#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w6x s VAL 1 N 0.00 -0.12 0.40 3.17 1.01 -1.26 -5.05 120.40 118.55 2w6x s VAL 1 Ca 0.00 0.36 -0.23 0.00 0.00 0.00 0.00 61.98 62.11 2w6x s VAL 1 Cb 0.00 -0.16 -0.10 0.00 0.00 0.00 0.00 36.38 36.12 2w6x s VAL 1 CO 0.00 0.15 1.00 -0.76 0.00 0.00 0.00 175.10 175.49 2w6x s LEU 2 N 1.89 4.09 0.73 3.92 1.02 -1.26 -5.06 118.68 124.01 2w6x s LEU 2 Ca 0.01 1.89 -0.11 0.00 0.02 0.00 0.00 54.13 55.94 2w6x s LEU 2 Cb -0.12 -4.29 0.03 0.00 0.02 0.00 0.00 46.19 41.83 2w6x s LEU 2 CO -0.04 -0.41 1.08 -0.94 0.02 0.00 0.00 176.35 176.06 2w6x s SER 3 N -1.79 5.09 0.26 2.29 1.04 -1.26 -4.89 113.70 114.44 2w6x s SER 3 Ca 0.58 1.45 -0.04 0.00 0.48 0.00 0.00 55.95 58.42 2w6x s SER 3 Cb -0.17 -2.28 0.35 0.00 0.10 0.00 0.00 66.02 64.03 2w6x s SER 3 CO 0.22 -1.61 1.88 -0.08 0.98 0.00 0.00 173.24 174.64 2w6x h GLU 4 N -0.83 1.13 -0.85 4.02 4.57 -1.99 -1.13 114.58 119.50 2w6x h GLU 4 Ca -0.45 -0.07 0.03 0.00 -1.18 0.00 0.00 59.36 57.69 2w6x h GLU 4 Cb 1.23 -0.25 -0.05 0.00 -0.16 0.00 0.00 28.75 29.52 2w6x h GLU 4 CO 0.59 0.75 0.55 0.78 -1.18 0.00 0.00 179.01 180.49 2w6x h GLY 5 N 1.16 1.24 0.91 1.92 0.00 -1.99 0.56 103.07 106.87 2w6x h GLY 5 Ca 0.40 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 47.29 2w6x h GLY 5 CO -0.15 0.36 0.11 0.83 0.00 0.00 0.00 176.54 177.69 2w6x h GLU 6 N 1.08 0.44 -0.98 4.80 5.08 -1.80 -1.98 114.58 121.21 2w6x h GLU 6 Ca 0.34 -0.09 0.05 0.00 -1.00 0.00 0.00 59.36 58.67 2w6x h GLU 6 Cb -0.00 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.12 2w6x h GLU 6 CO -0.11 0.47 0.64 -1.49 -1.00 0.00 0.00 179.01 177.52 2w6x h TRP 7 N 0.32 1.17 -0.47 4.33 4.06 -0.72 -1.67 115.95 122.96 2w6x h TRP 7 Ca 0.10 0.03 -0.08 0.00 2.06 0.00 0.00 58.89 61.00 2w6x h TRP 7 Cb 0.20 -0.39 -0.02 0.00 -1.00 0.00 0.00 29.16 27.96 2w6x h TRP 7 CO -0.00 0.64 -0.02 1.96 -3.56 0.00 0.00 178.44 177.45 2w6x h GLN 8 N 1.17 0.80 -0.85 0.49 1.08 -0.53 0.10 115.11 117.38 2w6x h GLN 8 Ca 0.41 -0.23 -0.02 0.00 -1.45 0.00 0.00 58.65 57.36 2w6x h GLN 8 Cb 0.11 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.41 2w6x h GLN 8 CO -0.15 0.82 0.46 -0.07 -0.95 0.00 0.00 178.83 178.95 2w6x h LEU 9 N 0.74 1.06 -0.03 1.46 3.38 -0.67 -0.30 115.31 120.96 2w6x h LEU 9 Ca 0.14 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 2w6x h LEU 9 Cb 0.48 -0.27 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 2w6x h LEU 9 CO 0.02 0.86 0.01 0.58 0.09 0.00 0.00 178.44 180.00 2w6x h VAL 10 N 1.19 1.12 0.00 1.22 2.07 -0.75 -2.88 116.25 118.22 2w6x h VAL 10 Ca 0.30 -0.36 -0.08 0.00 0.82 0.00 0.00 66.70 67.38 2w6x h VAL 10 Cb 0.03 1.32 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2w6x h VAL 10 CO -0.05 0.10 -0.38 -0.07 0.02 0.00 0.00 177.57 177.19 2w6x h LEU 11 N -0.10 0.00 -0.47 2.57 3.38 -0.63 -1.85 115.31 118.21 2w6x h LEU 11 Ca 0.01 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.81 2w6x h LEU 11 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2w6x h LEU 11 CO -0.00 0.38 -0.71 0.45 0.09 0.00 0.00 178.44 178.65 2w6x h HIS 12 N 0.00 0.40 -0.02 1.13 3.86 -1.00 -0.30 115.15 119.22 2w6x h HIS 12 Ca -0.00 -0.18 -0.21 0.00 -1.16 0.00 0.00 60.37 58.82 2w6x h HIS 12 Cb 0.69 -0.06 -0.00 0.00 1.06 0.00 0.00 27.41 29.09 2w6x h HIS 12 CO 0.00 0.91 -0.86 -0.24 0.86 0.00 0.00 177.93 178.60 2w6x h VAL 13 N 0.20 1.42 -0.31 2.45 3.04 -1.35 -3.19 116.25 118.51 2w6x h VAL 13 Ca -0.02 -2.40 -0.02 0.00 -1.01 0.00 0.00 66.70 63.24 2w6x h VAL 13 Cb 1.27 2.34 -0.02 0.00 -2.01 0.00 0.00 31.29 32.88 2w6x h VAL 13 CO 0.11 0.71 0.11 -0.25 -1.01 0.00 0.00 177.57 177.25 2w6x h TRP 14 N 0.21 0.44 -0.48 3.17 2.91 -1.01 -0.91 115.95 120.28 2w6x h TRP 14 Ca -0.06 -0.01 0.09 0.00 1.13 0.00 0.00 58.89 60.04 2w6x h TRP 14 Cb 1.48 -0.14 -0.03 0.00 -0.51 0.00 0.00 29.16 29.96 2w6x h TRP 14 CO 0.05 0.36 0.33 0.00 -1.03 0.00 0.00 178.44 178.14 2w6x h ALA 15 N 1.68 2.09 0.16 2.65 0.00 -1.04 -1.27 119.26 123.53 2w6x h ALA 15 Ca 0.11 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.72 2w6x h ALA 15 Cb 0.12 -0.05 0.03 0.00 0.00 0.00 0.00 17.79 17.89 2w6x h ALA 15 CO -0.01 -0.20 -1.21 0.87 0.00 0.00 0.00 179.25 178.70 2w6x h LYS 16 N 0.27 0.53 -0.93 0.00 1.79 -1.26 -3.14 116.57 113.83 2w6x h LYS 16 Ca 0.22 -0.79 0.18 0.00 -2.18 0.00 0.00 60.65 58.08 2w6x h LYS 16 Cb 0.51 0.28 -0.10 0.00 -1.58 0.00 0.00 32.23 31.33 2w6x h LYS 16 CO -0.05 1.36 0.52 0.28 -1.08 0.00 0.00 179.45 180.49 2w6x h VAL 17 N 0.09 0.69 0.00 0.50 2.07 -0.97 -1.43 116.25 117.20 2w6x h VAL 17 Ca -0.20 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.09 2w6x h VAL 17 Cb 1.92 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 31.65 2w6x h VAL 17 CO 0.23 0.12 0.00 -0.62 0.02 0.00 0.00 177.57 177.32 2w6x n GLU 18 N -4.84 0.09 0.24 1.57 1.02 -0.54 -1.76 120.64 116.42 2w6x n GLU 18 Ca 0.21 0.19 0.06 0.00 -0.02 0.00 0.00 57.16 57.60 2w6x n GLU 18 Cb 0.53 -1.50 0.55 0.00 -0.02 0.00 0.00 31.44 31.00 2w6x n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2w6x h ALA 19 N 2.64 1.75 -0.40 0.62 0.00 -1.27 -3.39 119.26 119.22 2w6x h ALA 19 Ca 0.00 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.62 2w6x h ALA 19 Cb 0.23 -0.02 -0.15 0.00 0.00 0.00 0.00 17.79 17.85 2w6x h ALA 19 CO 0.00 0.16 -0.44 -3.47 0.00 0.00 0.00 179.25 175.51 2w6x n ASP 20 N -4.34 -2.93 -0.09 0.00 2.03 -0.72 -5.03 116.55 105.48 2w6x n ASP 20 Ca -0.03 -2.91 -0.03 0.00 0.52 0.00 0.00 54.79 52.35 2w6x n ASP 20 Cb 0.20 1.66 0.21 0.00 -0.72 0.00 0.00 41.12 42.48 2w6x n ASP 20 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 2w6x h VAL 21 N 3.63 1.22 -0.31 5.18 3.04 -1.65 -2.62 116.25 124.75 2w6x h VAL 21 Ca -0.07 -0.86 0.02 0.00 -1.01 0.00 0.00 66.70 64.78 2w6x h VAL 21 Cb 1.08 0.81 -0.03 0.00 -2.01 0.00 0.00 31.29 31.15 2w6x h VAL 21 CO 0.14 0.31 0.15 0.00 -1.01 0.00 0.00 177.57 177.16 2w6x h ALA 22 N 1.36 0.37 -0.66 3.17 0.00 -1.90 0.13 119.26 121.73 2w6x h ALA 22 Ca 0.15 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 2w6x h ALA 22 Cb 0.35 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 2w6x h ALA 22 CO 0.01 -0.23 0.34 0.78 0.00 0.00 0.00 179.25 180.14 2w6x h GLY 23 N 0.31 1.00 1.02 0.00 0.00 -1.90 -1.49 103.07 102.01 2w6x h GLY 23 Ca 0.13 -0.48 -0.05 0.00 0.00 0.00 0.00 47.33 46.93 2w6x h GLY 23 CO -0.09 0.45 0.18 0.45 0.00 0.00 0.00 176.54 177.53 2w6x h HIS 24 N 0.91 1.04 -0.53 5.60 3.86 -1.17 -2.24 115.15 122.62 2w6x h HIS 24 Ca 0.23 -0.11 -0.00 0.00 -1.16 0.00 0.00 60.37 59.33 2w6x h HIS 24 Cb 0.08 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.23 2w6x h HIS 24 CO -0.00 0.85 0.32 0.78 0.86 0.00 0.00 177.93 180.75 2w6x h GLY 25 N 0.92 0.76 0.71 2.45 0.00 -0.66 -0.83 103.07 106.43 2w6x h GLY 25 Ca 0.20 -0.31 0.04 0.00 0.00 0.00 0.00 47.33 47.26 2w6x h GLY 25 CO -0.00 0.30 0.10 1.46 0.00 0.00 0.00 176.54 178.40 2w6x h GLN 26 N 0.71 0.22 -0.65 4.80 4.20 -1.14 -0.99 115.11 122.26 2w6x h GLN 26 Ca 0.19 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.89 2w6x h GLN 26 Cb -0.02 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.67 2w6x h GLN 26 CO -0.04 0.15 0.40 -0.44 -0.67 0.00 0.00 178.83 178.24 2w6x h ASP 27 N 0.23 0.77 -0.23 1.46 5.19 -1.06 -0.52 116.42 122.27 2w6x h ASP 27 Ca 0.14 -0.05 -0.04 0.00 -0.62 0.00 0.00 57.03 56.47 2w6x h ASP 27 Cb 0.12 -0.19 -0.01 0.00 0.18 0.00 0.00 39.33 39.43 2w6x h ASP 27 CO -0.15 0.59 -0.00 0.40 -3.12 0.00 0.00 179.24 176.96 2w6x h ILE 28 N 0.88 1.26 -0.58 0.35 2.04 -0.96 -0.81 117.51 119.69 2w6x h ILE 28 Ca 0.24 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 65.17 2w6x h ILE 28 Cb -0.05 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.40 2w6x h ILE 28 CO -0.05 0.28 0.24 1.88 0.00 0.00 0.00 178.15 180.50 2w6x h TYR 29 N 0.17 0.88 -0.55 1.37 0.05 -1.07 -0.60 116.97 117.22 2w6x h TYR 29 Ca 0.06 -0.06 -0.01 0.00 0.05 0.00 0.00 58.73 58.77 2w6x h TYR 29 Cb 0.40 -0.26 -0.03 0.00 1.01 0.00 0.00 36.73 37.86 2w6x h TYR 29 CO 0.04 0.70 0.31 0.82 -1.05 0.00 0.00 178.16 178.98 2w6x h ILE 30 N 0.80 1.17 -0.39 -2.88 2.04 -0.99 -0.32 117.51 116.94 2w6x h ILE 30 Ca 0.19 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.62 2w6x h ILE 30 Cb 0.19 0.47 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2w6x h ILE 30 CO -0.02 0.18 0.20 -0.09 0.00 0.00 0.00 178.15 178.42 2w6x h ARG 31 N 0.73 0.56 -0.16 2.37 9.65 -0.92 -1.14 114.38 125.47 2w6x h ARG 31 Ca 0.19 -0.08 0.02 0.00 -1.10 0.00 0.00 59.98 59.02 2w6x h ARG 31 Cb 0.02 -0.10 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 2w6x h ARG 31 CO -0.03 0.49 0.01 1.25 2.80 0.00 0.00 179.97 184.48 2w6x h LEU 32 N 0.50 -0.04 -0.86 3.80 5.85 -0.80 -0.23 115.31 123.53 2w6x h LEU 32 Ca 0.14 0.03 -0.12 0.00 0.84 0.00 0.00 57.88 58.77 2w6x h LEU 32 Cb 0.10 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 2w6x h LEU 32 CO -0.02 0.00 -0.57 -0.26 -0.34 0.00 0.00 178.44 177.26 2w6x h PHE 33 N 0.07 0.01 -0.00 1.25 0.04 -0.88 -0.44 116.94 116.99 2w6x h PHE 33 Ca 0.07 -0.00 -0.21 0.00 2.80 0.00 0.00 57.97 60.63 2w6x h PHE 33 Cb 0.08 -0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.25 2w6x h PHE 33 CO -0.15 0.57 -0.81 0.87 -0.60 0.00 0.00 178.31 178.19 2w6x h LYS 34 N 0.01 0.55 -0.07 1.51 1.57 -1.09 -2.91 116.57 116.14 2w6x h LYS 34 Ca -0.01 -0.59 -0.17 0.00 -1.87 0.00 0.00 60.65 58.01 2w6x h LYS 34 Cb 1.01 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 2w6x h LYS 34 CO 0.07 1.21 -0.69 0.77 -0.57 0.00 0.00 179.45 180.25 2w6x h SER 35 N 0.14 0.37 -2.01 0.86 0.02 -0.93 -3.39 113.55 108.61 2w6x h SER 35 Ca -0.10 -0.23 -0.54 0.00 -0.84 0.00 0.00 61.79 60.08 2w6x h SER 35 Cb 1.50 -0.11 -0.36 0.00 0.14 0.00 0.00 62.40 63.56 2w6x h SER 35 CO 0.16 0.94 -1.00 1.41 -1.14 0.00 0.00 176.83 177.20 2w6x n HIS 36 N -3.84 -0.90 0.19 3.45 8.25 -0.18 -5.00 115.22 117.19 2w6x n HIS 36 Ca -0.03 -3.27 0.17 0.00 -0.26 0.00 0.00 57.72 54.33 2w6x n HIS 36 Cb 0.68 0.08 0.81 0.00 1.12 0.00 0.00 29.99 32.68 2w6x n HIS 36 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 2w6x h PRO 37 N 4.71 0.00 -0.02 -0.41 0.11 -1.70 -0.99 132.00 133.70 2w6x h PRO 37 Ca 0.14 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.26 2w6x h PRO 37 Cb 0.91 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.02 2w6x h PRO 37 CO 0.40 0.00 0.02 1.05 -0.21 0.00 0.00 178.00 179.26 2w6x h GLU 38 N 0.00 0.00 -0.06 1.05 9.09 -1.92 -1.97 114.58 120.77 2w6x h GLU 38 Ca 0.10 0.00 -0.07 0.00 0.05 0.00 0.00 59.36 59.44 2w6x h GLU 38 Cb 0.57 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 27.66 2w6x h GLU 38 CO -0.00 0.00 -0.27 1.79 0.05 0.00 0.00 179.01 180.57 2w6x h THR 39 N 0.00 1.22 0.00 -1.06 1.35 -1.52 -2.14 112.91 110.77 2w6x h THR 39 Ca 0.01 -1.06 -0.02 0.00 -0.55 0.00 0.00 66.41 64.80 2w6x h THR 39 Cb 0.05 1.49 -0.00 0.00 -1.73 0.00 0.00 68.15 67.95 2w6x h THR 39 CO -0.00 0.31 -0.08 0.25 -0.25 0.00 0.00 175.52 175.75 2w6x h LEU 40 N 0.09 0.00 -2.38 3.87 5.85 -1.52 -2.33 115.31 118.90 2w6x h LEU 40 Ca 0.01 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 2w6x h LEU 40 Cb 0.54 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 2w6x h LEU 40 CO 0.04 0.08 -0.03 -0.33 -0.34 0.00 0.00 178.44 177.85 2w6x h GLU 41 N 0.00 0.00 0.00 1.25 5.08 -1.49 -1.98 114.58 117.44 2w6x h GLU 41 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2w6x h GLU 41 Cb 0.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.40 2w6x h GLU 41 CO 0.01 0.03 0.00 0.87 -1.00 0.00 0.00 179.01 178.92 2w6x h LYS 42 N 0.00 0.00 -4.46 2.33 1.79 -1.56 -3.41 116.57 111.26 2w6x h LYS 42 Ca -0.00 0.00 -0.73 0.00 -2.18 0.00 0.00 60.65 57.74 2w6x h LYS 42 Cb 0.16 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 30.60 2w6x h LYS 42 CO 0.00 0.00 0.13 -0.06 -1.08 0.00 0.00 179.45 178.45 2w6x s PHE 43 N -3.30 3.20 0.36 -1.35 0.40 -0.74 -4.91 117.98 111.64 2w6x s PHE 43 Ca 0.06 -1.27 0.08 0.00 -0.60 0.00 0.00 56.93 55.20 2w6x s PHE 43 Cb 0.09 -3.97 0.79 0.00 0.51 0.00 0.00 43.02 40.44 2w6x s PHE 43 CO 0.55 -1.21 1.91 -0.44 0.70 0.00 0.00 175.22 176.73 2w6x h ASP 44 N 8.83 0.65 1.53 1.36 3.32 -1.85 0.11 116.42 130.38 2w6x h ASP 44 Ca -0.17 0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.90 2w6x h ASP 44 Cb 1.07 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.51 2w6x h ASP 44 CO 1.03 0.38 0.00 0.03 -1.72 0.00 0.00 179.24 178.95 2w6x h ARG 45 N 0.71 0.00 0.00 3.56 3.08 -1.95 -3.37 114.38 116.41 2w6x h ARG 45 Ca 0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.43 2w6x h ARG 45 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 2w6x h ARG 45 CO -0.15 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 179.94 2w6x n PHE 46 N -2.60 0.00 0.24 3.04 3.72 -0.64 -4.77 117.46 116.45 2w6x n PHE 46 Ca 0.04 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.59 2w6x n PHE 46 Cb 0.43 0.00 0.79 0.00 -0.94 0.00 0.00 39.48 39.76 2w6x n PHE 46 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2w6x h LYS 47 N 0.00 0.00 0.00 -1.08 2.10 -0.96 -0.53 116.57 116.10 2w6x h LYS 47 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2w6x h LYS 47 Cb 0.03 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.36 2w6x h LYS 47 CO 0.00 0.00 0.00 1.12 -2.00 0.00 0.00 179.45 178.57 2w6x h HIS 48 N 0.00 0.00 -2.81 0.07 2.07 -1.86 -3.46 115.15 109.16 2w6x h HIS 48 Ca 0.00 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 56.99 2w6x h HIS 48 Cb 0.04 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.05 2w6x h HIS 48 CO 0.00 0.00 0.89 -0.51 -3.07 0.00 0.00 177.93 175.24 2w6x s LEU 49 N -5.40 4.36 -0.12 6.12 1.43 -0.21 -4.91 118.68 119.95 2w6x s LEU 49 Ca 0.06 2.44 0.20 0.00 -1.03 0.00 0.00 54.13 55.80 2w6x s LEU 49 Cb 0.09 -3.58 -0.29 0.00 0.03 0.00 0.00 46.19 42.44 2w6x s LEU 49 CO 0.57 -0.80 0.27 0.29 0.23 0.00 0.00 176.35 176.91 2w6x n LYS 50 N 4.81 0.68 -4.10 1.70 5.02 -1.26 -5.00 118.16 120.01 2w6x n LYS 50 Ca 0.14 -0.09 -0.09 0.00 -2.02 0.00 0.00 58.31 56.25 2w6x n LYS 50 Cb 0.41 -1.53 -0.10 0.00 -0.02 0.00 0.00 35.03 33.79 2w6x n LYS 50 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2w6x s THR 51 N -2.96 0.15 0.25 -0.18 -4.23 -1.26 -5.04 115.64 102.37 2w6x s THR 51 Ca -0.09 -1.80 -0.04 0.00 -1.18 0.00 0.00 61.69 58.58 2w6x s THR 51 Cb 0.10 -1.80 0.25 0.00 1.34 0.00 0.00 72.50 72.39 2w6x s THR 51 CO 0.87 -0.66 1.88 -0.08 -0.54 0.00 0.00 174.62 176.08 2w6x h GLU 52 N 2.95 1.12 -0.45 3.99 4.81 -1.98 -1.35 114.58 123.66 2w6x h GLU 52 Ca -0.34 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 58.88 2w6x h GLU 52 Cb 1.18 -0.25 -0.06 0.00 0.63 0.00 0.00 28.75 30.25 2w6x h GLU 52 CO 0.61 0.74 0.13 0.00 -0.73 0.00 0.00 179.01 179.76 2w6x h ALA 53 N 1.42 0.52 -0.64 2.92 0.00 -1.99 0.11 119.26 121.60 2w6x h ALA 53 Ca 0.40 0.07 -0.06 0.00 0.00 0.00 0.00 54.91 55.32 2w6x h ALA 53 Cb 0.10 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2w6x h ALA 53 CO -0.15 -0.27 0.16 0.93 0.00 0.00 0.00 179.25 179.92 2w6x h GLU 54 N 0.28 1.03 -0.43 0.00 5.08 -1.84 -1.77 114.58 116.92 2w6x h GLU 54 Ca 0.22 -0.24 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 2w6x h GLU 54 Cb 0.25 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.34 2w6x h GLU 54 CO -0.25 0.92 0.24 0.52 -1.00 0.00 0.00 179.01 179.44 2w6x h MET 55 N 0.95 0.60 -0.36 2.33 2.86 -0.74 -2.24 114.93 118.33 2w6x h MET 55 Ca 0.20 -0.07 -0.03 0.00 -2.06 0.00 0.00 59.70 57.75 2w6x h MET 55 Cb 0.35 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2w6x h MET 55 CO 0.00 0.47 0.09 0.87 1.06 0.00 0.00 176.91 179.40 2w6x h LYS 56 N 0.57 0.52 0.00 1.72 1.57 -0.62 -2.56 116.57 117.76 2w6x h LYS 56 Ca 0.15 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2w6x h LYS 56 Cb 0.04 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2w6x h LYS 56 CO -0.03 0.48 -0.07 0.00 -0.57 0.00 0.00 179.45 179.26 2w6x n ALA 57 N -2.48 2.43 -2.48 3.86 0.00 -0.68 -4.81 120.51 116.34 2w6x n ALA 57 Ca 0.02 -0.09 -0.43 0.00 0.00 0.00 0.00 53.44 52.94 2w6x n ALA 57 Cb 0.18 -1.43 -0.02 0.00 0.00 0.00 0.00 19.45 18.18 2w6x n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2w6x s SER 58 N -3.70 6.44 0.21 0.00 0.15 -0.87 -4.90 113.70 111.03 2w6x s SER 58 Ca 0.12 0.54 -0.08 0.00 0.70 0.00 0.00 55.95 57.22 2w6x s SER 58 Cb 0.16 -2.55 0.14 0.00 -1.71 0.00 0.00 66.02 62.06 2w6x s SER 58 CO 0.58 -1.40 1.76 -0.33 1.20 0.00 0.00 173.24 175.05 2w6x h GLU 59 N 10.03 1.15 -0.58 5.44 5.08 -1.88 -1.68 114.58 132.15 2w6x h GLU 59 Ca -0.25 -0.22 -0.08 0.00 -1.00 0.00 0.00 59.36 57.81 2w6x h GLU 59 Cb 1.08 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 2w6x h GLU 59 CO 1.13 0.95 0.05 -0.44 -1.00 0.00 0.00 179.01 179.70 2w6x h ASP 60 N 1.11 0.93 -0.57 1.42 3.32 -1.97 -1.09 116.42 119.56 2w6x h ASP 60 Ca 0.25 -0.23 -0.03 0.00 0.02 0.00 0.00 57.03 57.04 2w6x h ASP 60 Cb 0.25 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 2w6x h ASP 60 CO -0.02 0.96 0.22 0.25 -1.72 0.00 0.00 179.24 178.94 2w6x h LEU 61 N 0.90 0.80 -0.28 1.55 5.85 -1.85 -0.59 115.31 121.68 2w6x h LEU 61 Ca 0.18 -0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.77 2w6x h LEU 61 Cb 0.46 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.24 2w6x h LEU 61 CO 0.02 0.76 0.01 0.50 -0.34 0.00 0.00 178.44 179.39 2w6x h LYS 62 N 0.79 0.10 -0.99 1.25 3.64 -0.99 -0.72 116.57 119.65 2w6x h LYS 62 Ca 0.19 -0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.57 2w6x h LYS 62 Cb 0.21 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.96 2w6x h LYS 62 CO -0.01 0.06 0.64 0.87 -2.27 0.00 0.00 179.45 178.74 2w6x h LYS 63 N 0.10 1.31 -0.62 1.90 1.57 -0.99 -1.85 116.57 117.99 2w6x h LYS 63 Ca 0.14 -0.09 -0.02 0.00 -1.87 0.00 0.00 60.65 58.80 2w6x h LYS 63 Cb 0.17 -0.29 -0.03 0.00 0.08 0.00 0.00 32.23 32.16 2w6x h LYS 63 CO -0.22 0.88 0.30 0.37 -0.57 0.00 0.00 179.45 180.21 2w6x h GLN 64 N 1.35 0.90 -0.86 3.15 5.75 -0.71 -1.89 115.11 122.81 2w6x h GLN 64 Ca 0.36 -0.13 -0.01 0.00 -0.15 0.00 0.00 58.65 58.71 2w6x h GLN 64 Cb -0.13 -0.16 -0.04 0.00 1.07 0.00 0.00 27.48 28.22 2w6x h GLN 64 CO -0.07 0.72 0.49 0.78 -2.65 0.00 0.00 178.83 178.10 2w6x h GLY 65 N 0.86 1.26 0.97 2.39 0.00 -0.60 -0.75 103.07 107.21 2w6x h GLY 65 Ca 0.21 -0.55 -0.02 0.00 0.00 0.00 0.00 47.33 46.97 2w6x h GLY 65 CO -0.03 0.53 0.23 -2.08 0.00 0.00 0.00 176.54 175.20 2w6x h VAL 66 N 1.19 1.20 -0.28 4.60 2.07 -1.12 -0.76 116.25 123.14 2w6x h VAL 66 Ca 0.30 -0.57 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 2w6x h VAL 66 Cb -0.01 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 2w6x h VAL 66 CO -0.05 0.22 0.16 -0.09 0.02 0.00 0.00 177.57 177.83 2w6x h ARG 67 N 0.67 0.38 -0.04 1.57 2.43 -0.82 -0.98 114.38 117.60 2w6x h ARG 67 Ca 0.17 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.29 2w6x h ARG 67 Cb 0.14 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2w6x h ARG 67 CO -0.02 0.32 -0.00 0.28 -1.51 0.00 0.00 179.97 179.04 2w6x h VAL 68 N 0.34 1.26 -0.09 0.20 2.07 -1.03 -1.54 116.25 117.46 2w6x h VAL 68 Ca 0.10 -0.78 -0.09 0.00 0.82 0.00 0.00 66.70 66.76 2w6x h VAL 68 Cb 0.04 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.50 2w6x h VAL 68 CO -0.02 0.21 -0.33 -0.07 0.02 0.00 0.00 177.57 177.38 2w6x h LEU 69 N -0.23 0.17 -0.31 2.57 3.38 -1.11 -0.53 115.31 119.25 2w6x h LEU 69 Ca 0.01 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 2w6x h LEU 69 Cb 0.34 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2w6x h LEU 69 CO 0.00 0.50 -0.09 0.74 0.09 0.00 0.00 178.44 179.69 2w6x h THR 70 N 0.15 1.28 -0.59 0.22 2.02 -1.09 0.10 112.91 115.01 2w6x h THR 70 Ca 0.02 -1.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.03 2w6x h THR 70 Cb 0.67 1.39 -0.03 0.00 -1.74 0.00 0.00 68.15 68.44 2w6x h THR 70 CO 0.05 0.37 0.29 0.00 0.37 0.00 0.00 175.52 176.60 2w6x h ALA 71 N 0.79 0.76 -0.34 6.16 0.00 -0.97 -0.99 119.26 124.67 2w6x h ALA 71 Ca 0.08 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 2w6x h ALA 71 Cb 0.59 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 2w6x h ALA 71 CO 0.03 0.32 0.12 1.25 0.00 0.00 0.00 179.25 180.97 2w6x h LEU 72 N 0.81 0.48 -0.80 0.00 5.85 -1.03 -2.23 115.31 118.39 2w6x h LEU 72 Ca 0.20 -0.19 0.11 0.00 0.84 0.00 0.00 57.88 58.85 2w6x h LEU 72 Cb 0.11 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 40.94 2w6x h LEU 72 CO -0.03 0.54 0.43 1.23 -0.34 0.00 0.00 178.44 180.27 2w6x h GLY 73 N 0.40 1.25 1.11 3.75 0.00 -0.61 0.75 103.07 109.72 2w6x h GLY 73 Ca 0.11 -0.27 -0.03 0.00 0.00 0.00 0.00 47.33 47.13 2w6x h GLY 73 CO -0.01 0.07 0.36 0.00 0.00 0.00 0.00 176.54 176.96 2w6x h ALA 74 N 1.48 1.16 -0.00 3.60 0.00 -0.94 -0.84 119.26 123.71 2w6x h ALA 74 Ca 0.40 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 2w6x h ALA 74 Cb 0.44 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2w6x h ALA 74 CO -0.28 0.63 0.00 0.82 0.00 0.00 0.00 179.25 180.42 2w6x h ILE 75 N 1.13 1.18 -0.74 0.00 2.04 -0.70 -2.96 117.51 117.46 2w6x h ILE 75 Ca 0.27 -0.54 0.01 0.00 1.00 0.00 0.00 64.86 65.60 2w6x h ILE 75 Cb 0.13 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.73 2w6x h ILE 75 CO -0.03 0.14 0.49 -0.07 0.00 0.00 0.00 178.15 178.68 2w6x h LEU 76 N -0.23 0.83 -1.96 1.44 3.38 -0.58 -1.61 115.31 116.58 2w6x h LEU 76 Ca 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2w6x h LEU 76 Cb 0.23 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 40.78 2w6x h LEU 76 CO 0.00 0.59 0.00 0.11 0.09 0.00 0.00 178.44 179.23 2w6x h LYS 77 N 0.97 0.00 0.00 1.13 1.57 -1.03 -0.91 116.57 118.30 2w6x h LYS 77 Ca 0.28 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.06 2w6x h LYS 77 Cb -0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.24 2w6x h LYS 77 CO -0.07 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.44 2w6x n LYS 78 N -3.05 0.15 -3.91 3.15 4.76 -0.60 -4.94 118.16 113.72 2w6x n LYS 78 Ca -0.01 0.26 -0.25 0.00 -2.87 0.00 0.00 58.31 55.44 2w6x n LYS 78 Cb 0.22 -1.73 -0.01 0.00 -1.84 0.00 0.00 35.03 31.67 2w6x n LYS 78 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2w6x n LYS 79 N -2.01 -3.74 0.00 1.97 5.02 -0.35 -1.66 118.16 117.39 2w6x n LYS 79 Ca 0.04 0.46 0.00 0.00 -2.02 0.00 0.00 58.31 56.79 2w6x n LYS 79 Cb 0.30 -4.75 0.00 0.00 -0.02 0.00 0.00 35.03 30.56 2w6x n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2w6x n GLY 80 N -1.85 2.86 2.62 0.72 0.00 -1.26 -4.97 105.19 103.32 2w6x n GLY 80 Ca -0.27 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 2w6x n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2w6x n HIS 81 N -2.00 2.66 -1.16 1.61 8.25 -0.66 -4.66 115.22 119.25 2w6x n HIS 81 Ca 0.00 -2.75 0.09 0.00 -0.26 0.00 0.00 57.72 54.80 2w6x n HIS 81 Cb 0.00 -1.70 0.15 0.00 1.12 0.00 0.00 29.99 29.56 2w6x n HIS 81 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2w6x n HIS 82 N 1.77 0.00 -0.16 4.41 1.44 -1.26 -4.76 115.22 116.65 2w6x n HIS 82 Ca 0.53 -1.08 -0.02 0.00 -2.01 0.00 0.00 57.72 55.14 2w6x n HIS 82 Cb 0.28 -0.17 0.06 0.00 0.12 0.00 0.00 29.99 30.29 2w6x n HIS 82 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 2w6x h GLU 83 N 0.16 0.12 -0.49 -1.40 4.57 -2.00 -0.66 114.58 114.88 2w6x h GLU 83 Ca -0.00 -0.01 -0.09 0.00 -1.18 0.00 0.00 59.36 58.08 2w6x h GLU 83 Cb 1.00 -0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 29.55 2w6x h GLU 83 CO 0.00 0.08 -0.07 0.00 -1.18 0.00 0.00 179.01 177.84 2w6x h ALA 84 N 1.45 0.95 -0.21 2.92 0.00 -2.01 -2.62 119.26 119.75 2w6x h ALA 84 Ca 0.26 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 2w6x h ALA 84 Cb 0.39 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 2w6x h ALA 84 CO -0.42 0.62 -0.48 0.93 0.00 0.00 0.00 179.25 179.90 2w6x h GLU 85 N 0.80 0.55 0.00 0.00 3.07 -1.82 -3.25 114.58 113.94 2w6x h GLU 85 Ca 0.14 -0.31 -0.14 0.00 -0.50 0.00 0.00 59.36 58.55 2w6x h GLU 85 Cb 0.57 0.02 -0.02 0.00 -0.84 0.00 0.00 28.75 28.49 2w6x h GLU 85 CO 0.03 0.91 -0.65 -0.07 -1.40 0.00 0.00 179.01 177.83 2w6x h LEU 86 N 0.44 0.00 0.28 1.33 4.07 -0.87 -3.35 115.31 117.21 2w6x h LEU 86 Ca 0.02 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.99 2w6x h LEU 86 Cb 1.00 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.71 2w6x h LEU 86 CO 0.09 0.65 -0.37 0.11 -1.08 0.00 0.00 178.44 177.84 2w6x h LYS 87 N 0.00 -0.68 -0.16 1.13 1.57 -1.50 0.87 116.57 117.79 2w6x h LYS 87 Ca -0.01 0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.74 2w6x h LYS 87 Cb 1.21 0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.66 2w6x h LYS 87 CO 0.08 -0.46 -0.27 -1.00 -0.57 0.00 0.00 179.45 177.24 2w6x h PRO 88 N -0.71 0.30 -0.10 3.15 0.13 -1.75 -1.92 132.00 131.09 2w6x h PRO 88 Ca -0.01 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 65.00 2w6x h PRO 88 Cb 0.67 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.78 2w6x h PRO 88 CO -0.12 0.55 -0.00 -0.07 -0.23 0.00 0.00 178.00 178.13 2w6x h LEU 89 N 0.27 0.18 -0.53 1.56 3.38 -1.63 -1.35 115.31 117.18 2w6x h LEU 89 Ca 0.04 -0.31 0.03 0.00 0.09 0.00 0.00 57.88 57.73 2w6x h LEU 89 Cb 0.62 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 2w6x h LEU 89 CO 0.04 0.45 0.31 0.00 0.09 0.00 0.00 178.44 179.34 2w6x h ALA 90 N 0.74 0.69 -0.31 1.53 0.00 -0.74 -0.38 119.26 120.78 2w6x h ALA 90 Ca 0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 2w6x h ALA 90 Cb 0.36 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2w6x h ALA 90 CO 0.01 0.00 0.11 0.37 0.00 0.00 0.00 179.25 179.74 2w6x h GLN 91 N 0.61 0.47 -0.41 0.00 4.15 -1.24 -0.05 115.11 118.65 2w6x h GLN 91 Ca 0.22 -0.09 -0.09 0.00 0.77 0.00 0.00 58.65 59.46 2w6x h GLN 91 Cb 0.06 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.66 2w6x h GLN 91 CO -0.11 0.50 -0.09 0.66 -1.93 0.00 0.00 178.83 177.86 2w6x h SER 92 N 0.35 0.78 0.85 -0.69 4.64 -1.09 -1.35 113.55 117.04 2w6x h SER 92 Ca 0.10 -0.36 -0.10 0.00 -0.47 0.00 0.00 61.79 60.96 2w6x h SER 92 Cb 0.22 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2w6x h SER 92 CO -0.01 0.95 -0.50 0.45 -0.87 0.00 0.00 176.83 176.86 2w6x h HIS 93 N 0.59 0.00 0.03 4.77 3.86 -1.00 -0.00 115.15 123.41 2w6x h HIS 93 Ca 0.10 0.00 -0.16 0.00 -1.16 0.00 0.00 60.37 59.15 2w6x h HIS 93 Cb 0.61 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.09 2w6x h HIS 93 CO 0.05 0.50 -0.65 0.00 0.86 0.00 0.00 177.93 178.69 2w6x h ALA 94 N 1.50 0.03 0.00 2.45 0.00 -0.94 0.28 119.26 122.59 2w6x h ALA 94 Ca -0.00 -0.60 -0.34 0.00 0.00 0.00 0.00 54.91 53.97 2w6x h ALA 94 Cb 1.06 0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.83 2w6x h ALA 94 CO 0.06 0.35 -2.29 2.41 0.00 0.00 0.00 179.25 179.79 2w6x n THR 95 N -4.20 1.30 -0.09 0.00 -1.04 -0.51 -3.95 114.28 105.79 2w6x n THR 95 Ca -0.11 -0.50 -0.12 0.00 -2.04 0.00 0.00 64.05 61.28 2w6x n THR 95 Cb 0.71 -1.29 -0.05 0.00 -1.82 0.00 0.00 70.33 67.87 2w6x n THR 95 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2w6x n LYS 96 N -3.16 0.50 0.08 -2.82 4.81 -0.19 -4.62 118.16 112.77 2w6x n LYS 96 Ca -0.40 0.52 -0.01 0.00 -0.87 0.00 0.00 58.31 57.55 2w6x n LYS 96 Cb 0.93 -1.69 -0.05 0.00 0.02 0.00 0.00 35.03 34.23 2w6x n LYS 96 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2w6x h HIS 97 N -1.00 0.00 -5.64 5.64 3.86 -1.23 -3.49 115.15 113.29 2w6x h HIS 97 Ca -0.15 0.00 -0.21 0.00 -1.16 0.00 0.00 60.37 58.85 2w6x h HIS 97 Cb 0.86 0.00 0.10 0.00 1.06 0.00 0.00 27.41 29.42 2w6x h HIS 97 CO -0.11 0.69 -0.58 1.63 0.86 0.00 0.00 177.93 180.42 2w6x n LYS 98 N -3.17 -1.69 -3.54 2.45 5.02 -0.41 -4.99 118.16 111.84 2w6x n LYS 98 Ca -0.03 1.02 -0.42 0.00 -2.02 0.00 0.00 58.31 56.87 2w6x n LYS 98 Cb 0.84 -5.29 -0.11 0.00 -0.02 0.00 0.00 35.03 30.45 2w6x n LYS 98 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2w6x s ILE 99 N -3.24 4.87 0.72 -0.18 -1.09 -0.05 -5.03 121.20 117.20 2w6x s ILE 99 Ca 0.27 -0.79 -0.14 0.00 -2.23 0.00 0.00 60.65 57.76 2w6x s ILE 99 Cb -0.05 -3.72 0.03 0.00 -1.58 0.00 0.00 42.46 37.13 2w6x s ILE 99 CO 0.77 -0.28 1.13 -2.16 -1.23 0.00 0.00 174.94 173.17 2w6x s PRO 100 N 1.61 2.41 0.33 2.79 0.04 -1.26 -4.81 135.00 136.11 2w6x s PRO 100 Ca 0.03 1.42 0.05 0.00 0.04 0.00 0.00 61.00 62.54 2w6x s PRO 100 Cb -0.19 -1.90 0.67 0.00 0.04 0.00 0.00 34.50 33.12 2w6x s PRO 100 CO 0.08 -1.56 1.89 0.82 0.04 0.00 0.00 177.00 178.27 2w6x h ILE 101 N -0.44 0.95 -0.70 0.56 1.08 -1.62 -0.34 117.51 117.01 2w6x h ILE 101 Ca -0.46 -0.29 0.11 0.00 -0.39 0.00 0.00 64.86 63.82 2w6x h ILE 101 Cb 1.25 0.02 -0.05 0.00 -3.07 0.00 0.00 36.82 34.98 2w6x h ILE 101 CO 0.52 0.16 0.46 0.50 -0.69 0.00 0.00 178.15 179.10 2w6x h LYS 102 N 0.86 0.51 -0.06 2.37 3.64 -1.91 0.11 116.57 122.08 2w6x h LYS 102 Ca 0.41 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.62 2w6x h LYS 102 Cb 0.44 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2w6x h LYS 102 CO -0.18 0.34 -0.62 1.88 -2.27 0.00 0.00 179.45 178.60 2w6x h TYR 103 N 0.52 0.27 -0.15 1.91 -1.99 -1.41 -1.23 116.97 114.89 2w6x h TYR 103 Ca 0.33 -0.11 -0.09 0.00 2.00 0.00 0.00 58.73 60.86 2w6x h TYR 103 Cb 0.57 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.24 2w6x h TYR 103 CO -0.00 0.77 -0.29 -0.07 -0.00 0.00 0.00 178.16 178.57 2w6x h LEU 104 N 0.15 0.29 -0.23 3.88 3.38 -0.81 -0.73 115.31 121.24 2w6x h LEU 104 Ca -0.01 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2w6x h LEU 104 Cb 1.13 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 2w6x h LEU 104 CO 0.09 0.58 0.04 -0.33 0.09 0.00 0.00 178.44 178.91 2w6x h GLU 105 N 0.26 0.38 -0.81 1.13 5.08 -0.73 -1.07 114.58 118.82 2w6x h GLU 105 Ca 0.04 -0.10 0.05 0.00 -1.00 0.00 0.00 59.36 58.35 2w6x h GLU 105 Cb 0.65 -0.04 -0.06 0.00 0.50 0.00 0.00 28.75 29.80 2w6x h GLU 105 CO 0.05 0.52 0.50 0.74 -1.00 0.00 0.00 179.01 179.81 2w6x h PHE 106 N 0.18 0.93 -0.59 4.33 0.04 -0.90 -0.75 116.94 120.18 2w6x h PHE 106 Ca 0.07 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.82 2w6x h PHE 106 Cb 0.32 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 2w6x h PHE 106 CO 0.02 0.49 0.18 0.35 -0.60 0.00 0.00 178.31 178.75 2w6x h PHE 107 N 0.93 0.95 -0.62 -0.55 3.04 -0.95 -1.21 116.94 118.53 2w6x h PHE 107 Ca 0.35 -0.10 0.02 0.00 3.98 0.00 0.00 57.97 62.21 2w6x h PHE 107 Cb 0.12 -0.28 -0.03 0.00 2.56 0.00 0.00 35.95 38.32 2w6x h PHE 107 CO -0.04 0.79 0.40 0.77 -2.02 0.00 0.00 178.31 178.22 2w6x h SER 108 N 0.84 0.68 -0.79 0.41 0.02 -0.67 -0.89 113.55 113.15 2w6x h SER 108 Ca 0.19 -0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.16 2w6x h SER 108 Cb 0.29 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.62 2w6x h SER 108 CO -0.01 0.48 0.51 -0.08 -1.14 0.00 0.00 176.83 176.60 2w6x h GLU 109 N 0.81 0.98 -0.47 3.45 4.81 -0.72 -1.26 114.58 122.17 2w6x h GLU 109 Ca 0.24 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.37 2w6x h GLU 109 Cb -0.05 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.09 2w6x h GLU 109 CO -0.07 0.65 0.14 0.00 -0.73 0.00 0.00 179.01 179.00 2w6x h ALA 110 N 1.32 0.62 -0.13 2.92 0.00 -0.63 -0.80 119.26 122.56 2w6x h ALA 110 Ca 0.31 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.04 2w6x h ALA 110 Cb -0.03 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2w6x h ALA 110 CO -0.10 0.28 0.04 0.82 0.00 0.00 0.00 179.25 180.30 2w6x h ILE 111 N 0.63 0.97 -0.76 0.00 2.04 -0.79 -1.38 117.51 118.22 2w6x h ILE 111 Ca 0.15 -0.04 -0.02 0.00 1.00 0.00 0.00 64.86 65.95 2w6x h ILE 111 Cb 0.28 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 2w6x h ILE 111 CO -0.00 0.02 0.40 0.40 0.00 0.00 0.00 178.15 178.97 2w6x h ILE 112 N 0.11 1.24 -0.26 -0.67 2.04 -1.08 -0.67 117.51 118.21 2w6x h ILE 112 Ca 0.05 -0.61 -0.01 0.00 1.00 0.00 0.00 64.86 65.29 2w6x h ILE 112 Cb 0.03 0.24 -0.01 0.00 -0.74 0.00 0.00 36.82 36.33 2w6x h ILE 112 CO -0.05 0.27 0.14 -0.74 0.00 0.00 0.00 178.15 177.77 2w6x h HIS 113 N 1.06 0.36 -0.34 1.37 2.76 -0.87 -0.05 115.15 119.45 2w6x h HIS 113 Ca 0.27 -0.01 -0.04 0.00 -2.20 0.00 0.00 60.37 58.39 2w6x h HIS 113 Cb 0.06 -0.12 -0.01 0.00 1.55 0.00 0.00 27.41 28.90 2w6x h HIS 113 CO 0.00 0.31 0.05 0.28 -1.30 0.00 0.00 177.93 177.28 2w6x h VAL 114 N 0.31 1.24 -0.79 5.26 2.07 -0.91 -1.24 116.25 122.18 2w6x h VAL 114 Ca 0.09 -0.83 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 2w6x h VAL 114 Cb 0.07 1.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.93 2w6x h VAL 114 CO -0.01 0.28 0.38 -0.07 0.02 0.00 0.00 177.57 178.17 2w6x h LEU 115 N 0.40 1.04 -0.88 2.57 3.38 -1.04 0.97 115.31 121.74 2w6x h LEU 115 Ca 0.10 -0.13 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 2w6x h LEU 115 Cb 0.35 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.80 2w6x h LEU 115 CO 0.01 0.88 0.45 -0.74 0.09 0.00 0.00 178.44 179.13 2w6x h HIS 116 N 1.12 1.24 -0.12 1.13 2.76 -0.81 0.48 115.15 120.96 2w6x h HIS 116 Ca 0.27 -0.05 -0.09 0.00 -2.20 0.00 0.00 60.37 58.31 2w6x h HIS 116 Cb 0.12 -0.39 0.00 0.00 1.55 0.00 0.00 27.41 28.69 2w6x h HIS 116 CO 0.01 0.87 -0.27 1.03 -1.30 0.00 0.00 177.93 178.27 2w6x h SER 117 N 1.24 0.44 0.77 3.26 0.87 -0.74 -3.35 113.55 116.04 2w6x h SER 117 Ca 0.30 -0.57 -0.25 0.00 -1.23 0.00 0.00 61.79 60.04 2w6x h SER 117 Cb 0.08 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 61.89 2w6x h SER 117 CO -0.04 0.93 -1.23 0.03 -0.53 0.00 0.00 176.83 175.99 2w6x h ARG 118 N -0.04 0.08 -1.69 2.24 3.08 -0.76 -3.41 114.38 113.89 2w6x h ARG 118 Ca -0.00 -0.14 -0.52 0.00 0.07 0.00 0.00 59.98 59.39 2w6x h ARG 118 Cb 0.87 0.05 -0.41 0.00 0.08 0.00 0.00 29.97 30.56 2w6x h ARG 118 CO 0.06 0.97 -0.89 0.72 -1.07 0.00 0.00 179.97 179.76 2w6x n HIS 119 N -3.35 2.53 0.29 3.04 8.25 0.15 -4.87 115.22 121.26 2w6x n HIS 119 Ca -0.07 -3.40 0.13 0.00 -0.26 0.00 0.00 57.72 54.13 2w6x n HIS 119 Cb 0.99 -0.31 0.85 0.00 1.12 0.00 0.00 29.99 32.63 2w6x n HIS 119 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2w6x h PRO 120 N 2.85 0.00 0.00 -0.41 0.13 -1.74 0.26 132.00 133.08 2w6x h PRO 120 Ca 0.13 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.22 2w6x h PRO 120 Cb 0.88 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 2w6x h PRO 120 CO 0.70 0.01 -0.19 0.78 -0.23 0.00 0.00 178.00 179.07 2w6x h GLY 121 N 0.04 0.00 -0.18 1.56 0.00 -1.94 -3.24 103.07 99.31 2w6x h GLY 121 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2w6x h GLY 121 CO 0.00 0.00 -0.09 1.22 0.00 0.00 0.00 176.54 177.67 2w6x n ASP 122 N -3.57 1.38 -2.74 0.19 8.00 -0.55 -4.82 116.55 114.44 2w6x n ASP 122 Ca -0.01 -2.15 -0.11 0.00 0.71 0.00 0.00 54.79 53.24 2w6x n ASP 122 Cb 0.34 -0.17 0.02 0.00 -0.02 0.00 0.00 41.12 41.29 2w6x n ASP 122 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2w6x n PHE 123 N -0.61 1.04 -0.67 1.24 7.35 0.79 -4.48 117.46 122.13 2w6x n PHE 123 Ca 0.05 -2.95 -0.01 0.00 -0.76 0.00 0.00 57.45 53.78 2w6x n PHE 123 Cb 0.50 -0.38 0.00 0.00 0.35 0.00 0.00 39.48 39.95 2w6x n PHE 123 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2w6x n GLY 124 N -0.02 -2.04 0.26 7.13 0.00 -1.25 -4.60 105.19 104.67 2w6x n GLY 124 Ca 0.12 -1.52 -0.06 0.00 0.00 0.00 0.00 46.02 44.56 2w6x n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w6x h ALA 125 N -2.01 0.82 -0.41 4.61 0.00 -1.98 -0.35 119.26 119.94 2w6x h ALA 125 Ca -0.01 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 2w6x h ALA 125 Cb 0.02 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 2w6x h ALA 125 CO 0.01 0.26 0.10 -0.44 0.00 0.00 0.00 179.25 179.18 2w6x h ASP 126 N 0.88 0.63 -0.63 0.00 3.32 -1.99 -1.03 116.42 117.59 2w6x h ASP 126 Ca 0.24 -0.23 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 2w6x h ASP 126 Cb -0.08 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 2w6x h ASP 126 CO -0.05 0.69 0.22 0.00 -1.72 0.00 0.00 179.24 178.38 2w6x h ALA 127 N 0.96 0.83 -0.67 3.45 0.00 -1.80 -0.96 119.26 121.06 2w6x h ALA 127 Ca 0.13 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2w6x h ALA 127 Cb 0.31 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 2w6x h ALA 127 CO 0.00 0.48 0.21 0.37 0.00 0.00 0.00 179.25 180.31 2w6x h GLN 128 N 0.90 1.05 -0.79 0.00 4.15 -0.90 -0.21 115.11 119.31 2w6x h GLN 128 Ca 0.21 -0.23 0.01 0.00 0.77 0.00 0.00 58.65 59.41 2w6x h GLN 128 Cb 0.26 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 27.76 2w6x h GLN 128 CO -0.01 0.91 0.53 0.78 -1.93 0.00 0.00 178.83 179.11 2w6x h GLY 129 N 0.98 1.12 0.94 2.39 0.00 -0.94 0.13 103.07 107.69 2w6x h GLY 129 Ca 0.22 -0.42 -0.04 0.00 0.00 0.00 0.00 47.33 47.09 2w6x h GLY 129 CO -0.01 0.41 0.09 0.00 0.00 0.00 0.00 176.54 177.03 2w6x h ALA 130 N 1.29 0.54 -0.60 3.60 0.00 -0.70 -1.05 119.26 122.34 2w6x h ALA 130 Ca 0.29 -0.20 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 2w6x h ALA 130 Cb -0.12 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 2w6x h ALA 130 CO -0.06 0.23 0.20 1.98 0.00 0.00 0.00 179.25 181.59 2w6x h MET 131 N 0.52 0.92 -0.52 0.00 -1.53 -0.81 -0.62 114.93 112.89 2w6x h MET 131 Ca 0.13 -0.19 0.05 0.00 -3.44 0.00 0.00 59.70 56.24 2w6x h MET 131 Cb 0.33 -0.14 -0.05 0.00 -0.55 0.00 0.00 31.60 31.19 2w6x h MET 131 CO 0.00 0.82 0.26 -0.97 0.14 0.00 0.00 176.91 177.16 2w6x h ASN 132 N 0.85 0.37 -0.43 1.39 -1.24 -0.56 -0.20 115.58 115.75 2w6x h ASN 132 Ca 0.19 0.03 0.02 0.00 0.71 0.00 0.00 56.30 57.25 2w6x h ASN 132 Cb 0.27 -0.04 -0.03 0.00 0.73 0.00 0.00 38.32 39.25 2w6x h ASN 132 CO -0.01 0.26 0.26 0.50 -1.29 0.00 0.00 177.43 177.14 2w6x h LYS 133 N 0.51 0.51 -0.50 6.67 3.64 -0.79 0.56 116.57 127.16 2w6x h LYS 133 Ca 0.23 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.56 2w6x h LYS 133 Cb 0.15 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 2w6x h LYS 133 CO -0.17 0.33 0.23 0.00 -2.27 0.00 0.00 179.45 177.58 2w6x h ALA 134 N 1.19 0.65 -0.19 5.00 0.00 -0.67 -0.66 119.26 124.59 2w6x h ALA 134 Ca 0.17 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 2w6x h ALA 134 Cb 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 2w6x h ALA 134 CO -0.08 0.23 -0.54 -0.07 0.00 0.00 0.00 179.25 178.79 2w6x h LEU 135 N 0.67 0.62 -0.56 0.00 3.38 -0.87 -1.79 115.31 116.76 2w6x h LEU 135 Ca 0.17 -0.33 0.00 0.00 0.09 0.00 0.00 57.88 57.82 2w6x h LEU 135 Cb 0.14 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 40.69 2w6x h LEU 135 CO -0.02 1.04 0.35 -0.08 0.09 0.00 0.00 178.44 179.82 2w6x h GLU 136 N 0.43 0.75 -0.37 1.13 4.81 -0.71 -0.09 114.58 120.53 2w6x h GLU 136 Ca 0.01 -0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.19 2w6x h GLU 136 Cb 1.08 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 2w6x h GLU 136 CO 0.10 0.52 0.24 1.25 -0.73 0.00 0.00 179.01 180.39 2w6x h LEU 137 N 0.75 0.40 -0.09 1.64 5.85 -0.97 0.11 115.31 123.01 2w6x h LEU 137 Ca 0.20 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.93 2w6x h LEU 137 Cb -0.04 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 40.88 2w6x h LEU 137 CO -0.04 0.29 -0.02 0.15 -0.34 0.00 0.00 178.44 178.48 2w6x h PHE 138 N 0.48 -0.05 -0.63 1.25 3.57 -1.08 -1.02 116.94 119.46 2w6x h PHE 138 Ca 0.14 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 2w6x h PHE 138 Cb -0.04 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 2w6x h PHE 138 CO -0.06 -0.04 0.21 0.00 -2.23 0.00 0.00 178.31 176.19 2w6x h ARG 139 N -0.00 0.95 -0.40 1.11 3.08 -0.67 -0.44 114.38 118.00 2w6x h ARG 139 Ca 0.04 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.89 2w6x h ARG 139 Cb 0.07 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 2w6x h ARG 139 CO -0.09 0.81 0.17 -0.22 -1.07 0.00 0.00 179.97 179.56 2w6x h LYS 140 N 0.92 0.59 -0.40 0.04 3.64 -0.39 0.20 116.57 121.18 2w6x h LYS 140 Ca 0.21 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.36 2w6x h LYS 140 Cb 0.25 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 2w6x h LYS 140 CO -0.01 0.55 -0.27 -0.44 -2.27 0.00 0.00 179.45 177.01 2w6x h ASP 141 N 0.50 0.87 -0.52 4.20 3.32 -0.89 -1.64 116.42 122.26 2w6x h ASP 141 Ca 0.13 -0.34 -0.03 0.00 0.02 0.00 0.00 57.03 56.82 2w6x h ASP 141 Cb 0.17 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 2w6x h ASP 141 CO -0.01 1.08 0.21 0.40 -1.72 0.00 0.00 179.24 179.21 2w6x h ILE 142 N 0.72 1.21 -0.75 0.35 1.08 -0.93 -1.80 117.51 117.39 2w6x h ILE 142 Ca 0.09 -0.66 -0.02 0.00 -0.39 0.00 0.00 64.86 63.88 2w6x h ILE 142 Cb 0.81 0.67 -0.04 0.00 -3.07 0.00 0.00 36.82 35.20 2w6x h ILE 142 CO 0.07 0.25 0.39 0.00 -0.69 0.00 0.00 178.15 178.17 2w6x h ALA 143 N 1.06 0.96 -0.80 1.87 0.00 -0.75 0.31 119.26 121.92 2w6x h ALA 143 Ca 0.17 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2w6x h ALA 143 Cb 0.19 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2w6x h ALA 143 CO -0.02 0.50 0.35 0.00 0.00 0.00 0.00 179.25 180.08 2w6x h ALA 144 N 1.20 1.11 -0.29 0.00 0.00 -1.14 -2.01 119.26 118.13 2w6x h ALA 144 Ca 0.26 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 2w6x h ALA 144 Cb 0.07 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 2w6x h ALA 144 CO -0.04 0.65 -0.36 -0.22 0.00 0.00 0.00 179.25 179.28 2w6x h LYS 145 N 1.15 0.75 -0.79 0.00 1.63 -0.43 -2.34 116.57 116.54 2w6x h LYS 145 Ca 0.27 -0.42 0.18 0.00 -0.85 0.00 0.00 60.65 59.82 2w6x h LYS 145 Cb 0.17 0.03 -0.11 0.00 -0.60 0.00 0.00 32.23 31.71 2w6x h LYS 145 CO -0.03 1.05 0.25 1.88 -3.45 0.00 0.00 179.45 179.15 2w6x h TYR 146 N 0.50 0.40 -0.38 1.91 -1.99 -0.18 0.28 116.97 117.51 2w6x h TYR 146 Ca 0.04 0.04 -0.07 0.00 2.00 0.00 0.00 58.73 60.74 2w6x h TYR 146 Cb 0.95 -0.05 -0.01 0.00 2.00 0.00 0.00 36.73 39.61 2w6x h TYR 146 CO 0.07 -0.06 -0.04 0.87 -0.00 0.00 0.00 178.16 179.00 2w6x h LYS 147 N 0.32 0.71 -0.49 4.88 1.57 -1.16 0.11 116.57 122.50 2w6x h LYS 147 Ca 0.46 -0.25 -0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2w6x h LYS 147 Cb 0.81 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.04 2w6x h LYS 147 CO -0.51 0.83 0.30 0.93 -0.57 0.00 0.00 179.45 180.42 2w6x h GLU 148 N 0.52 0.66 -0.00 3.15 5.08 -0.78 -2.45 114.58 120.76 2w6x h GLU 148 Ca 0.10 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2w6x h GLU 148 Cb 0.54 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.64 2w6x h GLU 148 CO 0.03 0.46 -0.08 1.28 -1.00 0.00 0.00 179.01 179.70 2w6x n LEU 149 N -4.44 0.13 0.00 1.33 4.77 0.00 -4.92 117.00 113.88 2w6x n LEU 149 Ca 0.04 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.34 2w6x n LEU 149 Cb 0.07 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 2w6x n LEU 149 CO 0.36 0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.06 2w6x n GLY 150 N 1.42 0.79 3.25 -0.72 0.00 -0.78 -5.06 105.19 104.08 2w6x n GLY 150 Ca 0.10 -0.36 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 2w6x n GLY 150 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2w6x s TYR 151 N -2.00 2.95 -0.55 1.61 5.04 -0.04 -5.02 117.35 119.33 2w6x s TYR 151 Ca 0.00 -1.20 -0.20 0.00 -2.44 0.00 0.00 57.07 53.24 2w6x s TYR 151 Cb 0.00 -2.06 0.07 0.00 0.35 0.00 0.00 41.96 40.32 2w6x s TYR 151 CO 0.00 -0.64 0.70 1.14 -1.34 0.00 0.00 175.55 175.41 2w6x s GLN 152 N 1.41 3.11 0.00 4.97 -2.07 -1.26 -3.63 119.66 122.19 2w6x s GLN 152 Ca 0.04 -0.99 0.00 0.00 -1.82 0.00 0.00 55.36 52.59 2w6x s GLN 152 Cb -0.14 -4.16 0.00 0.00 -1.09 0.00 0.00 33.01 27.61 2w6x s GLN 152 CO -0.05 -1.39 0.00 0.41 -1.32 0.00 0.00 175.29 172.93