b h SER 267 Ca 0.16 0.09 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 3d6b h SER 267 Cb 0.47 0.18 -0.02 0.00 0.14 0.00 0.00 62.40 63.17 3d6b h SER 267 CO 0.02 -0.09 0.15 0.00 -1.14 0.00 0.00 176.83 175.77 3d6b h TRP 269 N 0.40 -0.17 -0.26 0.00 7.01 -1.13 0.29 115.95 122.08 3d6b h TRP 269 Ca 0.11 0.02 -0.03 0.00 2.11 0.00 0.00 58.89 61.11 3d6b h TRP 269 Cb 0.13 0.11 -0.01 0.00 -2.10 0.00 0.00 29.16 27.29 3d6b h TRP 269 CO -0.01 -0.13 0.06 0.45 -2.79 0.00 0.00 178.44 176.02 3d6b h HIS 270 N -0.04 0.45 -0.12 2.65 3.86 -0.68 0.22 115.15 121.49 3d6b h HIS 270 Ca 0.11 -0.05 0.03 0.00 -1.16 0.00 0.00 60.37 59.30 3d6b h HIS 270 Cb 0.20 -0.13 -0.03 0.00 1.06 0.00 0.00 27.41 28.51 3d6b h HIS 270 CO -0.25 0.51 -0.09 0.82 0.86 0.00 0.00 177.93 179.78 3d6b h ILE 271 N 0.25 0.74 -0.48 2.45 2.04 -0.55 -1.30 117.51 120.66 3d6b h ILE 271 Ca 0.08 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.95 3d6b h ILE 271 Cb 0.29 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 3d6b h ILE 271 CO 0.00 0.00 0.31 0.00 0.00 0.00 0.00 178.15 178.47 3d6b h ALA 272 N 1.01 0.61 -0.30 1.87 0.00 -0.67 -0.64 119.26 121.13 3d6b h ALA 272 Ca 0.08 -0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.97 3d6b h ALA 272 Cb 0.21 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3d6b h ALA 272 CO -0.18 0.06 0.15 -0.09 0.00 0.00 0.00 179.25 179.19 3d6b h ARG 273 N 0.65 0.30 -0.75 0.00 2.43 -0.43 -2.60 114.38 113.97 3d6b h ARG 273 Ca 0.17 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.33 3d6b h ARG 273 Cb -0.07 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 29.38 3d6b h ARG 273 CO -0.04 0.20 0.47 0.37 -1.51 0.00 0.00 179.97 179.46 3d6b h GLN 274 N 0.31 1.01 -0.44 0.20 5.75 -0.96 -2.49 115.11 118.49 3d6b h GLN 274 Ca 0.13 -0.08 0.06 0.00 -0.15 0.00 0.00 58.65 58.61 3d6b h GLN 274 Cb 0.05 -0.22 -0.06 0.00 1.07 0.00 0.00 27.48 28.33 3d6b h GLN 274 CO -0.09 0.70 0.12 -0.92 -2.65 0.00 0.00 178.83 176.00 3d6b h TYR 275 N 1.03 0.21 0.00 3.99 3.20 -0.89 -1.16 116.97 123.35 3d6b h TYR 275 Ca 0.27 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.14 3d6b h TYR 275 Cb -0.06 -0.03 -0.00 0.00 1.54 0.00 0.00 36.73 38.18 3d6b h TYR 275 CO -0.01 0.05 -0.14 -0.39 -1.64 0.00 0.00 178.16 176.03 3d6b h VAL 276 N 0.27 0.29 -0.11 1.81 -1.51 -1.28 -2.97 116.25 112.77 3d6b h VAL 276 Ca 0.21 -1.11 -0.24 0.00 -1.23 0.00 0.00 66.70 64.34 3d6b h VAL 276 Cb 0.24 1.88 0.01 0.00 -2.13 0.00 0.00 31.29 31.29 3d6b h VAL 276 CO -0.25 0.14 -0.87 -0.07 -1.23 0.00 0.00 177.57 175.30 3d6b h LEU 277 N 0.00 0.94 0.00 4.19 4.07 -0.98 -2.28 115.31 121.25 3d6b h LEU 277 Ca -0.00 -0.66 0.00 0.00 0.08 0.00 0.00 57.88 57.30 3d6b h LEU 277 Cb 0.87 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.32 3d6b h LEU 277 CO 0.02 1.46 0.00 0.47 -1.08 0.00 0.00 178.44 179.31 3d6b n ASP 278 N -3.91 0.00 0.00 -0.43 10.43 -0.48 -4.93 116.55 117.23 3d6b n ASP 278 Ca -0.09 -0.71 0.00 0.00 2.57 0.00 0.00 54.79 56.56 3d6b n ASP 278 Cb 0.79 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.75 3d6b n ASP 278 CO 0.00 0.00 0.00 -2.11 -1.07 0.00 0.00 177.20 174.02 3d6b n ARG 279 N -0.98 0.00 0.00 -1.24 0.00 -1.22 -5.09 116.66 108.13 3d6b n ARG 279 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.01 3d6b n ARG 279 Cb 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.53 3d6b n ARG 279 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 3d6b n LEU 286 N -0.66 0.00 0.04 2.89 4.32 -1.25 -4.99 117.00 117.35 3d6b n LEU 286 Ca 0.00 0.00 0.09 0.00 -0.02 0.00 0.00 56.01 56.08 3d6b n LEU 286 Cb 0.00 0.00 0.39 0.00 -1.62 0.00 0.00 43.42 42.19 3d6b n LEU 286 CO 0.00 0.00 0.79 0.00 -1.22 0.00 0.00 177.39 176.96 3d6b n ALA 287 N 0.00 1.73 0.81 -1.18 0.00 -0.86 -1.72 120.51 119.29 3d6b n ALA 287 Ca 0.00 -0.01 0.13 0.00 0.00 0.00 0.00 53.44 53.56 3d6b n ALA 287 Cb 0.00 -1.30 0.46 0.00 0.00 0.00 0.00 19.45 18.60 3d6b n ALA 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d6b n ALA 288 N -1.59 2.48 -2.38 0.00 0.00 -1.26 -4.81 120.51 112.94 3d6b n ALA 288 Ca 0.03 -0.11 -0.42 0.00 0.00 0.00 0.00 53.44 52.94 3d6b n ALA 288 Cb 0.21 -1.41 -0.03 0.00 0.00 0.00 0.00 19.45 18.22 3d6b n ALA 288 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3d6b s ASN 289 N -3.73 7.00 0.28 0.00 2.47 -0.70 -4.95 114.94 115.31 3d6b s ASN 289 Ca 0.12 1.94 0.11 0.00 0.42 0.00 0.00 52.86 55.45 3d6b s ASN 289 Cb 0.16 -2.56 0.38 0.00 -1.45 0.00 0.00 41.25 37.78 3d6b s ASN 289 CO 0.59 -0.60 1.63 1.56 -3.72 0.00 0.00 177.10 176.56 3d6b h GLN 290 N 7.41 0.00 0.04 0.43 4.20 -1.89 -1.78 115.11 123.52 3d6b h GLN 290 Ca -0.37 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.34 3d6b h GLN 290 Cb 1.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.96 3d6b h GLN 290 CO 0.87 0.60 -0.02 -0.07 -0.67 0.00 0.00 178.83 179.54 3d6b h LEU 291 N 0.00 -0.04 -0.50 1.46 4.07 -1.97 -2.15 115.31 116.18 3d6b h LEU 291 Ca -0.01 -0.03 0.08 0.00 0.08 0.00 0.00 57.88 58.01 3d6b h LEU 291 Cb 1.07 0.01 -0.07 0.00 1.08 0.00 0.00 40.66 42.75 3d6b h LEU 291 CO 0.08 -0.00 0.13 0.40 -1.08 0.00 0.00 178.44 177.97 3d6b h ILE 292 N -0.08 0.76 -0.42 1.22 1.08 -1.85 -2.26 117.51 115.96 3d6b h ILE 292 Ca -0.01 -0.10 -0.02 0.00 -0.39 0.00 0.00 64.86 64.35 3d6b h ILE 292 Cb 0.07 0.45 -0.02 0.00 -3.07 0.00 0.00 36.82 34.25 3d6b h ILE 292 CO 0.01 0.05 0.17 1.56 -0.69 0.00 0.00 178.15 179.25 3d6b h GLN 293 N 0.28 0.62 -0.66 2.37 4.20 -1.25 0.88 115.11 121.54 3d6b h GLN 293 Ca 0.25 -0.11 0.08 0.00 0.06 0.00 0.00 58.65 58.93 3d6b h GLN 293 Cb 0.32 -0.10 -0.06 0.00 0.30 0.00 0.00 27.48 27.93 3d6b h GLN 293 CO -0.30 0.58 0.33 -0.22 -0.67 0.00 0.00 178.83 178.55 3d6b h LYS 294 N 0.53 0.56 -0.36 1.46 3.64 -1.28 0.23 116.57 121.35 3d6b h LYS 294 Ca 0.14 -0.03 -0.04 0.00 -1.27 0.00 0.00 60.65 59.45 3d6b h LYS 294 Cb 0.19 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.86 3d6b h LYS 294 CO -0.01 0.37 0.08 0.87 -2.27 0.00 0.00 179.45 178.49 3d6b h LYS 295 N 0.58 0.58 -0.28 1.90 1.57 -0.71 -0.93 116.57 119.27 3d6b h LYS 295 Ca 0.32 -0.15 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 3d6b h LYS 295 Cb 0.31 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 3d6b h LYS 295 CO -0.24 0.64 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.11 3d6b h LEU 296 N 0.43 0.44 -0.35 2.94 3.38 -0.63 -2.07 115.31 119.46 3d6b h LEU 296 Ca 0.11 -0.10 -0.13 0.00 0.09 0.00 0.00 57.88 57.85 3d6b h LEU 296 Cb 0.32 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 3d6b h LEU 296 CO 0.00 0.58 -0.29 0.00 0.09 0.00 0.00 178.44 178.83 3d6b h ALA 297 N 1.47 0.51 -0.51 1.53 0.00 -0.70 -1.43 119.26 120.13 3d6b h ALA 297 Ca 0.09 -0.41 0.02 0.00 0.00 0.00 0.00 54.91 54.61 3d6b h ALA 297 Cb 0.43 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.08 3d6b h ALA 297 CO 0.02 0.53 0.31 -0.44 0.00 0.00 0.00 179.25 179.68 3d6b h ASP 298 N 0.60 0.51 0.28 0.00 3.32 -1.00 0.12 116.42 120.25 3d6b h ASP 298 Ca 0.06 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.11 3d6b h ASP 298 Cb 0.86 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 3d6b h ASP 298 CO 0.07 0.36 -0.18 0.24 -1.72 0.00 0.00 179.24 178.02 3d6b h MET 299 N 0.62 -0.43 -0.24 3.56 2.86 -1.33 -1.58 114.93 118.40 3d6b h MET 299 Ca 0.20 0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.93 3d6b h MET 299 Cb 0.01 0.10 -0.07 0.00 0.06 0.00 0.00 31.60 31.69 3d6b h MET 299 CO -0.09 -0.29 -0.26 0.37 1.06 0.00 0.00 176.91 177.71 3d6b h GLN 300 N -0.45 -0.26 0.41 1.72 4.15 -1.08 -2.04 115.11 117.57 3d6b h GLN 300 Ca -0.02 0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 3d6b h GLN 300 Cb 0.38 0.06 -0.01 0.00 0.21 0.00 0.00 27.48 28.11 3d6b h GLN 300 CO 0.02 -0.17 -0.33 1.15 -1.93 0.00 0.00 178.83 177.57 3d6b h THR 301 N -0.27 0.32 -0.45 2.39 2.02 -0.71 -1.29 112.91 114.92 3d6b h THR 301 Ca 0.13 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.26 3d6b h THR 301 Cb 0.48 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 3d6b h THR 301 CO -0.39 0.00 0.06 -0.33 0.37 0.00 0.00 175.52 175.22 3d6b h GLU 302 N -0.74 0.70 -0.09 6.66 4.39 -1.24 -0.30 114.58 123.96 3d6b h GLU 302 Ca -0.04 -0.15 -0.03 0.00 0.34 0.00 0.00 59.36 59.48 3d6b h GLU 302 Cb 0.64 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.19 3d6b h GLU 302 CO -0.01 0.68 -0.05 0.82 -1.16 0.00 0.00 179.01 179.29 3d6b h ILE 303 N 0.67 1.32 -0.47 3.13 2.04 -1.38 -0.10 117.51 122.72 3d6b h ILE 303 Ca 0.14 -1.06 0.05 0.00 1.00 0.00 0.00 64.86 64.99 3d6b h ILE 303 Cb 0.33 1.84 -0.05 0.00 -0.74 0.00 0.00 36.82 38.21 3d6b h ILE 303 CO 0.01 0.30 0.21 0.74 0.00 0.00 0.00 178.15 179.40 3d6b h THR 304 N -0.17 0.92 -0.22 -0.27 2.02 -0.97 -0.97 112.91 113.24 3d6b h THR 304 Ca 0.02 -0.14 -0.10 0.00 0.77 0.00 0.00 66.41 66.96 3d6b h THR 304 Cb 0.50 0.47 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 3d6b h THR 304 CO 0.01 0.08 -0.23 -0.07 0.37 0.00 0.00 175.52 175.67 3d6b h LEU 305 N 0.41 0.60 -1.16 2.58 3.38 -1.12 -2.97 115.31 117.02 3d6b h LEU 305 Ca 0.21 -0.48 0.21 0.00 0.09 0.00 0.00 57.88 57.91 3d6b h LEU 305 Cb 0.16 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 40.64 3d6b h LEU 305 CO -0.18 0.95 0.62 1.23 0.09 0.00 0.00 178.44 181.16 3d6b h GLY 306 N 0.25 1.53 0.93 0.83 0.00 -0.67 -2.58 103.07 103.36 3d6b h GLY 306 Ca 0.03 -0.30 -0.14 0.00 0.00 0.00 0.00 47.33 46.92 3d6b h GLY 306 CO 0.06 -0.08 -0.44 1.41 0.00 0.00 0.00 176.54 177.49 3d6b h LEU 307 N 0.63 0.69 -1.12 3.11 3.38 -1.12 -2.20 115.31 118.67 3d6b h LEU 307 Ca 0.57 -0.58 0.13 0.00 0.09 0.00 0.00 57.88 58.09 3d6b h LEU 307 Cb 1.07 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.54 3d6b h LEU 307 CO -0.34 1.14 0.61 1.56 0.09 0.00 0.00 178.44 181.50 3d6b h GLN 308 N 0.27 0.84 0.05 1.13 1.08 -1.34 -0.42 115.11 116.72 3d6b h GLN 308 Ca -0.01 -0.05 -0.00 0.00 -1.45 0.00 0.00 58.65 57.14 3d6b h GLN 308 Cb 1.05 -0.19 0.00 0.00 -0.05 0.00 0.00 27.48 28.29 3d6b h GLN 308 CO 0.10 0.55 -0.02 0.78 -0.95 0.00 0.00 178.83 179.29 3d6b h GLY 309 N 0.86 -0.07 1.46 3.46 0.00 -1.28 -1.80 103.07 105.71 3d6b h GLY 309 Ca 0.48 0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.74 3d6b h GLY 309 CO -0.25 -0.03 -0.18 -0.39 0.00 0.00 0.00 176.54 175.70 3d6b h VAL 310 N -0.47 1.26 0.10 4.60 -1.51 -1.22 -0.60 116.25 118.41 3d6b h VAL 310 Ca -0.01 -1.21 -0.00 0.00 -1.23 0.00 0.00 66.70 64.25 3d6b h VAL 310 Cb 0.42 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 30.77 3d6b h VAL 310 CO 0.01 0.40 -0.05 0.25 -1.23 0.00 0.00 177.57 176.95 3d6b h LEU 311 N 0.57 -0.11 -0.91 4.19 5.85 -1.10 -0.10 115.31 123.69 3d6b h LEU 311 Ca 0.09 -0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 3d6b h LEU 311 Cb 0.62 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.64 3d6b h LEU 311 CO 0.04 -0.06 0.51 -0.09 -0.34 0.00 0.00 178.44 178.51 3d6b h ARG 312 N -0.16 1.26 -0.78 1.25 9.65 -1.17 0.01 114.38 124.45 3d6b h ARG 312 Ca -0.01 -0.14 -0.01 0.00 -1.10 0.00 0.00 59.98 58.72 3d6b h ARG 312 Cb 0.13 -0.25 -0.04 0.00 -1.39 0.00 0.00 29.97 28.42 3d6b h ARG 312 CO 0.02 0.91 0.47 1.25 2.80 0.00 0.00 179.97 185.42 3d6b h LEU 313 N 1.27 0.94 0.12 3.80 6.46 -0.94 -1.91 115.31 125.05 3d6b h LEU 313 Ca 0.32 -0.07 -0.01 0.00 -0.12 0.00 0.00 57.88 58.01 3d6b h LEU 313 Cb 0.00 -0.24 0.00 0.00 -0.73 0.00 0.00 40.66 39.70 3d6b h LEU 313 CO -0.05 0.73 -0.06 1.23 -0.62 0.00 0.00 178.44 179.66 3d6b h GLY 314 N 1.06 -0.17 0.67 3.75 0.00 0.18 -0.00 103.07 108.56 3d6b h GLY 314 Ca 0.28 0.06 0.07 0.00 0.00 0.00 0.00 47.33 47.74 3d6b h GLY 314 CO -0.05 -0.06 0.45 3.21 0.00 0.00 0.00 176.54 180.09 3d6b h ARG 315 N -0.24 0.79 -0.60 4.80 2.47 -0.94 -1.64 114.38 119.03 3d6b h ARG 315 Ca -0.02 -0.05 -0.08 0.00 -1.26 0.00 0.00 59.98 58.57 3d6b h ARG 315 Cb 0.19 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 28.31 3d6b h ARG 315 CO 0.03 0.52 0.06 0.52 0.56 0.00 0.00 179.97 181.66 3d6b h MET 316 N 0.82 1.02 -0.60 0.04 2.86 -1.24 -1.99 114.93 115.84 3d6b h MET 316 Ca 0.35 -0.29 -0.00 0.00 -2.06 0.00 0.00 59.70 57.69 3d6b h MET 316 Cb 0.21 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 3d6b h MET 316 CO -0.19 0.98 0.37 0.87 1.06 0.00 0.00 176.91 179.99 3d6b h LYS 317 N 0.92 0.80 0.00 1.72 1.57 -0.32 -0.95 116.57 120.31 3d6b h LYS 317 Ca 0.18 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.89 3d6b h LYS 317 Cb 0.48 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.61 3d6b h LYS 317 CO 0.02 0.56 0.00 -0.44 -0.57 0.00 0.00 179.45 179.02 3d6b h ASP 318 N 0.82 0.00 -0.02 0.86 3.32 -1.09 -3.14 116.42 117.17 3d6b h ASP 318 Ca 0.22 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.27 3d6b h ASP 318 Cb -0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.51 3d6b h ASP 318 CO -0.04 0.00 -0.43 -0.62 -1.72 0.00 0.00 179.24 176.42 3d6b n GLU 319 N -2.53 1.32 -0.96 3.56 1.02 -0.77 -4.97 120.64 117.30 3d6b n GLU 319 Ca 0.05 -1.08 0.00 0.00 -0.02 0.00 0.00 57.16 56.11 3d6b n GLU 319 Cb 0.45 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.40 3d6b n GLU 319 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d6b n GLY 320 N 1.41 0.47 0.73 0.62 0.00 -0.54 -4.91 105.19 102.98 3d6b n GLY 320 Ca 0.10 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.21 3d6b n GLY 320 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d6b n THR 321 N -2.54 0.37 -3.43 2.61 -2.24 -0.48 -4.87 114.28 103.71 3d6b n THR 321 Ca 0.00 -0.48 -0.41 0.00 -2.27 0.00 0.00 64.05 60.89 3d6b n THR 321 Cb 0.09 0.45 -0.10 0.00 -2.10 0.00 0.00 70.33 68.68 3d6b n THR 321 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d6b s ALA 322 N -1.63 3.50 0.50 6.98 0.00 -1.14 -4.95 121.76 125.02 3d6b s ALA 322 Ca 0.32 -1.26 -0.17 0.00 0.00 0.00 0.00 51.96 50.85 3d6b s ALA 322 Cb 0.18 -2.80 -0.08 0.00 0.00 0.00 0.00 23.12 20.42 3d6b s ALA 322 CO 0.25 -1.07 0.98 0.00 0.00 0.00 0.00 175.76 175.92 3d6b s ALA 323 N 1.96 3.07 0.38 0.00 0.00 -1.26 -4.90 121.76 121.00 3d6b s ALA 323 Ca 0.10 0.21 0.07 0.00 0.00 0.00 0.00 51.96 52.34 3d6b s ALA 323 Cb -0.17 -3.12 0.79 0.00 0.00 0.00 0.00 23.12 20.63 3d6b s ALA 323 CO 0.11 -0.18 2.00 0.28 0.00 0.00 0.00 175.76 177.98 3d6b h VAL 324 N 1.06 1.05 -0.43 0.00 2.07 -2.02 -2.66 116.25 115.33 3d6b h VAL 324 Ca -0.47 -0.23 0.09 0.00 0.82 0.00 0.00 66.70 66.90 3d6b h VAL 324 Cb 1.18 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 3d6b h VAL 324 CO 0.61 0.12 0.29 -0.33 0.02 0.00 0.00 177.57 178.29 3d6b h GLU 325 N 0.67 0.19 -0.56 1.57 3.07 -1.98 -1.95 114.58 115.59 3d6b h GLU 325 Ca 0.25 -0.01 0.04 0.00 -0.50 0.00 0.00 59.36 59.14 3d6b h GLU 325 Cb 0.14 -0.04 -0.03 0.00 -0.84 0.00 0.00 28.75 27.97 3d6b h GLU 325 CO -0.07 0.13 0.37 0.82 -1.40 0.00 0.00 179.01 178.86 3d6b h ILE 326 N 0.20 1.03 -0.08 3.13 2.04 -1.87 -0.63 117.51 121.34 3d6b h ILE 326 Ca 0.20 -0.20 -0.02 0.00 1.00 0.00 0.00 64.86 65.83 3d6b h ILE 326 Cb 0.52 0.39 -0.01 0.00 -0.74 0.00 0.00 36.82 36.99 3d6b h ILE 326 CO -0.03 0.11 -0.05 0.74 0.00 0.00 0.00 178.15 178.92 3d6b h THR 327 N 0.59 1.08 -0.40 -0.27 2.02 -1.52 -2.32 112.91 112.09 3d6b h THR 327 Ca 0.23 -0.35 -0.11 0.00 0.77 0.00 0.00 66.41 66.95 3d6b h THR 327 Cb 0.17 1.08 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 3d6b h THR 327 CO -0.06 0.11 -0.19 0.28 0.37 0.00 0.00 175.52 176.03 3d6b h SER 328 N 0.11 0.78 0.09 4.18 0.02 -1.20 -1.57 113.55 115.96 3d6b h SER 328 Ca 0.03 -0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 60.71 3d6b h SER 328 Cb 0.16 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 62.49 3d6b h SER 328 CO 0.01 0.95 -0.04 0.40 -1.14 0.00 0.00 176.83 177.01 3d6b h ILE 329 N 0.68 1.00 0.01 3.27 2.04 -1.30 -2.64 117.51 120.57 3d6b h ILE 329 Ca 0.10 -0.33 -0.26 0.00 1.00 0.00 0.00 64.86 65.38 3d6b h ILE 329 Cb 0.68 1.21 0.02 0.00 -0.74 0.00 0.00 36.82 37.99 3d6b h ILE 329 CO 0.05 0.08 -1.03 0.24 0.00 0.00 0.00 178.15 177.49 3d6b h MET 330 N -0.27 0.59 -0.01 2.37 2.86 -1.46 -1.54 114.93 117.47 3d6b h MET 330 Ca -0.01 -0.65 -0.00 0.00 -2.06 0.00 0.00 59.70 56.97 3d6b h MET 330 Cb 0.23 0.19 -0.00 0.00 0.06 0.00 0.00 31.60 32.08 3d6b h MET 330 CO 0.02 1.26 -0.00 -0.22 1.06 0.00 0.00 176.91 179.03 3d6b h LYS 331 N 0.32 0.01 -0.49 1.72 3.11 -1.39 -0.66 116.57 119.19 3d6b h LYS 331 Ca -0.12 -0.00 0.06 0.00 -2.81 0.00 0.00 60.65 57.77 3d6b h LYS 331 Cb 1.68 -0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 32.86 3d6b h LYS 331 CO 0.19 0.34 0.21 -0.09 -2.81 0.00 0.00 179.45 177.29 3d6b h ARG 332 N -0.31 0.40 -0.25 1.90 2.43 -1.51 -2.05 114.38 114.99 3d6b h ARG 332 Ca 0.00 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 3d6b h ARG 332 Cb 0.33 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.78 3d6b h ARG 332 CO 0.00 0.26 -0.02 -0.97 -1.51 0.00 0.00 179.97 177.73 3d6b h ASN 333 N 0.41 0.45 -0.09 -3.80 -1.24 -1.24 -1.32 115.58 108.75 3d6b h ASN 333 Ca 0.23 -0.33 -0.01 0.00 0.71 0.00 0.00 56.30 56.90 3d6b h ASN 333 Cb 0.20 -0.12 -0.00 0.00 0.73 0.00 0.00 38.32 39.12 3d6b h ASN 333 CO -0.20 0.67 0.03 0.28 -1.29 0.00 0.00 177.43 176.92 3d6b h SER 334 N 0.21 0.13 -0.15 1.15 0.02 -1.04 0.73 113.55 114.60 3d6b h SER 334 Ca 0.07 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.81 3d6b h SER 334 Cb 0.46 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 3d6b h SER 334 CO 0.02 0.30 0.06 0.00 -1.14 0.00 0.00 176.83 176.06 3d6b h GLY 336 N 0.08 0.29 1.59 0.00 0.00 -1.21 -1.71 103.07 102.12 3d6b h GLY 336 Ca 0.05 -0.18 -0.08 0.00 0.00 0.00 0.00 47.33 47.11 3d6b h GLY 336 CO -0.00 0.17 -0.20 0.50 0.00 0.00 0.00 176.54 177.01 3d6b h LYS 337 N 0.09 0.48 -0.37 4.80 1.79 -0.84 -1.71 116.57 120.82 3d6b h LYS 337 Ca 0.05 -0.16 -0.07 0.00 -2.18 0.00 0.00 60.65 58.29 3d6b h LYS 337 Cb 0.25 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.85 3d6b h LYS 337 CO -0.00 0.66 -0.04 0.00 -1.08 0.00 0.00 179.45 178.99 3d6b h ALA 338 N 1.36 0.50 -0.48 3.86 0.00 -0.60 0.02 119.26 123.92 3d6b h ALA 338 Ca 0.07 -0.28 0.02 0.00 0.00 0.00 0.00 54.91 54.73 3d6b h ALA 338 Cb 0.59 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3d6b h ALA 338 CO 0.04 0.31 0.29 1.25 0.00 0.00 0.00 179.25 181.14 3d6b h LEU 339 N 0.48 0.48 -0.60 0.00 5.85 -1.22 0.12 115.31 120.43 3d6b h LEU 339 Ca 0.10 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.85 3d6b h LEU 339 Cb 0.52 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.41 3d6b h LEU 339 CO 0.03 0.34 0.35 0.44 -0.34 0.00 0.00 178.44 179.26 3d6b h ASP 340 N 0.59 0.56 -0.22 1.25 3.45 -1.00 -1.81 116.42 119.24 3d6b h ASP 340 Ca 0.19 0.01 -0.13 0.00 0.43 0.00 0.00 57.03 57.53 3d6b h ASP 340 Cb 0.00 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 38.65 3d6b h ASP 340 CO -0.08 0.39 -0.33 0.40 -1.57 0.00 0.00 179.24 178.04 3d6b h ILE 341 N 0.69 1.28 -0.63 0.35 2.04 -0.63 -0.47 117.51 120.14 3d6b h ILE 341 Ca 0.25 -1.48 -0.06 0.00 1.00 0.00 0.00 64.86 64.56 3d6b h ILE 341 Cb 0.06 1.38 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3d6b h ILE 341 CO -0.12 0.49 0.15 0.00 0.00 0.00 0.00 178.15 178.67 3d6b h ALA 342 N 1.00 1.09 -0.23 1.87 0.00 -0.54 -0.44 119.26 122.01 3d6b h ALA 342 Ca 0.07 -0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.59 3d6b h ALA 342 Cb 0.86 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3d6b h ALA 342 CO 0.08 0.61 -0.52 0.00 0.00 0.00 0.00 179.25 179.42 3d6b h ARG 343 N 0.94 0.66 -0.31 0.00 3.08 -1.13 -1.15 114.38 116.46 3d6b h ARG 343 Ca 0.20 -0.40 -0.02 0.00 0.07 0.00 0.00 59.98 59.83 3d6b h ARG 343 Cb 0.33 0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.41 3d6b h ARG 343 CO -0.00 1.01 0.11 1.25 -1.07 0.00 0.00 179.97 181.28 3d6b h LEU 344 N 0.51 0.44 -0.36 3.04 5.85 -0.89 -2.19 115.31 121.71 3d6b h LEU 344 Ca 0.02 -0.18 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 3d6b h LEU 344 Cb 1.07 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.97 3d6b h LEU 344 CO 0.10 0.50 0.13 0.00 -0.34 0.00 0.00 178.44 178.84 3d6b h ALA 345 N 0.95 0.48 -0.40 1.25 0.00 -1.04 -2.97 119.26 117.53 3d6b h ALA 345 Ca 0.10 -0.15 0.04 0.00 0.00 0.00 0.00 54.91 54.91 3d6b h ALA 345 Cb 0.21 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 3d6b h ALA 345 CO -0.01 0.10 0.16 -0.09 0.00 0.00 0.00 179.25 179.41 3d6b h ARG 346 N 0.44 0.32 0.00 0.00 9.65 -1.17 -1.89 114.38 121.72 3d6b h ARG 346 Ca 0.12 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.98 3d6b h ARG 346 Cb 0.23 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 28.73 3d6b h ARG 346 CO -0.01 0.21 0.00 -0.25 2.80 0.00 0.00 179.97 182.72 3d6b n ASP 347 N -4.99 0.14 0.08 -3.80 10.43 -0.83 -1.76 116.55 115.82 3d6b n ASP 347 Ca 0.02 0.54 0.09 0.00 2.57 0.00 0.00 54.79 58.01 3d6b n ASP 347 Cb 0.14 -0.57 -0.03 0.00 1.84 0.00 0.00 41.12 42.49 3d6b n ASP 347 CO 0.00 0.00 0.00 0.23 -1.07 0.00 0.00 177.20 176.36 3d6b n MET 348 N -1.67 0.61 -1.75 -1.24 2.81 -0.73 -4.98 117.12 110.18 3d6b n MET 348 Ca 0.02 0.12 -0.29 0.00 -1.81 0.00 0.00 57.70 55.74 3d6b n MET 348 Cb 0.15 -1.80 0.10 0.00 -0.71 0.00 0.00 33.22 30.96 3d6b n MET 348 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3d6b s LEU 349 N -5.40 2.41 0.00 4.03 1.43 -0.72 -5.02 118.68 115.41 3d6b s LEU 349 Ca -0.02 0.94 0.00 0.00 -1.03 0.00 0.00 54.13 54.02 3d6b s LEU 349 Cb 0.10 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.89 3d6b s LEU 349 CO 0.80 -2.04 0.37 0.61 0.23 0.00 0.00 176.35 176.32 3d6b n GLY 350 N -2.81 -0.66 4.05 -3.19 0.00 -1.26 -5.06 105.19 96.26 3d6b n GLY 350 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3d6b n GLY 350 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d6b n GLY 359 N -0.01 0.00 0.17 -0.02 0.00 -1.26 -5.28 105.19 98.78 3d6b n GLY 359 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 3d6b n GLY 359 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3d6b h VAL 360 N 0.00 0.82 -0.71 1.61 2.07 -1.96 -1.36 116.25 116.71 3d6b h VAL 360 Ca 0.00 -0.08 0.03 0.00 0.82 0.00 0.00 66.70 67.47 3d6b h VAL 360 Cb 0.00 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.30 3d6b h VAL 360 CO 0.00 0.04 0.47 0.00 0.02 0.00 0.00 177.57 178.10 3d6b h ALA 361 N 1.29 1.59 -0.19 1.67 0.00 -1.99 0.43 119.26 122.05 3d6b h ALA 361 Ca 0.19 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.95 3d6b h ALA 361 Cb 0.21 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 3d6b h ALA 361 CO -0.23 0.34 -0.31 -0.09 0.00 0.00 0.00 179.25 178.96 3d6b h ARG 362 N 0.87 0.55 -0.86 0.00 2.43 -1.87 -2.30 114.38 113.19 3d6b h ARG 362 Ca 0.28 -0.33 0.01 0.00 -0.81 0.00 0.00 59.98 59.13 3d6b h ARG 362 Cb 0.06 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.60 3d6b h ARG 362 CO -0.08 0.94 0.57 0.45 -1.51 0.00 0.00 179.97 180.34 3d6b h HIS 363 N 0.21 1.08 0.44 2.20 3.86 -0.78 -1.84 115.15 120.31 3d6b h HIS 363 Ca 0.02 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 3d6b h HIS 363 Cb 0.89 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 29.00 3d6b h HIS 363 CO 0.09 0.67 -0.21 1.25 0.86 0.00 0.00 177.93 180.59 3d6b h LEU 364 N 1.16 -0.50 -1.34 2.43 5.85 -0.82 0.13 115.31 122.21 3d6b h LEU 364 Ca 0.32 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.99 3d6b h LEU 364 Cb -0.12 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 3d6b h LEU 364 CO -0.07 -0.28 0.25 -0.37 -0.34 0.00 0.00 178.44 177.63 3d6b h VAL 365 N -0.69 1.17 0.35 1.05 -1.51 -1.37 -0.53 116.25 114.72 3d6b h VAL 365 Ca -0.06 -0.45 -0.01 0.00 -1.23 0.00 0.00 66.70 64.94 3d6b h VAL 365 Cb 0.50 0.51 -0.01 0.00 -2.13 0.00 0.00 31.29 30.16 3d6b h VAL 365 CO 0.10 0.19 -0.23 0.78 -1.23 0.00 0.00 177.57 177.18 3d6b h ASN 366 N 0.71 -0.59 0.01 4.19 -0.26 -1.13 -2.70 115.58 115.81 3d6b h ASN 366 Ca 0.18 0.04 -0.04 0.00 -0.56 0.00 0.00 56.30 55.92 3d6b h ASN 366 Cb 0.06 0.18 -0.01 0.00 -1.06 0.00 0.00 38.32 37.49 3d6b h ASN 366 CO -0.03 -0.37 -0.10 -0.07 -1.06 0.00 0.00 177.43 175.81 3d6b h LEU 367 N -0.57 0.18 -0.93 1.61 3.38 -0.46 -1.17 115.31 117.35 3d6b h LEU 367 Ca -0.03 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.91 3d6b h LEU 367 Cb 0.48 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.14 3d6b h LEU 367 CO 0.02 0.31 0.60 -0.33 0.09 0.00 0.00 178.44 179.13 3d6b h GLU 368 N 0.19 1.23 -0.17 1.13 5.08 -0.97 -1.23 114.58 119.84 3d6b h GLU 368 Ca 0.04 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 3d6b h GLU 368 Cb 0.30 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 3d6b h GLU 368 CO 0.02 0.83 -0.10 0.28 -1.00 0.00 0.00 179.01 179.03 3d6b h VAL 369 N 1.27 1.32 -0.77 3.13 2.07 -1.03 -3.28 116.25 118.96 3d6b h VAL 369 Ca 0.34 -1.17 -0.02 0.00 0.82 0.00 0.00 66.70 66.66 3d6b h VAL 369 Cb -0.12 1.72 -0.04 0.00 -1.52 0.00 0.00 31.29 31.33 3d6b h VAL 369 CO -0.07 0.35 0.39 0.58 0.02 0.00 0.00 177.57 178.84 3d6b h VAL 370 N 0.04 1.23 0.00 2.57 2.07 -0.98 -1.02 116.25 120.17 3d6b h VAL 370 Ca 0.04 -0.62 -0.04 0.00 0.82 0.00 0.00 66.70 66.89 3d6b h VAL 370 Cb 0.59 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 3d6b h VAL 370 CO 0.03 0.27 -0.21 0.78 0.02 0.00 0.00 177.57 178.46 3d6b h ASN 371 N 1.09 0.00 -0.13 0.57 4.21 -1.33 -3.17 115.58 116.81 3d6b h ASN 371 Ca 0.27 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.78 3d6b h ASN 371 Cb 0.07 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.27 3d6b h ASN 371 CO -0.04 0.21 0.00 0.35 -1.29 0.00 0.00 177.43 176.66 3d6b n THR 372 N -3.54 0.30 -0.07 2.81 -2.24 -0.80 -4.63 114.28 106.11 3d6b n THR 372 Ca -0.01 -0.65 -0.01 0.00 -2.27 0.00 0.00 64.05 61.12 3d6b n THR 372 Cb 0.36 1.04 0.27 0.00 -2.10 0.00 0.00 70.33 69.90 3d6b n THR 372 CO 0.00 0.00 0.00 0.22 -0.57 0.00 0.00 175.07 174.72 3d6b h TYR 373 N 2.51 0.69 -0.40 4.78 3.20 -1.18 -1.95 116.97 124.62 3d6b h TYR 373 Ca 0.00 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.82 3d6b h TYR 373 Cb 0.61 -0.21 0.00 0.00 1.54 0.00 0.00 36.73 38.67 3d6b h TYR 373 CO 0.08 0.59 0.00 0.39 -1.64 0.00 0.00 178.16 177.58 3d6b n GLU 374 N -4.31 1.97 0.00 1.82 1.02 -1.26 -5.02 120.64 114.86 3d6b n GLU 374 Ca 0.03 -1.45 0.00 0.00 -0.02 0.00 0.00 57.16 55.72 3d6b n GLU 374 Cb 0.20 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 30.29 3d6b n GLU 374 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3d6b n GLY 375 N 1.11 -0.06 0.03 0.62 0.00 -0.73 -4.71 105.19 101.44 3d6b n GLY 375 Ca 0.13 -2.28 0.02 0.00 0.00 0.00 0.00 46.02 43.89 3d6b n GLY 375 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3d6b n THR 376 N -0.48 1.05 -0.35 2.61 -2.24 -1.26 -4.44 114.28 109.16 3d6b n THR 376 Ca 0.00 -1.12 0.11 0.00 -2.27 0.00 0.00 64.05 60.76 3d6b n THR 376 Cb 0.00 0.40 0.30 0.00 -2.10 0.00 0.00 70.33 68.94 3d6b n THR 376 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d6b n HIS 377 N -0.62 0.92 -3.36 4.78 1.44 -1.26 -4.98 115.22 112.14 3d6b n HIS 377 Ca 0.03 -0.50 -0.18 0.00 -2.01 0.00 0.00 57.72 55.06 3d6b n HIS 377 Cb 0.36 -0.01 0.07 0.00 0.12 0.00 0.00 29.99 30.53 3d6b n HIS 377 CO 0.00 0.00 0.00 -3.47 -2.81 0.00 0.00 176.34 170.06 3d6b n ASP 378 N 1.50 -5.58 -0.33 4.39 -0.08 -1.26 -4.82 116.55 110.37 3d6b n ASP 378 Ca 0.23 -0.75 0.20 0.00 -1.51 0.00 0.00 54.79 52.97 3d6b n ASP 378 Cb 0.60 -4.89 0.42 0.00 2.34 0.00 0.00 41.12 39.59 3d6b n ASP 378 CO 0.00 0.00 0.00 -0.29 0.12 0.00 0.00 177.20 177.03 3d6b h ILE 379 N -1.34 0.31 0.00 5.18 2.10 -1.92 -2.19 117.51 119.66 3d6b h ILE 379 Ca -0.62 -0.10 -0.18 0.00 1.08 0.00 0.00 64.86 65.04 3d6b h ILE 379 Cb 1.32 -0.02 -0.03 0.00 -1.09 0.00 0.00 36.82 37.01 3d6b h ILE 379 CO 0.46 0.06 -0.86 0.45 -1.08 0.00 0.00 178.15 177.18 3d6b h HIS 380 N 0.30 0.00 -0.63 2.19 3.86 -1.90 -0.41 115.15 118.56 3d6b h HIS 380 Ca 0.68 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.87 3d6b h HIS 380 Cb 1.49 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.93 3d6b h HIS 380 CO -0.08 0.86 0.31 0.00 0.86 0.00 0.00 177.93 179.87 3d6b h ALA 381 N 1.14 0.81 -0.36 2.45 0.00 -1.74 -1.20 119.26 120.35 3d6b h ALA 381 Ca -0.01 -0.13 -0.15 0.00 0.00 0.00 0.00 54.91 54.62 3d6b h ALA 381 Cb 1.60 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 3d6b h ALA 381 CO 0.11 0.36 -0.38 -0.07 0.00 0.00 0.00 179.25 179.28 3d6b h LEU 382 N 0.86 0.93 -0.39 0.00 3.38 -1.23 0.43 115.31 119.28 3d6b h LEU 382 Ca 0.22 -0.42 0.02 0.00 0.09 0.00 0.00 57.88 57.78 3d6b h LEU 382 Cb 0.11 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 3d6b h LEU 382 CO -0.03 1.19 0.23 0.40 0.09 0.00 0.00 178.44 180.33 3d6b h ILE 383 N 0.71 1.05 -0.20 1.22 2.04 -1.03 -2.03 117.51 119.28 3d6b h ILE 383 Ca 0.06 -0.16 -0.18 0.00 1.00 0.00 0.00 64.86 65.58 3d6b h ILE 383 Cb 0.95 0.53 -0.00 0.00 -0.74 0.00 0.00 36.82 37.56 3d6b h ILE 383 CO 0.09 0.09 -0.61 -0.07 0.00 0.00 0.00 178.15 177.65 3d6b h LEU 384 N 0.47 0.75 -0.66 1.44 3.38 -0.97 -2.21 115.31 117.52 3d6b h LEU 384 Ca 0.16 -0.43 0.04 0.00 0.09 0.00 0.00 57.88 57.73 3d6b h LEU 384 Cb 0.00 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.49 3d6b h LEU 384 CO -0.07 1.19 0.40 1.23 0.09 0.00 0.00 178.44 181.28 3d6b h GLY 385 N 0.91 0.95 0.96 0.83 0.00 -0.09 -1.58 103.07 105.05 3d6b h GLY 385 Ca -0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 46.97 3d6b h GLY 385 CO 0.12 0.24 0.04 -0.09 0.00 0.00 0.00 176.54 176.85 3d6b h ARG 386 N 0.77 0.74 -0.69 4.80 2.43 -1.30 -2.03 114.38 119.10 3d6b h ARG 386 Ca 0.27 -0.21 -0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3d6b h ARG 386 Cb 0.06 -0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 3d6b h ARG 386 CO -0.12 0.79 0.42 0.00 -1.51 0.00 0.00 179.97 179.55 3d6b h ALA 387 N 0.92 1.44 -0.37 2.80 0.00 -1.11 0.88 119.26 123.82 3d6b h ALA 387 Ca 0.13 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.80 3d6b h ALA 387 Cb 0.43 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3d6b h ALA 387 CO 0.01 0.49 -0.41 1.96 0.00 0.00 0.00 179.25 181.30 3d6b h GLN 388 N 0.95 0.93 0.00 0.00 4.20 -1.22 -3.40 115.11 116.58 3d6b h GLN 388 Ca 0.25 -0.51 -0.06 0.00 0.06 0.00 0.00 58.65 58.40 3d6b h GLN 388 Cb -0.05 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 3d6b h GLN 388 CO -0.05 1.16 -1.53 0.25 -0.67 0.00 0.00 178.83 177.99 3d6b n THR 389 N -4.05 0.21 -1.01 -0.54 -2.24 -0.77 -5.01 114.28 100.86 3d6b n THR 389 Ca -0.03 -0.29 -0.00 0.00 -2.27 0.00 0.00 64.05 61.46 3d6b n THR 389 Cb 0.56 -0.06 -0.00 0.00 -2.10 0.00 0.00 70.33 68.72 3d6b n THR 389 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d6b n GLY 390 N 2.07 0.47 3.08 3.38 0.00 0.30 -5.02 105.19 109.48 3d6b n GLY 390 Ca -0.06 -0.28 -0.27 0.00 0.00 0.00 0.00 46.02 45.41 3d6b n GLY 390 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3d6b s ILE 391 N -1.96 1.41 0.27 -0.61 1.01 -1.25 -5.06 121.20 115.01 3d6b s ILE 391 Ca 0.00 -0.64 -0.29 0.00 0.00 0.00 0.00 60.65 59.72 3d6b s ILE 391 Cb 0.00 -1.26 -0.09 0.00 0.01 0.00 0.00 42.46 41.12 3d6b s ILE 391 CO 0.00 0.42 0.95 -1.58 0.00 0.00 0.00 174.94 174.73 3d6b s GLN 392 N 0.55 4.74 0.00 2.79 0.74 -1.26 -4.14 119.66 123.08 3d6b s GLN 392 Ca -0.16 1.46 0.27 0.00 0.05 0.00 0.00 55.36 56.98 3d6b s GLN 392 Cb -0.16 -3.10 1.59 0.00 1.10 0.00 0.00 33.01 32.43 3d6b s GLN 392 CO 0.05 0.41 1.94 0.00 -0.55 0.00 0.00 175.29 177.14