#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d3w s GLU 2 N 0.00 4.36 0.03 2.12 2.56 -1.26 -4.92 118.70 121.59 3d3w s GLU 2 Ca 0.00 1.79 0.26 0.00 0.00 0.00 0.00 54.97 57.02 3d3w s GLU 2 Cb 0.00 -3.48 0.69 0.00 2.00 0.00 0.00 34.13 33.34 3d3w s GLU 2 CO 0.00 -0.42 1.55 1.28 -0.56 0.00 0.00 175.26 177.11 3d3w n LEU 3 N 4.80 0.41 -3.66 2.70 4.77 -1.26 -4.92 117.00 119.83 3d3w n LEU 3 Ca 0.11 0.19 -0.22 0.00 -0.03 0.00 0.00 56.01 56.06 3d3w n LEU 3 Cb 0.45 -0.31 0.05 0.00 -2.33 0.00 0.00 43.42 41.28 3d3w n LEU 3 CO 0.56 0.05 0.03 0.49 -1.33 0.00 0.00 177.39 177.20 3d3w n PHE 4 N -1.62 -2.14 0.07 -1.77 3.72 -1.26 -4.11 117.46 110.36 3d3w n PHE 4 Ca 0.06 0.89 0.10 0.00 -0.05 0.00 0.00 57.45 58.45 3d3w n PHE 4 Cb 0.36 -4.56 -0.16 0.00 -0.94 0.00 0.00 39.48 34.18 3d3w n PHE 4 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3d3w n LEU 5 N -4.38 0.08 -4.61 4.37 4.77 -1.26 -4.91 117.00 111.06 3d3w n LEU 5 Ca -0.21 -0.04 -0.49 0.00 -0.03 0.00 0.00 56.01 55.24 3d3w n LEU 5 Cb 0.64 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.69 3d3w n LEU 5 CO 0.67 0.02 0.91 0.00 -1.33 0.00 0.00 177.39 177.67 3d3w n ALA 6 N -2.15 -0.11 0.00 -1.18 0.00 -1.26 -2.61 120.51 113.19 3d3w n ALA 6 Ca -0.03 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.88 3d3w n ALA 6 Cb 0.52 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.83 3d3w n ALA 6 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d3w n GLY 7 N 2.45 3.00 3.81 0.00 0.00 -0.22 -4.87 105.19 109.36 3d3w n GLY 7 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 3d3w n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d3w s ARG 8 N -0.00 3.54 -0.26 1.61 0.52 -1.07 -4.60 118.95 118.69 3d3w s ARG 8 Ca 0.00 1.13 -0.12 0.00 -0.52 0.00 0.00 55.73 56.23 3d3w s ARG 8 Cb 0.00 -2.07 -0.05 0.00 0.52 0.00 0.00 34.95 33.35 3d3w s ARG 8 CO 0.00 -0.62 0.21 0.50 0.02 0.00 0.00 175.30 175.41 3d3w s ARG 9 N -4.03 4.02 -0.11 3.54 3.52 -1.26 -1.34 118.95 123.29 3d3w s ARG 9 Ca 0.62 -0.22 0.04 0.00 -0.13 0.00 0.00 55.73 56.03 3d3w s ARG 9 Cb -0.14 -3.61 0.00 0.00 -1.56 0.00 0.00 34.95 29.65 3d3w s ARG 9 CO 0.34 -0.09 -0.23 0.08 -0.81 0.00 0.00 175.30 174.60 3d3w s VAL 10 N 1.50 1.99 -0.17 7.11 1.01 0.11 -0.59 120.40 131.35 3d3w s VAL 10 Ca 0.09 -0.97 -0.07 0.00 0.00 0.00 0.00 61.98 61.03 3d3w s VAL 10 Cb -0.15 -1.73 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 3d3w s VAL 10 CO 0.08 0.54 0.05 -0.22 0.00 0.00 0.00 175.10 175.56 3d3w s LEU 11 N 0.48 3.79 -0.11 3.92 0.20 -0.62 0.46 118.68 126.79 3d3w s LEU 11 Ca -0.16 0.08 0.02 0.00 0.69 0.00 0.00 54.13 54.76 3d3w s LEU 11 Cb -0.17 -1.95 0.01 0.00 -0.43 0.00 0.00 46.19 43.65 3d3w s LEU 11 CO 0.06 0.19 -0.16 -0.69 -0.29 0.00 0.00 176.35 175.47 3d3w s VAL 12 N 0.25 1.55 0.38 1.68 1.01 0.38 -1.08 120.40 124.58 3d3w s VAL 12 Ca 0.03 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.33 3d3w s VAL 12 Cb -0.12 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.80 3d3w s VAL 12 CO 0.00 0.45 0.62 0.42 0.00 0.00 0.00 175.10 176.59 3d3w s THR 13 N 1.02 5.04 -1.44 3.92 -4.23 -0.62 -0.97 115.64 118.36 3d3w s THR 13 Ca -0.06 -0.24 -0.09 0.00 -1.18 0.00 0.00 61.69 60.13 3d3w s THR 13 Cb -0.15 -3.85 0.05 0.00 1.34 0.00 0.00 72.50 69.89 3d3w s THR 13 CO -0.02 -0.63 0.92 0.61 -0.54 0.00 0.00 174.62 174.96 3d3w n GLY 14 N -1.86 -0.44 0.21 3.99 0.00 -0.05 -3.06 105.19 103.99 3d3w n GLY 14 Ca -0.03 0.18 0.13 0.00 0.00 0.00 0.00 46.02 46.30 3d3w n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d3w h ALA 15 N 0.94 1.00 -0.38 4.61 0.00 -1.45 -3.34 119.26 120.65 3d3w h ALA 15 Ca -0.59 0.00 0.09 0.00 0.00 0.00 0.00 54.91 54.41 3d3w h ALA 15 Cb 1.37 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 3d3w h ALA 15 CO 0.62 0.00 0.26 0.78 0.00 0.00 0.00 179.25 180.92 3d3w h GLY 16 N 3.69 0.13 -2.80 0.00 0.00 -1.88 -2.44 103.07 99.77 3d3w h GLY 16 Ca 0.00 -0.04 -0.07 0.00 0.00 0.00 0.00 47.33 47.22 3d3w h GLY 16 CO 0.00 0.03 -0.21 0.54 0.00 0.00 0.00 176.54 176.89 3d3w s LYS 17 N -5.12 1.16 2.63 4.80 1.02 -1.26 -4.81 119.74 118.17 3d3w s LYS 17 Ca -0.06 -1.02 0.00 0.00 0.02 0.00 0.00 55.97 54.91 3d3w s LYS 17 Cb 0.19 0.42 0.00 0.00 -0.52 0.00 0.00 37.83 37.92 3d3w s LYS 17 CO 0.72 -0.44 0.00 0.41 -0.92 0.00 0.00 175.35 175.11 3d3w n GLY 18 N -0.23 2.68 0.21 -3.33 0.00 -1.26 -2.23 105.19 101.05 3d3w n GLY 18 Ca -0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 46.02 45.83 3d3w n GLY 18 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3d3w h ILE 19 N 0.00 0.63 -0.61 -0.61 2.04 -1.93 -1.23 117.51 115.80 3d3w h ILE 19 Ca 0.00 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 3d3w h ILE 19 Cb 0.00 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 36.47 3d3w h ILE 19 CO 0.00 0.04 0.36 1.23 0.00 0.00 0.00 178.15 179.77 3d3w h GLY 20 N 0.19 0.89 0.69 5.37 0.00 -1.65 -0.35 103.07 108.21 3d3w h GLY 20 Ca 0.28 -0.38 0.03 0.00 0.00 0.00 0.00 47.33 47.26 3d3w h GLY 20 CO -0.41 0.37 -0.04 -0.09 0.00 0.00 0.00 176.54 176.37 3d3w h ARG 21 N 0.83 -0.01 -0.57 4.80 2.43 -0.96 -1.28 114.38 119.62 3d3w h ARG 21 Ca 0.22 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.43 3d3w h ARG 21 Cb -0.00 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 3d3w h ARG 21 CO -0.04 -0.00 0.38 0.78 -1.51 0.00 0.00 179.97 179.58 3d3w h GLY 22 N -0.01 0.73 0.80 2.80 0.00 -1.12 0.70 103.07 106.97 3d3w h GLY 22 Ca 0.07 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 47.08 3d3w h GLY 22 CO -0.16 0.21 -0.19 -0.84 0.00 0.00 0.00 176.54 175.56 3d3w h THR 23 N 0.62 1.34 -0.43 4.70 2.02 -0.66 -0.60 112.91 119.91 3d3w h THR 23 Ca 0.24 -1.37 0.05 0.00 0.77 0.00 0.00 66.41 66.10 3d3w h THR 23 Cb 0.15 1.83 -0.05 0.00 -1.74 0.00 0.00 68.15 68.34 3d3w h THR 23 CO -0.07 0.41 0.16 0.58 0.37 0.00 0.00 175.52 176.98 3d3w h VAL 24 N 0.10 0.88 0.20 3.16 2.07 -0.77 -1.45 116.25 120.43 3d3w h VAL 24 Ca 0.03 -0.11 0.00 0.00 0.82 0.00 0.00 66.70 67.43 3d3w h VAL 24 Cb 0.74 0.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3d3w h VAL 24 CO 0.05 0.06 -0.18 1.56 0.02 0.00 0.00 177.57 179.07 3d3w h GLN 25 N 0.33 -0.39 -0.84 1.57 4.20 -0.71 -1.35 115.11 117.92 3d3w h GLN 25 Ca 0.20 0.03 0.07 0.00 0.06 0.00 0.00 58.65 59.00 3d3w h GLN 25 Cb 0.18 0.09 -0.06 0.00 0.30 0.00 0.00 27.48 27.98 3d3w h GLN 25 CO -0.19 -0.26 0.51 0.00 -0.67 0.00 0.00 178.83 178.22 3d3w h ALA 26 N 0.35 1.16 -0.34 3.87 0.00 -0.96 -1.30 119.26 122.04 3d3w h ALA 26 Ca -0.00 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 3d3w h ALA 26 Cb 0.38 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3d3w h ALA 26 CO -0.04 0.24 -0.43 -0.07 0.00 0.00 0.00 179.25 178.95 3d3w h LEU 27 N 0.93 0.93 -0.31 0.00 3.38 -1.10 -2.38 115.31 116.76 3d3w h LEU 27 Ca 0.37 -0.45 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 3d3w h LEU 27 Cb 0.19 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 3d3w h LEU 27 CO -0.18 1.23 0.00 -0.74 0.09 0.00 0.00 178.44 178.84 3d3w h HIS 28 N 0.70 0.60 -0.55 1.13 2.76 -1.06 0.26 115.15 118.98 3d3w h HIS 28 Ca 0.05 -0.10 0.05 0.00 -2.20 0.00 0.00 60.37 58.16 3d3w h HIS 28 Cb 1.01 -0.16 -0.03 0.00 1.55 0.00 0.00 27.41 29.79 3d3w h HIS 28 CO 0.06 0.68 0.37 0.00 -1.30 0.00 0.00 177.93 177.74 3d3w h ALA 29 N 0.84 1.80 -0.01 5.26 0.00 -1.15 -2.20 119.26 123.81 3d3w h ALA 29 Ca 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3d3w h ALA 29 Cb 0.44 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3d3w h ALA 29 CO 0.02 0.12 -0.01 2.41 0.00 0.00 0.00 179.25 181.79 3d3w n THR 30 N -4.47 0.00 -0.42 0.00 -1.04 -0.91 -4.94 114.28 102.50 3d3w n THR 30 Ca 0.07 -0.15 0.00 0.00 -2.04 0.00 0.00 64.05 61.93 3d3w n THR 30 Cb 0.20 0.13 0.00 0.00 -1.82 0.00 0.00 70.33 68.84 3d3w n THR 30 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 3d3w n GLY 31 N 1.12 0.79 3.79 3.41 0.00 -0.83 -4.03 105.19 109.44 3d3w n GLY 31 Ca 0.20 -0.02 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 3d3w n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d3w s ALA 32 N -2.00 2.73 -0.21 4.61 0.00 0.05 -1.06 121.76 125.88 3d3w s ALA 32 Ca 0.00 0.57 -0.19 0.00 0.00 0.00 0.00 51.96 52.34 3d3w s ALA 32 Cb 0.00 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.82 3d3w s ALA 32 CO 0.00 -0.72 0.57 1.03 0.00 0.00 0.00 175.76 176.65 3d3w s ARG 33 N -3.66 4.17 -0.06 0.00 0.52 -0.45 -4.39 118.95 115.09 3d3w s ARG 33 Ca 0.67 0.50 0.05 0.00 -0.52 0.00 0.00 55.73 56.43 3d3w s ARG 33 Cb -0.18 -3.59 -0.02 0.00 0.52 0.00 0.00 34.95 31.68 3d3w s ARG 33 CO 0.30 -0.24 -0.21 0.08 0.02 0.00 0.00 175.30 175.25 3d3w s VAL 34 N 1.93 2.43 -0.34 3.52 1.01 -1.26 0.04 120.40 127.72 3d3w s VAL 34 Ca 0.26 -0.93 -0.10 0.00 0.00 0.00 0.00 61.98 61.20 3d3w s VAL 34 Cb -0.16 -1.92 0.01 0.00 0.00 0.00 0.00 36.38 34.32 3d3w s VAL 34 CO 0.10 0.57 0.17 -0.69 0.00 0.00 0.00 175.10 175.25 3d3w s VAL 35 N -0.25 4.49 -0.34 2.92 1.01 0.17 -0.95 120.40 127.45 3d3w s VAL 35 Ca -0.00 -0.71 -0.14 0.00 0.00 0.00 0.00 61.98 61.13 3d3w s VAL 35 Cb -0.13 -3.42 -0.02 0.00 0.00 0.00 0.00 36.38 32.82 3d3w s VAL 35 CO 0.03 -0.10 0.28 0.00 0.00 0.00 0.00 175.10 175.31 3d3w s ALA 36 N 1.56 3.50 -0.13 5.51 0.00 -0.49 -0.47 121.76 131.24 3d3w s ALA 36 Ca 0.03 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 50.67 3d3w s ALA 36 Cb -0.18 -2.72 -0.01 0.00 0.00 0.00 0.00 23.12 20.21 3d3w s ALA 36 CO 0.06 -1.00 -0.14 0.08 0.00 0.00 0.00 175.76 174.75 3d3w s VAL 37 N 1.82 2.88 0.12 0.00 1.01 -0.15 -0.85 120.40 125.22 3d3w s VAL 37 Ca 0.08 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 61.09 3d3w s VAL 37 Cb -0.17 -2.20 0.07 0.00 0.00 0.00 0.00 36.38 34.08 3d3w s VAL 37 CO 0.11 0.52 0.80 -0.55 0.00 0.00 0.00 175.10 175.99 3d3w s SER 38 N 0.46 -0.36 0.08 3.32 0.15 -0.89 -0.87 113.70 115.59 3d3w s SER 38 Ca -0.11 -0.19 -0.05 0.00 0.70 0.00 0.00 55.95 56.31 3d3w s SER 38 Cb -0.16 0.52 -0.26 0.00 -1.71 0.00 0.00 66.02 64.41 3d3w s SER 38 CO 0.05 -0.89 1.16 -0.09 1.20 0.00 0.00 173.24 174.67 3d3w h ARG 39 N 2.00 0.30 -5.06 5.44 2.43 -1.88 -2.18 114.38 115.43 3d3w h ARG 39 Ca -0.25 -0.47 -0.65 0.00 -0.81 0.00 0.00 59.98 57.80 3d3w h ARG 39 Cb 1.26 0.17 -0.24 0.00 -0.42 0.00 0.00 29.97 30.74 3d3w h ARG 39 CO 0.30 1.21 -0.66 0.99 -1.51 0.00 0.00 179.97 180.30 3d3w s THR 40 N -2.74 3.96 0.18 0.20 2.01 -1.26 -4.50 115.64 113.49 3d3w s THR 40 Ca -0.04 -0.30 -0.12 0.00 0.31 0.00 0.00 61.69 61.53 3d3w s THR 40 Cb 0.07 -2.81 0.09 0.00 0.01 0.00 0.00 72.50 69.86 3d3w s THR 40 CO 0.88 0.40 1.79 -0.61 -0.69 0.00 0.00 174.62 176.40 3d3w h GLN 41 N 7.79 0.84 -0.89 4.92 5.75 -1.98 -2.66 115.11 128.88 3d3w h GLN 41 Ca -0.38 -0.10 0.12 0.00 -0.15 0.00 0.00 58.65 58.14 3d3w h GLN 41 Cb 1.17 -0.16 -0.08 0.00 1.07 0.00 0.00 27.48 29.48 3d3w h GLN 41 CO 0.60 0.64 0.52 0.00 -2.65 0.00 0.00 178.83 177.94 3d3w h ALA 42 N 1.15 1.32 -0.72 3.38 0.00 -1.99 0.06 119.26 122.46 3d3w h ALA 42 Ca 0.21 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.20 3d3w h ALA 42 Cb 0.05 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 3d3w h ALA 42 CO -0.03 0.08 0.46 -0.44 0.00 0.00 0.00 179.25 179.32 3d3w h ASP 43 N 0.81 0.75 -0.23 0.00 3.32 -1.79 -2.46 116.42 116.82 3d3w h ASP 43 Ca 0.45 -0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.30 3d3w h ASP 43 Cb 0.49 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.88 3d3w h ASP 43 CO -0.29 0.52 -0.63 -0.07 -1.72 0.00 0.00 179.24 177.06 3d3w h LEU 44 N 0.89 0.95 -0.02 1.55 3.38 -1.24 -2.41 115.31 118.40 3d3w h LEU 44 Ca 0.29 -0.57 0.03 0.00 0.09 0.00 0.00 57.88 57.72 3d3w h LEU 44 Cb 0.02 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 3d3w h LEU 44 CO -0.11 1.35 -0.22 0.44 0.09 0.00 0.00 178.44 179.99 3d3w h ASP 45 N 0.59 -0.66 -0.67 -0.43 3.32 -0.82 -1.15 116.42 116.60 3d3w h ASP 45 Ca -0.01 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.11 3d3w h ASP 45 Cb 1.24 0.28 -0.03 0.00 0.22 0.00 0.00 39.33 41.04 3d3w h ASP 45 CO 0.13 -0.29 0.34 0.77 -1.72 0.00 0.00 179.24 178.47 3d3w h SER 46 N -0.34 0.89 -0.26 6.45 4.64 -1.50 -2.42 113.55 121.00 3d3w h SER 46 Ca 0.07 -0.09 -0.08 0.00 -0.47 0.00 0.00 61.79 61.21 3d3w h SER 46 Cb 0.43 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 3d3w h SER 46 CO -0.22 0.75 -0.15 0.25 -0.87 0.00 0.00 176.83 176.60 3d3w h LEU 47 N 0.98 0.59 -1.52 5.97 5.85 -1.17 -0.99 115.31 125.03 3d3w h LEU 47 Ca 0.24 -0.42 -0.01 0.00 0.84 0.00 0.00 57.88 58.53 3d3w h LEU 47 Cb 0.10 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 3d3w h LEU 47 CO -0.03 0.88 0.23 -0.37 -0.34 0.00 0.00 178.44 178.81 3d3w h VAL 48 N 0.29 1.13 -0.39 1.05 -1.51 -1.04 0.56 116.25 116.34 3d3w h VAL 48 Ca 0.06 -0.30 -0.02 0.00 -1.23 0.00 0.00 66.70 65.20 3d3w h VAL 48 Cb 0.67 0.56 -0.02 0.00 -2.13 0.00 0.00 31.29 30.37 3d3w h VAL 48 CO 0.04 0.14 0.17 0.03 -1.23 0.00 0.00 177.57 176.72 3d3w h ARG 49 N 0.57 0.58 -0.46 5.19 3.08 -1.07 -2.84 114.38 119.43 3d3w h ARG 49 Ca 0.15 -0.10 -0.06 0.00 0.07 0.00 0.00 59.98 60.05 3d3w h ARG 49 Cb 0.00 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 29.93 3d3w h ARG 49 CO -0.03 0.53 0.06 0.93 -1.07 0.00 0.00 179.97 180.39 3d3w h GLU 50 N 0.49 0.72 -2.11 0.04 5.08 -0.63 -3.38 114.58 114.78 3d3w h GLU 50 Ca 0.13 -0.16 -0.57 0.00 -1.00 0.00 0.00 59.36 57.76 3d3w h GLU 50 Cb 0.16 -0.10 -0.41 0.00 0.50 0.00 0.00 28.75 28.91 3d3w h GLU 50 CO -0.01 0.69 -0.86 0.00 -1.00 0.00 0.00 179.01 177.83 3d3w n PRO 52 N 0.84 2.76 0.00 0.00 -0.02 -1.08 -2.57 135.00 134.92 3d3w n PRO 52 Ca 0.26 0.99 0.00 0.00 -2.02 0.00 0.00 63.50 62.73 3d3w n PRO 52 Cb 0.48 -2.80 0.00 0.00 -0.02 0.00 0.00 33.50 31.17 3d3w n PRO 52 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d3w n GLY 53 N 2.78 0.43 3.79 -1.23 0.00 -1.26 -5.08 105.19 104.61 3d3w n GLY 53 Ca 0.11 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 3d3w n GLY 53 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d3w s ILE 54 N -2.00 3.52 -0.45 -0.61 -4.36 -1.06 -4.74 121.20 111.50 3d3w s ILE 54 Ca 0.00 1.00 -0.14 0.00 -0.26 0.00 0.00 60.65 61.25 3d3w s ILE 54 Cb 0.00 -3.44 0.06 0.00 1.25 0.00 0.00 42.46 40.34 3d3w s ILE 54 CO 0.00 -0.15 0.35 -1.61 0.24 0.00 0.00 174.94 173.77 3d3w s GLU 55 N -3.07 2.92 0.30 0.37 2.02 -0.13 -4.97 118.70 116.14 3d3w s GLU 55 Ca 0.67 -1.29 -0.28 0.00 0.02 0.00 0.00 54.97 54.09 3d3w s GLU 55 Cb -0.21 -4.03 -0.09 0.00 0.10 0.00 0.00 34.13 29.90 3d3w s GLU 55 CO 0.25 -0.95 1.01 -1.25 0.02 0.00 0.00 175.26 174.34 3d3w s PRO 56 N 1.61 4.59 -0.19 0.39 0.04 -1.26 -1.40 135.00 138.78 3d3w s PRO 56 Ca 0.04 1.55 -0.04 0.00 0.04 0.00 0.00 61.00 62.59 3d3w s PRO 56 Cb -0.23 -2.99 0.06 0.00 0.04 0.00 0.00 34.50 31.38 3d3w s PRO 56 CO 0.07 0.24 0.07 0.54 0.04 0.00 0.00 177.00 177.96 3d3w s VAL 57 N -1.37 0.22 -0.33 -0.36 0.11 -0.03 -4.91 120.40 113.72 3d3w s VAL 57 Ca 0.48 -0.41 -0.17 0.00 -2.93 0.00 0.00 61.98 58.94 3d3w s VAL 57 Cb -0.25 -0.84 -0.01 0.00 -1.53 0.00 0.00 36.38 33.75 3d3w s VAL 57 CO 0.32 -0.28 0.46 0.00 -3.33 0.00 0.00 175.10 172.26 3d3w s VAL 59 N 2.25 0.02 -0.58 0.00 0.11 -0.82 -4.98 120.40 116.40 3d3w s VAL 59 Ca 0.17 -0.14 -0.23 0.00 -2.93 0.00 0.00 61.98 58.84 3d3w s VAL 59 Cb -0.16 -0.87 0.05 0.00 -1.53 0.00 0.00 36.38 33.87 3d3w s VAL 59 CO 0.12 -0.08 0.92 -0.62 -3.33 0.00 0.00 175.10 172.12 3d3w s ASP 60 N -1.08 6.28 0.08 3.54 -1.08 -1.26 -3.57 116.67 119.58 3d3w s ASP 60 Ca -0.11 -0.57 0.13 0.00 -0.52 0.00 0.00 52.55 51.48 3d3w s ASP 60 Cb -0.02 -2.42 0.56 0.00 -1.46 0.00 0.00 42.92 39.58 3d3w s ASP 60 CO 0.07 -1.26 1.39 0.18 0.52 0.00 0.00 175.17 176.07 3d3w n LEU 61 N 7.43 0.18 0.20 -1.34 4.77 -1.26 -1.42 117.00 125.56 3d3w n LEU 61 Ca -0.00 0.56 0.14 0.00 -0.03 0.00 0.00 56.01 56.68 3d3w n LEU 61 Cb 0.47 -0.55 0.57 0.00 -2.33 0.00 0.00 43.42 41.58 3d3w n LEU 61 CO 0.63 -0.46 0.92 1.23 -1.33 0.00 0.00 177.39 178.38 3d3w h GLY 62 N 1.41 0.00 -7.15 -0.72 0.00 -1.91 -3.41 103.07 91.29 3d3w h GLY 62 Ca 0.00 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 46.60 3d3w h GLY 62 CO 0.00 0.00 -0.02 -0.35 0.00 0.00 0.00 176.54 176.17 3d3w s ASP 63 N -4.96 6.20 0.14 0.19 -1.08 -0.51 -4.79 116.67 111.86 3d3w s ASP 63 Ca 0.03 -1.63 -0.23 0.00 -0.52 0.00 0.00 52.55 50.20 3d3w s ASP 63 Cb 0.09 -2.26 -0.01 0.00 -1.46 0.00 0.00 42.92 39.28 3d3w s ASP 63 CO 0.48 -0.99 1.64 -0.25 0.52 0.00 0.00 175.17 176.57 3d3w h TRP 64 N 9.02 -0.58 -0.80 -5.34 2.91 -1.85 0.10 115.95 119.41 3d3w h TRP 64 Ca -0.28 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 59.74 3d3w h TRP 64 Cb 1.09 0.28 -0.04 0.00 -0.51 0.00 0.00 29.16 29.98 3d3w h TRP 64 CO 0.80 -0.30 0.39 0.93 -1.03 0.00 0.00 178.44 179.23 3d3w h GLU 65 N -0.27 1.14 -0.06 2.65 3.07 -1.96 -1.69 114.58 117.45 3d3w h GLU 65 Ca 0.10 -0.16 -0.17 0.00 -0.50 0.00 0.00 59.36 58.63 3d3w h GLU 65 Cb 0.43 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 3d3w h GLU 65 CO -0.30 0.88 -0.70 0.00 -1.40 0.00 0.00 179.01 177.49 3d3w h ALA 66 N 1.20 0.69 0.06 3.43 0.00 -1.84 -2.64 119.26 120.16 3d3w h ALA 66 Ca 0.28 -0.60 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 3d3w h ALA 66 Cb 0.11 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.82 3d3w h ALA 66 CO -0.04 0.77 -0.03 1.15 0.00 0.00 0.00 179.25 181.11 3d3w h THR 67 N 0.21 1.02 -0.63 0.00 2.02 -0.57 0.23 112.91 115.19 3d3w h THR 67 Ca -0.02 -0.29 0.13 0.00 0.77 0.00 0.00 66.41 67.00 3d3w h THR 67 Cb 1.25 1.22 -0.10 0.00 -1.74 0.00 0.00 68.15 68.78 3d3w h THR 67 CO 0.11 0.07 0.05 -0.08 0.37 0.00 0.00 175.52 176.04 3d3w h GLU 68 N -0.22 0.15 -0.24 6.66 4.81 -1.32 0.10 114.58 124.52 3d3w h GLU 68 Ca -0.01 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.15 3d3w h GLU 68 Cb 0.19 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 3d3w h GLU 68 CO 0.01 0.10 -0.08 0.00 -0.73 0.00 0.00 179.01 178.32 3d3w h ARG 69 N 0.16 0.48 -0.39 1.92 3.08 -1.27 -0.53 114.38 117.83 3d3w h ARG 69 Ca 0.34 -0.19 -0.10 0.00 0.07 0.00 0.00 59.98 60.09 3d3w h ARG 69 Cb 0.55 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 3d3w h ARG 69 CO -0.51 0.72 -0.17 0.00 -1.07 0.00 0.00 179.97 178.95 3d3w h ALA 70 N 0.75 0.99 -0.39 0.04 0.00 -0.70 -3.25 119.26 116.70 3d3w h ALA 70 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3d3w h ALA 70 Cb 0.56 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3d3w h ALA 70 CO 0.03 0.60 0.00 1.28 0.00 0.00 0.00 179.25 181.16 3d3w n LEU 71 N -4.14 3.33 0.00 0.00 4.77 0.34 -4.63 117.00 116.66 3d3w n LEU 71 Ca 0.01 -1.57 0.00 0.00 -0.03 0.00 0.00 56.01 54.42 3d3w n LEU 71 Cb 0.39 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3d3w n LEU 71 CO 0.43 0.74 0.12 0.61 -1.33 0.00 0.00 177.39 177.96 3d3w n GLY 72 N 1.32 -1.81 2.75 -0.72 0.00 -0.21 -3.28 105.19 103.24 3d3w n GLY 72 Ca 0.18 0.39 -0.37 0.00 0.00 0.00 0.00 46.02 46.22 3d3w n GLY 72 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d3w n SER 73 N -0.74 6.58 0.08 1.61 3.41 -1.26 -4.70 113.62 118.60 3d3w n SER 73 Ca 0.00 -3.73 -0.02 0.00 -0.26 0.00 0.00 58.87 54.85 3d3w n SER 73 Cb 0.00 -0.95 0.22 0.00 -0.26 0.00 0.00 64.21 63.22 3d3w n SER 73 CO 0.00 0.00 0.00 1.62 -0.16 0.00 0.00 175.04 176.50 3d3w h VAL 74 N 2.34 1.30 0.00 -3.33 3.04 -1.84 -3.49 116.25 114.26 3d3w h VAL 74 Ca 0.44 -1.45 0.00 0.00 -1.01 0.00 0.00 66.70 64.68 3d3w h VAL 74 Cb 0.34 1.61 0.00 0.00 -2.01 0.00 0.00 31.29 31.23 3d3w h VAL 74 CO 1.14 0.44 0.00 0.61 -1.01 0.00 0.00 177.57 178.75 3d3w n GLY 75 N -0.23 -1.75 3.71 3.17 0.00 -1.26 -4.92 105.19 103.90 3d3w n GLY 75 Ca -0.01 -1.97 -0.42 0.00 0.00 0.00 0.00 46.02 43.61 3d3w n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3d3w s PRO 76 N 0.00 4.23 -0.11 1.61 0.04 -1.26 -4.98 135.00 134.53 3d3w s PRO 76 Ca 0.00 2.26 0.01 0.00 0.04 0.00 0.00 61.00 63.31 3d3w s PRO 76 Cb 0.00 -3.36 0.02 0.00 0.04 0.00 0.00 34.50 31.20 3d3w s PRO 76 CO 0.00 -0.62 -0.11 0.08 0.04 0.00 0.00 177.00 176.40 3d3w s VAL 77 N 1.75 1.21 -0.09 -0.36 1.01 -1.26 -4.81 120.40 117.84 3d3w s VAL 77 Ca 0.70 -0.44 0.15 0.00 0.00 0.00 0.00 61.98 62.39 3d3w s VAL 77 Cb -0.40 -1.17 -0.20 0.00 0.00 0.00 0.00 36.38 34.61 3d3w s VAL 77 CO 0.31 0.39 0.63 0.47 0.00 0.00 0.00 175.10 176.90 3d3w n ASP 78 N 4.59 0.72 -3.98 3.32 8.00 0.24 -4.67 116.55 124.77 3d3w n ASP 78 Ca -0.16 0.33 -0.12 0.00 0.71 0.00 0.00 54.79 55.55 3d3w n ASP 78 Cb 0.50 0.23 -0.12 0.00 -0.02 0.00 0.00 41.12 41.71 3d3w n ASP 78 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3d3w s LEU 79 N -5.85 2.17 -0.04 0.64 1.43 -0.94 -3.24 118.68 112.85 3d3w s LEU 79 Ca -0.05 -0.36 -0.01 0.00 -1.03 0.00 0.00 54.13 52.68 3d3w s LEU 79 Cb 0.08 -0.05 0.03 0.00 0.03 0.00 0.00 46.19 46.29 3d3w s LEU 79 CO 0.82 -0.16 0.07 -0.22 0.23 0.00 0.00 176.35 177.09 3d3w s LEU 80 N -1.03 0.86 -0.29 1.79 2.96 -0.56 -1.60 118.68 120.81 3d3w s LEU 80 Ca -0.09 0.12 0.02 0.00 -0.22 0.00 0.00 54.13 53.97 3d3w s LEU 80 Cb -0.07 0.05 0.07 0.00 0.50 0.00 0.00 46.19 46.74 3d3w s LEU 80 CO -0.00 -0.15 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.15 3d3w s VAL 81 N 1.24 2.35 -0.75 1.68 1.01 -0.24 -0.64 120.40 125.04 3d3w s VAL 81 Ca -0.07 -1.83 -0.23 0.00 0.00 0.00 0.00 61.98 59.85 3d3w s VAL 81 Cb -0.13 -2.49 0.07 0.00 0.00 0.00 0.00 36.38 33.83 3d3w s VAL 81 CO -0.04 -0.23 1.09 0.20 0.00 0.00 0.00 175.10 176.12 3d3w s ASN 82 N 1.09 6.28 -0.03 3.32 0.01 0.20 -1.58 114.94 124.23 3d3w s ASN 82 Ca -0.02 -1.13 0.03 0.00 -0.71 0.00 0.00 52.86 51.03 3d3w s ASN 82 Cb -0.20 -2.45 -0.04 0.00 0.41 0.00 0.00 41.25 38.97 3d3w s ASN 82 CO -0.05 -1.45 0.02 -3.20 -1.51 0.00 0.00 177.10 170.90 3d3w n ASN 83 N 7.90 4.18 -4.64 -1.22 5.15 -1.24 -0.89 115.26 124.50 3d3w n ASN 83 Ca 0.05 0.00 -0.47 0.00 -0.60 0.00 0.00 54.58 53.56 3d3w n ASN 83 Cb 0.47 0.65 -0.04 0.00 -0.53 0.00 0.00 39.78 40.33 3d3w n ASN 83 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3d3w n ALA 84 N -2.07 0.50 -3.47 5.20 0.00 -1.17 -4.81 120.51 114.69 3d3w n ALA 84 Ca -0.05 0.45 -0.10 0.00 0.00 0.00 0.00 53.44 53.74 3d3w n ALA 84 Cb 0.55 -2.22 -0.02 0.00 0.00 0.00 0.00 19.45 17.76 3d3w n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d3w s ALA 85 N 0.35 -1.68 0.00 0.00 0.00 -1.26 -4.61 121.76 114.57 3d3w s ALA 85 Ca 0.76 0.67 0.08 0.00 0.00 0.00 0.00 51.96 53.46 3d3w s ALA 85 Cb -0.75 0.70 -0.02 0.00 0.00 0.00 0.00 23.12 23.05 3d3w s ALA 85 CO 0.45 -0.75 -0.24 0.14 0.00 0.00 0.00 175.76 175.36 3d3w s VAL 86 N -3.50 1.92 -0.52 0.00 -7.23 -1.26 -5.03 120.40 104.77 3d3w s VAL 86 Ca 0.03 -1.12 -0.04 0.00 -1.81 0.00 0.00 61.98 59.04 3d3w s VAL 86 Cb -0.01 -1.61 0.14 0.00 0.56 0.00 0.00 36.38 35.45 3d3w s VAL 86 CO -0.11 0.46 0.33 0.00 -0.31 0.00 0.00 175.10 175.48 3d3w s ALA 87 N -0.64 3.38 -0.51 1.32 0.00 -1.26 -4.94 121.76 119.12 3d3w s ALA 87 Ca 0.10 -2.87 -0.17 0.00 0.00 0.00 0.00 51.96 49.02 3d3w s ALA 87 Cb -0.09 -2.58 0.09 0.00 0.00 0.00 0.00 23.12 20.53 3d3w s ALA 87 CO 0.00 -1.95 0.50 -0.51 0.00 0.00 0.00 175.76 173.79 3d3w s LEU 88 N 0.61 5.62 -0.22 0.00 1.43 -1.26 -5.04 118.68 119.83 3d3w s LEU 88 Ca 0.12 -1.38 -0.13 0.00 -1.03 0.00 0.00 54.13 51.72 3d3w s LEU 88 Cb -0.22 -2.25 -0.05 0.00 0.03 0.00 0.00 46.19 43.71 3d3w s LEU 88 CO -0.04 -0.79 0.25 -0.76 0.23 0.00 0.00 176.35 175.24 3d3w s LEU 89 N 1.92 4.15 -0.05 1.79 1.43 -1.26 -4.63 118.68 122.03 3d3w s LEU 89 Ca 0.07 0.29 -0.04 0.00 -1.03 0.00 0.00 54.13 53.42 3d3w s LEU 89 Cb -0.25 -2.26 0.01 0.00 0.03 0.00 0.00 46.19 43.72 3d3w s LEU 89 CO 0.07 0.03 0.12 -1.10 0.23 0.00 0.00 176.35 175.70 3d3w s GLN 90 N 1.01 0.14 0.56 1.70 -0.21 -0.90 -5.05 119.66 116.91 3d3w s GLN 90 Ca 0.12 0.19 -0.19 0.00 0.02 0.00 0.00 55.36 55.50 3d3w s GLN 90 Cb -0.14 0.05 -0.08 0.00 1.00 0.00 0.00 33.01 33.84 3d3w s GLN 90 CO 0.05 -0.03 0.66 -2.30 -2.12 0.00 0.00 175.29 171.54 3d3w n PRO 91 N 3.12 0.65 -0.23 2.91 -0.02 -1.26 -4.34 135.00 135.82 3d3w n PRO 91 Ca -0.14 0.25 0.03 0.00 -2.02 0.00 0.00 63.50 61.63 3d3w n PRO 91 Cb 0.58 -1.82 0.15 0.00 -0.02 0.00 0.00 33.50 32.40 3d3w n PRO 91 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 3d3w h PHE 92 N 0.40 0.38 0.00 6.00 3.57 -1.99 0.95 116.94 126.25 3d3w h PHE 92 Ca -0.46 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.08 3d3w h PHE 92 Cb 1.39 -0.07 0.00 0.00 2.79 0.00 0.00 35.95 40.06 3d3w h PHE 92 CO 0.34 0.03 0.00 1.28 -2.23 0.00 0.00 178.31 177.72 3d3w n LEU 93 N -5.05 0.00 -0.67 0.59 4.77 -1.26 -2.53 117.00 112.84 3d3w n LEU 93 Ca 0.12 0.45 0.09 0.00 -0.03 0.00 0.00 56.01 56.64 3d3w n LEU 93 Cb 0.37 -0.45 0.06 0.00 -2.33 0.00 0.00 43.42 41.07 3d3w n LEU 93 CO 0.18 -0.14 0.49 -0.62 -1.33 0.00 0.00 177.39 175.96 3d3w n GLU 94 N -1.45 1.59 -1.66 3.23 1.02 0.26 -5.02 120.64 118.62 3d3w n GLU 94 Ca 0.06 -1.45 -0.46 0.00 -0.02 0.00 0.00 57.16 55.29 3d3w n GLU 94 Cb 0.22 -1.35 -0.03 0.00 -0.02 0.00 0.00 31.44 30.25 3d3w n GLU 94 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3d3w n VAL 95 N 0.80 0.67 -4.19 2.62 0.31 -0.80 -4.87 118.33 112.88 3d3w n VAL 95 Ca 0.10 -0.17 -0.29 0.00 -0.01 0.00 0.00 64.34 63.98 3d3w n VAL 95 Cb 0.45 -1.40 -0.09 0.00 -0.91 0.00 0.00 33.84 31.89 3d3w n VAL 95 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 3d3w s THR 96 N 0.19 3.68 0.25 2.52 -4.23 -1.26 -5.02 115.64 111.77 3d3w s THR 96 Ca 0.72 -1.24 -0.04 0.00 -1.18 0.00 0.00 61.69 59.95 3d3w s THR 96 Cb -0.69 -2.78 0.25 0.00 1.34 0.00 0.00 72.50 70.62 3d3w s THR 96 CO 0.47 0.04 1.67 0.50 -0.54 0.00 0.00 174.62 176.75 3d3w h LYS 97 N 3.24 0.23 -0.38 3.99 3.64 -1.99 -0.95 116.57 124.35 3d3w h LYS 97 Ca -0.48 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 58.87 3d3w h LYS 97 Cb 1.18 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.93 3d3w h LYS 97 CO 0.56 0.15 0.17 0.93 -2.27 0.00 0.00 179.45 179.00 3d3w h GLU 98 N 0.23 0.55 -0.41 1.90 3.07 -1.99 -0.67 114.58 117.26 3d3w h GLU 98 Ca 0.44 -0.09 -0.06 0.00 -0.50 0.00 0.00 59.36 59.15 3d3w h GLU 98 Cb 0.78 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.58 3d3w h GLU 98 CO -0.56 0.50 0.00 0.00 -1.40 0.00 0.00 179.01 177.56 3d3w h ALA 99 N 1.02 0.55 -0.14 3.43 0.00 -1.85 -1.74 119.26 120.53 3d3w h ALA 99 Ca 0.13 -0.26 0.03 0.00 0.00 0.00 0.00 54.91 54.81 3d3w h ALA 99 Cb 0.14 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3d3w h ALA 99 CO -0.01 0.33 -0.05 0.35 0.00 0.00 0.00 179.25 179.86 3d3w h PHE 100 N 0.55 -0.11 0.37 0.00 3.57 -1.07 -1.85 116.94 118.40 3d3w h PHE 100 Ca 0.12 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 3d3w h PHE 100 Cb 0.48 0.07 0.00 0.00 2.79 0.00 0.00 35.95 39.29 3d3w h PHE 100 CO 0.04 -0.08 -0.18 -0.44 -2.23 0.00 0.00 178.31 175.42 3d3w h ASP 101 N -0.02 -0.42 -0.50 0.41 3.32 -0.96 -1.49 116.42 116.76 3d3w h ASP 101 Ca 0.07 -0.05 0.10 0.00 0.02 0.00 0.00 57.03 57.17 3d3w h ASP 101 Cb 0.13 0.11 -0.08 0.00 0.22 0.00 0.00 39.33 39.70 3d3w h ASP 101 CO -0.15 -0.21 0.00 -0.09 -1.72 0.00 0.00 179.24 177.07 3d3w h ARG 102 N -0.61 0.11 -0.03 3.56 9.65 -1.35 -0.84 114.38 124.87 3d3w h ARG 102 Ca -0.05 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 58.82 3d3w h ARG 102 Cb 0.45 -0.03 -0.00 0.00 -1.39 0.00 0.00 29.97 29.00 3d3w h ARG 102 CO 0.08 0.08 0.02 0.77 2.80 0.00 0.00 179.97 183.72 3d3w h SER 103 N 0.12 0.04 0.20 -3.80 0.02 -1.07 -1.84 113.55 107.21 3d3w h SER 103 Ca 0.25 -0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 61.07 3d3w h SER 103 Cb 0.38 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.90 3d3w h SER 103 CO -0.42 0.06 -0.37 -0.26 -1.14 0.00 0.00 176.83 174.69 3d3w h PHE 104 N 0.01 0.28 -0.26 3.45 -1.00 -1.03 0.51 116.94 118.90 3d3w h PHE 104 Ca 0.01 -0.07 -0.02 0.00 2.81 0.00 0.00 57.97 60.71 3d3w h PHE 104 Cb 0.03 -0.06 -0.01 0.00 3.61 0.00 0.00 35.95 39.51 3d3w h PHE 104 CO -0.07 0.59 0.11 0.93 -1.61 0.00 0.00 178.31 178.26 3d3w h GLU 105 N 0.21 0.39 0.08 1.51 5.08 -0.88 0.10 114.58 121.08 3d3w h GLU 105 Ca 0.02 -0.07 -0.16 0.00 -1.00 0.00 0.00 59.36 58.15 3d3w h GLU 105 Cb 0.76 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.95 3d3w h GLU 105 CO 0.06 0.43 -0.78 0.28 -1.00 0.00 0.00 179.01 177.99 3d3w h VAL 106 N 0.27 1.42 0.00 3.13 2.07 -1.28 -1.68 116.25 120.18 3d3w h VAL 106 Ca 0.09 -2.42 -0.00 0.00 0.82 0.00 0.00 66.70 65.19 3d3w h VAL 106 Cb 0.18 3.04 -0.00 0.00 -1.52 0.00 0.00 31.29 32.99 3d3w h VAL 106 CO -0.01 0.64 -0.01 0.78 0.02 0.00 0.00 177.57 179.00 3d3w h ASN 107 N -0.59 0.00 0.00 0.57 4.21 -1.00 -3.36 115.58 115.41 3d3w h ASN 107 Ca -0.16 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.35 3d3w h ASN 107 Cb 1.46 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.66 3d3w h ASN 107 CO 0.05 0.01 -0.19 -0.11 -1.29 0.00 0.00 177.43 175.90 3d3w n LEU 108 N -3.10 0.04 -0.30 1.61 7.94 -0.91 -4.63 117.00 117.64 3d3w n LEU 108 Ca 0.04 0.11 -0.05 0.00 -1.11 0.00 0.00 56.01 54.99 3d3w n LEU 108 Cb 0.52 0.06 0.08 0.00 0.53 0.00 0.00 43.42 44.60 3d3w n LEU 108 CO 0.34 -0.48 1.09 -0.09 -1.11 0.00 0.00 177.39 177.13 3d3w h ARG 109 N 0.00 1.21 -0.47 1.96 2.43 -0.85 -1.49 114.38 117.17 3d3w h ARG 109 Ca 0.00 -0.20 -0.04 0.00 -0.81 0.00 0.00 59.98 58.94 3d3w h ARG 109 Cb 0.19 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 3d3w h ARG 109 CO 0.00 0.95 0.13 0.00 -1.51 0.00 0.00 179.97 179.54 3d3w h ALA 110 N 1.21 1.35 -0.33 2.80 0.00 -1.45 -0.80 119.26 122.04 3d3w h ALA 110 Ca 0.28 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 55.06 3d3w h ALA 110 Cb 0.16 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 3d3w h ALA 110 CO -0.03 0.47 0.12 0.28 0.00 0.00 0.00 179.25 180.08 3d3w h VAL 111 N 0.68 0.91 0.22 0.00 2.07 -1.52 -0.90 116.25 117.72 3d3w h VAL 111 Ca 0.16 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.59 3d3w h VAL 111 Cb 0.23 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 3d3w h VAL 111 CO -0.01 0.05 -0.24 0.40 0.02 0.00 0.00 177.57 177.79 3d3w h ILE 112 N 0.26 0.49 0.01 4.57 2.04 -0.90 -1.87 117.51 122.11 3d3w h ILE 112 Ca 0.15 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.01 3d3w h ILE 112 Cb 0.12 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 36.68 3d3w h ILE 112 CO -0.15 0.00 -0.01 -0.61 0.00 0.00 0.00 178.15 177.38 3d3w h GLN 113 N -0.50 -0.02 -0.56 2.37 4.15 -0.94 0.98 115.11 120.60 3d3w h GLN 113 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.36 3d3w h GLN 113 Cb 0.47 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.14 3d3w h GLN 113 CO -0.06 0.24 0.11 0.28 -1.93 0.00 0.00 178.83 177.46 3d3w h VAL 114 N -0.27 1.25 -0.65 2.39 2.07 -1.19 -1.79 116.25 118.05 3d3w h VAL 114 Ca -0.00 -0.94 0.01 0.00 0.82 0.00 0.00 66.70 66.59 3d3w h VAL 114 Cb 0.26 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.78 3d3w h VAL 114 CO 0.00 0.34 0.43 0.28 0.02 0.00 0.00 177.57 178.64 3d3w h SER 115 N 0.81 0.73 -0.00 0.57 0.02 -1.20 -1.35 113.55 113.13 3d3w h SER 115 Ca 0.17 -0.01 0.02 0.00 -0.84 0.00 0.00 61.79 61.13 3d3w h SER 115 Cb 0.39 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.72 3d3w h SER 115 CO 0.01 0.53 -0.15 1.56 -1.14 0.00 0.00 176.83 177.63 3d3w h GLN 116 N 0.87 -0.24 -0.11 3.45 4.20 -0.51 0.24 115.11 123.00 3d3w h GLN 116 Ca 0.25 0.02 0.04 0.00 0.06 0.00 0.00 58.65 59.01 3d3w h GLN 116 Cb -0.07 0.05 -0.05 0.00 0.30 0.00 0.00 27.48 27.71 3d3w h GLN 116 CO -0.06 -0.16 -0.17 0.82 -0.67 0.00 0.00 178.83 178.59 3d3w h ILE 117 N -0.25 0.56 -0.23 2.54 2.04 -1.08 0.17 117.51 121.26 3d3w h ILE 117 Ca 0.05 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.89 3d3w h ILE 117 Cb 0.31 0.56 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 3d3w h ILE 117 CO -0.15 0.00 0.06 0.58 0.00 0.00 0.00 178.15 178.65 3d3w h VAL 118 N -0.22 1.20 -0.67 1.67 2.07 -1.16 -3.02 116.25 116.12 3d3w h VAL 118 Ca 0.09 -0.65 -0.04 0.00 0.82 0.00 0.00 66.70 66.93 3d3w h VAL 118 Cb 0.35 1.20 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 3d3w h VAL 118 CO -0.24 0.21 0.27 0.00 0.02 0.00 0.00 177.57 177.82 3d3w h ALA 119 N 0.88 0.87 -0.71 1.67 0.00 -0.20 -1.50 119.26 120.27 3d3w h ALA 119 Ca 0.07 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.82 3d3w h ALA 119 Cb 0.26 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3d3w h ALA 119 CO -0.00 0.48 0.47 0.00 0.00 0.00 0.00 179.25 180.21 3d3w h ARG 120 N 0.94 0.94 -0.18 0.00 3.08 -0.70 -0.88 114.38 117.58 3d3w h ARG 120 Ca 0.22 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 60.14 3d3w h ARG 120 Cb 0.20 -0.21 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 3d3w h ARG 120 CO -0.02 0.62 -0.18 0.78 -1.07 0.00 0.00 179.97 180.11 3d3w h GLY 121 N 0.97 0.48 0.89 0.04 0.00 -1.31 -1.14 103.07 103.00 3d3w h GLY 121 Ca 0.26 -0.49 0.02 0.00 0.00 0.00 0.00 47.33 47.13 3d3w h GLY 121 CO -0.06 0.44 0.34 1.41 0.00 0.00 0.00 176.54 178.67 3d3w h LEU 122 N 0.10 0.56 -0.39 3.11 3.38 -0.72 -1.81 115.31 119.53 3d3w h LEU 122 Ca 0.03 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.90 3d3w h LEU 122 Cb 0.71 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 3d3w h LEU 122 CO 0.04 0.40 -0.14 0.40 0.09 0.00 0.00 178.44 179.23 3d3w h ILE 123 N 0.68 1.28 -0.92 1.22 2.04 -1.16 0.18 117.51 120.84 3d3w h ILE 123 Ca 0.22 -1.25 0.05 0.00 1.00 0.00 0.00 64.86 64.88 3d3w h ILE 123 Cb 0.01 1.26 -0.06 0.00 -0.74 0.00 0.00 36.82 37.29 3d3w h ILE 123 CO -0.09 0.42 0.59 0.00 0.00 0.00 0.00 178.15 179.06 3d3w h ALA 124 N 0.83 1.24 0.00 1.87 0.00 -1.07 -1.86 119.26 120.27 3d3w h ALA 124 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3d3w h ALA 124 Cb 0.67 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.18 3d3w h ALA 124 CO 0.05 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.69 3d3w h ARG 125 N 1.10 0.00 -4.11 0.00 3.08 -1.16 -3.48 114.38 109.82 3d3w h ARG 125 Ca 0.38 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 60.17 3d3w h ARG 125 Cb 0.09 0.00 0.09 0.00 0.08 0.00 0.00 29.97 30.23 3d3w h ARG 125 CO -0.15 0.00 -0.44 0.41 -1.07 0.00 0.00 179.97 178.72 3d3w n GLY 126 N 1.09 -0.03 3.33 0.04 0.00 -0.01 -5.04 105.19 104.57 3d3w n GLY 126 Ca 0.04 -0.07 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 3d3w n GLY 126 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d3w s VAL 127 N -3.20 1.91 0.78 1.61 -7.23 -0.85 -5.04 120.40 108.38 3d3w s VAL 127 Ca 0.38 -1.67 -0.11 0.00 -1.81 0.00 0.00 61.98 58.76 3d3w s VAL 127 Cb -0.17 -1.74 0.06 0.00 0.56 0.00 0.00 36.38 35.09 3d3w s VAL 127 CO 0.46 -0.05 1.08 -2.16 -0.31 0.00 0.00 175.10 174.13 3d3w s PRO 128 N -2.09 2.23 0.01 4.82 0.04 -1.26 -4.61 135.00 134.14 3d3w s PRO 128 Ca 0.10 0.97 -0.01 0.00 0.04 0.00 0.00 61.00 62.11 3d3w s PRO 128 Cb -0.09 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.54 3d3w s PRO 128 CO 0.05 -1.61 0.03 0.41 0.04 0.00 0.00 177.00 175.93 3d3w n GLY 129 N -1.52 1.83 3.32 0.56 0.00 -0.92 -4.99 105.19 103.47 3d3w n GLY 129 Ca 0.08 -1.00 -0.14 0.00 0.00 0.00 0.00 46.02 44.96 3d3w n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d3w s ALA 130 N -1.04 -1.06 -0.05 4.61 0.00 -1.20 -1.59 121.76 121.42 3d3w s ALA 130 Ca 0.01 0.87 0.03 0.00 0.00 0.00 0.00 51.96 52.87 3d3w s ALA 130 Cb -0.00 -0.29 0.01 0.00 0.00 0.00 0.00 23.12 22.84 3d3w s ALA 130 CO 0.00 -0.25 -0.13 0.42 0.00 0.00 0.00 175.76 175.80 3d3w s ILE 131 N -0.62 1.15 -0.14 0.00 1.01 0.07 -1.49 121.20 121.19 3d3w s ILE 131 Ca -0.07 -0.52 0.03 0.00 0.00 0.00 0.00 60.65 60.08 3d3w s ILE 131 Cb -0.04 -1.03 0.01 0.00 0.01 0.00 0.00 42.46 41.42 3d3w s ILE 131 CO 0.03 0.35 -0.22 -0.69 0.00 0.00 0.00 174.94 174.41 3d3w s VAL 132 N 0.40 2.06 -0.24 2.92 1.01 0.19 -1.24 120.40 125.49 3d3w s VAL 132 Ca -0.09 -0.98 -0.09 0.00 0.00 0.00 0.00 61.98 60.81 3d3w s VAL 132 Cb -0.13 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 3d3w s VAL 132 CO 0.03 0.55 0.13 0.20 0.00 0.00 0.00 175.10 176.01 3d3w s ASN 133 N 0.80 5.82 -0.57 3.32 0.01 0.11 -0.63 114.94 123.81 3d3w s ASN 133 Ca -0.07 0.02 -0.27 0.00 -0.71 0.00 0.00 52.86 51.83 3d3w s ASN 133 Cb -0.16 -2.05 0.03 0.00 0.41 0.00 0.00 41.25 39.49 3d3w s ASN 133 CO -0.02 0.04 1.09 -0.69 -1.51 0.00 0.00 177.10 176.02 3d3w s VAL 134 N 1.20 4.17 0.00 1.60 1.01 -0.06 -1.75 120.40 126.56 3d3w s VAL 134 Ca 0.06 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.72 3d3w s VAL 134 Cb -0.14 -4.65 0.00 0.00 0.00 0.00 0.00 36.38 31.59 3d3w s VAL 134 CO 0.05 -1.24 0.00 -0.24 0.00 0.00 0.00 175.10 173.67 3d3w n SER 135 N 8.04 0.00 -3.57 3.32 2.88 0.15 -4.88 113.62 119.55 3d3w n SER 135 Ca 0.06 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.47 3d3w n SER 135 Cb 0.48 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.88 3d3w n SER 135 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 3d3w s SER 136 N -1.00 -0.54 0.38 -3.46 0.15 -1.25 -4.32 113.70 103.66 3d3w s SER 136 Ca 0.00 0.74 0.20 0.00 0.70 0.00 0.00 55.95 57.59 3d3w s SER 136 Cb 0.00 0.65 1.23 0.00 -1.71 0.00 0.00 66.02 66.19 3d3w s SER 136 CO 0.00 -0.39 1.64 -0.61 1.20 0.00 0.00 173.24 175.08 3d3w h GLN 137 N 3.33 0.19 0.00 5.44 4.15 -1.12 0.30 115.11 127.40 3d3w h GLN 137 Ca -0.24 -0.01 -0.01 0.00 0.77 0.00 0.00 58.65 59.15 3d3w h GLN 137 Cb 1.16 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.80 3d3w h GLN 137 CO 0.27 0.13 -0.07 0.00 -1.93 0.00 0.00 178.83 177.23 3d3w h SER 139 N 0.00 0.00 0.00 0.00 4.64 -0.64 -3.32 113.55 114.23 3d3w h SER 139 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3d3w h SER 139 Cb 0.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 3d3w h SER 139 CO 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.97 3d3w n GLN 140 N -2.81 0.55 -4.04 4.77 6.02 -1.16 -3.87 117.38 116.85 3d3w n GLN 140 Ca -0.00 -0.06 -0.17 0.00 -0.01 0.00 0.00 57.00 56.75 3d3w n GLN 140 Cb 0.61 -0.39 -0.16 0.00 1.02 0.00 0.00 30.24 31.32 3d3w n GLN 140 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3d3w s ARG 141 N -0.10 0.45 0.29 -1.09 1.81 -1.15 -5.14 118.95 114.03 3d3w s ARG 141 Ca 0.00 -0.03 -0.24 0.00 -1.72 0.00 0.00 55.73 53.74 3d3w s ARG 141 Cb 0.00 -0.54 -0.09 0.00 -0.45 0.00 0.00 34.95 33.87 3d3w s ARG 141 CO 0.00 -0.06 0.88 0.00 -0.68 0.00 0.00 175.30 175.43 3d3w s ALA 142 N 0.70 3.27 -0.06 2.13 0.00 -1.26 -4.31 121.76 122.23 3d3w s ALA 142 Ca -0.08 0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.31 3d3w s ALA 142 Cb -0.11 -3.07 0.01 0.00 0.00 0.00 0.00 23.12 19.95 3d3w s ALA 142 CO -0.01 0.22 -0.11 0.08 0.00 0.00 0.00 175.76 175.94 3d3w s VAL 143 N -1.60 1.03 0.19 0.00 1.01 -1.26 -5.10 120.40 114.67 3d3w s VAL 143 Ca 0.48 -0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.73 3d3w s VAL 143 Cb -0.18 -0.94 -0.17 0.00 0.00 0.00 0.00 36.38 35.09 3d3w s VAL 143 CO 0.23 0.33 0.79 0.41 0.00 0.00 0.00 175.10 176.85 3d3w n THR 144 N 3.74 1.60 -0.99 3.92 -1.04 -1.26 -1.65 114.28 118.60 3d3w n THR 144 Ca -0.23 -0.40 0.00 0.00 -2.04 0.00 0.00 64.05 61.39 3d3w n THR 144 Cb 0.52 -0.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.69 3d3w n THR 144 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3d3w n ASN 145 N 1.77 -4.21 -0.76 8.00 3.02 -1.26 -4.87 115.26 116.95 3d3w n ASN 145 Ca 0.16 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.74 3d3w n ASN 145 Cb 0.24 -1.92 0.20 0.00 -0.61 0.00 0.00 39.78 37.69 3d3w n ASN 145 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3d3w n HIS 146 N -2.48 0.41 -0.12 3.10 8.25 -0.66 -2.12 115.22 121.60 3d3w n HIS 146 Ca 0.00 -1.47 -0.13 0.00 -0.26 0.00 0.00 57.72 55.87 3d3w n HIS 146 Cb 0.23 -0.33 -0.08 0.00 1.12 0.00 0.00 29.99 30.93 3d3w n HIS 146 CO 0.00 0.00 0.00 0.77 0.64 0.00 0.00 176.34 177.75 3d3w h SER 147 N 0.94 -1.72 0.27 0.41 0.02 -1.78 0.30 113.55 111.98 3d3w h SER 147 Ca 0.08 0.23 -0.01 0.00 -0.84 0.00 0.00 61.79 61.25 3d3w h SER 147 Cb 1.24 0.71 0.00 0.00 0.14 0.00 0.00 62.40 64.50 3d3w h SER 147 CO 0.14 -0.40 -0.13 0.58 -1.14 0.00 0.00 176.83 175.88 3d3w h VAL 148 N -0.40 0.77 -0.14 2.27 2.07 -1.87 -2.01 116.25 116.93 3d3w h VAL 148 Ca 0.09 -0.26 0.02 0.00 0.82 0.00 0.00 66.70 67.37 3d3w h VAL 148 Cb 0.61 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 3d3w h VAL 148 CO -0.57 0.06 0.02 0.22 0.02 0.00 0.00 177.57 177.32 3d3w h TYR 149 N -0.50 0.03 -0.66 1.57 3.20 -1.77 -1.18 116.97 117.67 3d3w h TYR 149 Ca -0.04 0.01 0.08 0.00 3.14 0.00 0.00 58.73 61.92 3d3w h TYR 149 Cb 0.37 0.01 -0.06 0.00 1.54 0.00 0.00 36.73 38.58 3d3w h TYR 149 CO -0.02 0.01 0.33 0.00 -1.64 0.00 0.00 178.16 176.84 3d3w h SER 151 N 0.59 0.83 -0.57 0.00 0.02 -0.73 0.50 113.55 114.19 3d3w h SER 151 Ca 0.32 -0.15 -0.07 0.00 -0.84 0.00 0.00 61.79 61.04 3d3w h SER 151 Cb 0.29 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.59 3d3w h SER 151 CO -0.23 0.81 0.09 0.71 -1.14 0.00 0.00 176.83 177.07 3d3w h THR 152 N 0.85 1.26 -0.04 -2.27 1.35 -0.68 0.16 112.91 113.54 3d3w h THR 152 Ca 0.18 -0.98 -0.24 0.00 -0.55 0.00 0.00 66.41 64.82 3d3w h THR 152 Cb 0.31 0.79 0.01 0.00 -1.73 0.00 0.00 68.15 67.53 3d3w h THR 152 CO -0.00 0.36 -0.93 0.11 -0.25 0.00 0.00 175.52 174.81 3d3w h LYS 153 N 0.84 0.59 -0.23 4.72 1.79 -1.01 0.16 116.57 123.43 3d3w h LYS 153 Ca 0.17 -0.58 0.00 0.00 -2.18 0.00 0.00 60.65 58.06 3d3w h LYS 153 Cb 0.42 0.15 -0.01 0.00 -1.58 0.00 0.00 32.23 31.22 3d3w h LYS 153 CO 0.01 1.20 0.15 0.78 -1.08 0.00 0.00 179.45 180.51 3d3w h GLY 154 N 0.82 0.32 0.33 3.86 0.00 -0.90 0.26 103.07 107.76 3d3w h GLY 154 Ca -0.09 -0.12 0.10 0.00 0.00 0.00 0.00 47.33 47.22 3d3w h GLY 154 CO 0.17 0.12 0.21 0.00 0.00 0.00 0.00 176.54 177.04 3d3w h ALA 155 N 1.07 0.78 -0.59 3.60 0.00 -0.90 -2.91 119.26 120.31 3d3w h ALA 155 Ca 0.08 0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 3d3w h ALA 155 Cb -0.02 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3d3w h ALA 155 CO -0.02 -0.22 0.14 1.25 0.00 0.00 0.00 179.25 180.40 3d3w h LEU 156 N 0.37 0.90 -0.46 0.00 5.85 -0.16 0.17 115.31 121.98 3d3w h LEU 156 Ca 0.31 -0.24 0.09 0.00 0.84 0.00 0.00 57.88 58.88 3d3w h LEU 156 Cb 0.41 -0.24 -0.08 0.00 0.37 0.00 0.00 40.66 41.13 3d3w h LEU 156 CO -0.33 0.90 0.00 0.44 -0.34 0.00 0.00 178.44 179.11 3d3w h ASP 157 N 0.85 -0.19 -0.40 1.25 3.32 -0.88 0.47 116.42 120.84 3d3w h ASP 157 Ca 0.18 0.11 -0.14 0.00 0.02 0.00 0.00 57.03 57.21 3d3w h ASP 157 Cb 0.36 0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.09 3d3w h ASP 157 CO 0.00 -0.06 -0.28 0.24 -1.72 0.00 0.00 179.24 177.42 3d3w h MET 158 N 0.11 0.89 -0.64 3.56 2.86 -1.24 -2.52 114.93 117.96 3d3w h MET 158 Ca 0.23 -0.43 0.12 0.00 -2.06 0.00 0.00 59.70 57.56 3d3w h MET 158 Cb 0.34 -0.00 -0.09 0.00 0.06 0.00 0.00 31.60 31.91 3d3w h MET 158 CO -0.38 1.08 0.15 1.25 1.06 0.00 0.00 176.91 180.07 3d3w h LEU 159 N 0.71 0.03 -0.92 1.22 5.85 -0.48 -1.43 115.31 120.28 3d3w h LEU 159 Ca 0.08 0.12 0.09 0.00 0.84 0.00 0.00 57.88 59.00 3d3w h LEU 159 Cb 0.86 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.98 3d3w h LEU 159 CO 0.08 0.01 0.57 0.74 -0.34 0.00 0.00 178.44 179.50 3d3w h THR 160 N 0.28 0.99 -0.12 1.05 2.02 -0.67 -0.15 112.91 116.30 3d3w h THR 160 Ca 0.34 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 67.16 3d3w h THR 160 Cb 0.52 -0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 66.84 3d3w h THR 160 CO -0.42 0.18 0.00 0.11 0.37 0.00 0.00 175.52 175.76 3d3w h LYS 161 N 0.98 0.21 -0.69 6.66 1.57 -0.87 0.11 116.57 124.55 3d3w h LYS 161 Ca 0.43 -0.07 -0.07 0.00 -1.87 0.00 0.00 60.65 59.08 3d3w h LYS 161 Cb 0.30 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 3d3w h LYS 161 CO -0.22 0.45 0.18 0.28 -0.57 0.00 0.00 179.45 179.57 3d3w h VAL 162 N -0.06 1.26 -0.34 0.50 2.07 -1.00 -1.37 116.25 117.31 3d3w h VAL 162 Ca 0.03 -0.95 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 3d3w h VAL 162 Cb 0.36 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 3d3w h VAL 162 CO 0.01 0.36 0.14 0.24 0.02 0.00 0.00 177.57 178.34 3d3w h MET 163 N 1.03 0.50 -0.67 1.57 2.86 -0.96 -0.02 114.93 119.25 3d3w h MET 163 Ca 0.22 -0.09 0.09 0.00 -2.06 0.00 0.00 59.70 57.86 3d3w h MET 163 Cb 0.36 -0.08 -0.07 0.00 0.06 0.00 0.00 31.60 31.87 3d3w h MET 163 CO 0.00 0.50 0.32 0.00 1.06 0.00 0.00 176.91 178.78 3d3w h ALA 164 N 0.98 0.91 0.11 6.32 0.00 -0.77 0.14 119.26 126.95 3d3w h ALA 164 Ca 0.11 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3d3w h ALA 164 Cb 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3d3w h ALA 164 CO -0.01 -0.08 -0.05 1.25 0.00 0.00 0.00 179.25 180.36 3d3w h LEU 165 N 0.55 -0.12 -0.02 0.00 5.85 -0.58 -0.99 115.31 120.00 3d3w h LEU 165 Ca 0.33 -0.10 -0.14 0.00 0.84 0.00 0.00 57.88 58.81 3d3w h LEU 165 Cb 0.35 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 3d3w h LEU 165 CO -0.27 0.03 -0.66 -0.33 -0.34 0.00 0.00 178.44 176.87 3d3w h GLU 166 N -0.27 0.00 0.00 1.25 5.08 -0.79 -3.25 114.58 116.60 3d3w h GLU 166 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3d3w h GLU 166 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 3d3w h GLU 166 CO 0.02 0.66 -1.18 1.28 -1.00 0.00 0.00 179.01 178.79 3d3w n LEU 167 N -3.27 0.58 -0.17 1.33 4.77 0.46 -4.38 117.00 116.32 3d3w n LEU 167 Ca 0.01 -0.10 -0.01 0.00 -0.03 0.00 0.00 56.01 55.88 3d3w n LEU 167 Cb 0.80 -0.06 0.07 0.00 -2.33 0.00 0.00 43.42 41.90 3d3w n LEU 167 CO 0.43 0.07 0.87 1.23 -1.33 0.00 0.00 177.39 178.65 3d3w h GLY 168 N 4.53 0.59 1.90 -0.72 0.00 -1.21 -0.34 103.07 107.82 3d3w h GLY 168 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 47.33 47.37 3d3w h GLY 168 CO 0.00 -0.13 0.05 -2.55 0.00 0.00 0.00 176.54 173.91 3d3w h PRO 169 N 0.16 0.00 -0.64 4.80 0.11 -1.77 -0.25 132.00 134.41 3d3w h PRO 169 Ca 0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.38 3d3w h PRO 169 Cb 0.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.52 3d3w h PRO 169 CO -0.41 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 178.10 3d3w n HIS 170 N -3.08 1.35 -3.87 0.65 8.25 -0.17 -4.95 115.22 113.41 3d3w n HIS 170 Ca -0.03 -0.52 -0.29 0.00 -0.26 0.00 0.00 57.72 56.62 3d3w n HIS 170 Cb 0.12 -0.26 0.03 0.00 1.12 0.00 0.00 29.99 31.01 3d3w n HIS 170 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3d3w n LYS 171 N 0.86 -5.91 -3.95 -0.41 5.02 -0.10 -4.62 118.16 109.04 3d3w n LYS 171 Ca 0.22 0.63 -0.35 0.00 -2.02 0.00 0.00 58.31 56.80 3d3w n LYS 171 Cb 0.82 -5.55 -0.14 0.00 -0.02 0.00 0.00 35.03 30.14 3d3w n LYS 171 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3d3w s ILE 172 N -3.31 2.96 0.17 -0.18 1.01 -1.03 -2.15 121.20 118.67 3d3w s ILE 172 Ca 0.65 -0.94 -0.10 0.00 0.00 0.00 0.00 60.65 60.26 3d3w s ILE 172 Cb -0.32 -2.48 -0.07 0.00 0.01 0.00 0.00 42.46 39.61 3d3w s ILE 172 CO 0.82 0.23 0.50 -0.13 0.00 0.00 0.00 174.94 176.36 3d3w s ARG 173 N 1.35 3.81 -0.07 2.79 0.52 -0.62 -3.80 118.95 122.93 3d3w s ARG 173 Ca 0.01 0.26 -0.01 0.00 -0.52 0.00 0.00 55.73 55.47 3d3w s ARG 173 Cb -0.16 -2.81 0.03 0.00 0.52 0.00 0.00 34.95 32.53 3d3w s ARG 173 CO -0.04 0.42 0.01 0.08 0.02 0.00 0.00 175.30 175.78 3d3w s VAL 174 N -1.63 0.35 0.06 3.52 1.01 -1.26 -0.75 120.40 121.70 3d3w s VAL 174 Ca 0.42 0.12 0.01 0.00 0.00 0.00 0.00 61.98 62.53 3d3w s VAL 174 Cb -0.13 -0.52 -0.03 0.00 0.00 0.00 0.00 36.38 35.70 3d3w s VAL 174 CO 0.21 0.24 -0.06 0.20 0.00 0.00 0.00 175.10 175.69 3d3w s ASN 175 N 1.98 0.84 0.07 3.32 0.01 -0.38 -0.14 114.94 120.65 3d3w s ASN 175 Ca 0.05 -0.77 0.06 0.00 -0.71 0.00 0.00 52.86 51.49 3d3w s ASN 175 Cb -0.12 0.09 -0.04 0.00 0.41 0.00 0.00 41.25 41.59 3d3w s ASN 175 CO -0.05 -0.36 -0.09 0.00 -1.51 0.00 0.00 177.10 175.08 3d3w s ALA 176 N -2.54 2.96 0.02 0.60 0.00 -0.52 0.07 121.76 122.35 3d3w s ALA 176 Ca -0.00 -1.18 0.05 0.00 0.00 0.00 0.00 51.96 50.82 3d3w s ALA 176 Cb -0.02 -0.96 -0.03 0.00 0.00 0.00 0.00 23.12 22.11 3d3w s ALA 176 CO -0.03 0.63 -0.11 0.08 0.00 0.00 0.00 175.76 176.33 3d3w s VAL 177 N -1.15 3.29 -0.52 0.00 1.01 -0.72 -0.52 120.40 121.79 3d3w s VAL 177 Ca 0.20 -0.95 0.04 0.00 0.00 0.00 0.00 61.98 61.27 3d3w s VAL 177 Cb -0.11 -2.42 0.17 0.00 0.00 0.00 0.00 36.38 34.02 3d3w s VAL 177 CO 0.12 0.37 0.39 0.20 0.00 0.00 0.00 175.10 176.18 3d3w s ASN 178 N -1.44 2.90 0.48 3.32 -0.87 -0.14 0.30 114.94 119.50 3d3w s ASN 178 Ca 0.16 -3.32 -0.19 0.00 -1.57 0.00 0.00 52.86 47.94 3d3w s ASN 178 Cb -0.11 -0.93 -0.09 0.00 -0.02 0.00 0.00 41.25 40.10 3d3w s ASN 178 CO 0.07 -0.15 0.99 -2.16 -2.57 0.00 0.00 177.10 173.28 3d3w s PRO 179 N -0.48 3.98 0.02 -0.60 0.05 -1.26 -0.62 135.00 136.08 3d3w s PRO 179 Ca 0.28 1.11 -0.00 0.00 0.05 0.00 0.00 61.00 62.44 3d3w s PRO 179 Cb -0.02 -2.14 0.01 0.00 0.05 0.00 0.00 34.50 32.40 3d3w s PRO 179 CO -0.17 -0.25 0.02 -2.37 0.05 0.00 0.00 177.00 174.28 3d3w n THR 180 N -1.16 0.00 -1.57 1.26 5.66 -0.51 -0.87 114.28 117.09 3d3w n THR 180 Ca 0.07 -0.01 -0.53 0.00 -3.05 0.00 0.00 64.05 60.53 3d3w n THR 180 Cb 0.54 -1.11 -0.06 0.00 -1.55 0.00 0.00 70.33 68.14 3d3w n THR 180 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 3d3w n VAL 181 N -2.48 0.05 -4.54 1.08 0.31 -1.26 -4.77 118.33 106.72 3d3w n VAL 181 Ca 0.00 -0.01 -0.32 0.00 -0.01 0.00 0.00 64.34 64.00 3d3w n VAL 181 Cb 0.01 -0.62 -0.16 0.00 -0.91 0.00 0.00 33.84 32.15 3d3w n VAL 181 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 3d3w s VAL 182 N 0.33 2.02 -0.77 2.52 1.01 -1.26 -1.83 120.40 122.42 3d3w s VAL 182 Ca 0.85 -0.95 -0.25 0.00 0.00 0.00 0.00 61.98 61.63 3d3w s VAL 182 Cb -1.02 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 33.54 3d3w s VAL 182 CO 0.49 0.54 1.83 -0.04 0.00 0.00 0.00 175.10 177.92 3d3w s MET 183 N 0.93 2.70 0.17 2.72 -1.94 -1.26 -3.44 119.30 119.18 3d3w s MET 183 Ca -0.04 0.05 0.03 0.00 -1.71 0.00 0.00 55.69 54.02 3d3w s MET 183 Cb -0.15 -4.72 -0.01 0.00 2.01 0.00 0.00 34.83 31.96 3d3w s MET 183 CO -0.04 -2.93 0.10 0.25 -0.01 0.00 0.00 175.02 172.39 3d3w n THR 184 N 7.41 0.00 -0.22 2.05 -2.24 -1.26 -4.89 114.28 115.13 3d3w n THR 184 Ca 0.28 -1.10 0.00 0.00 -2.27 0.00 0.00 64.05 60.96 3d3w n THR 184 Cb 0.50 0.48 0.12 0.00 -2.10 0.00 0.00 70.33 69.32 3d3w n THR 184 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3d3w h SER 185 N 0.85 0.34 0.60 3.42 4.64 -1.93 0.30 113.55 121.76 3d3w h SER 185 Ca -0.13 0.07 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 3d3w h SER 185 Cb 0.55 0.02 0.01 0.00 -0.31 0.00 0.00 62.40 62.67 3d3w h SER 185 CO 0.19 0.20 -0.29 -0.03 -0.87 0.00 0.00 176.83 176.03 3d3w h MET 186 N 0.50 -0.77 -0.54 4.77 -1.53 -1.97 -2.66 114.93 112.73 3d3w h MET 186 Ca 0.32 0.05 0.06 0.00 -3.44 0.00 0.00 59.70 56.70 3d3w h MET 186 Cb 0.35 0.18 -0.06 0.00 -0.55 0.00 0.00 31.60 31.53 3d3w h MET 186 CO -0.28 -0.47 0.23 0.78 0.14 0.00 0.00 176.91 177.31 3d3w h GLY 187 N -0.97 0.74 -3.65 1.39 0.00 -1.51 -2.68 103.07 96.40 3d3w h GLY 187 Ca -0.08 -0.14 -0.37 0.00 0.00 0.00 0.00 47.33 46.74 3d3w h GLY 187 CO 0.14 0.05 0.47 -0.18 0.00 0.00 0.00 176.54 177.01 3d3w n GLN 188 N -4.94 2.52 -0.07 4.80 7.27 0.10 -2.71 117.38 124.36 3d3w n GLN 188 Ca 0.06 -2.65 -0.08 0.00 0.07 0.00 0.00 57.00 54.40 3d3w n GLN 188 Cb 0.19 -2.06 -0.06 0.00 2.41 0.00 0.00 30.24 30.72 3d3w n GLN 188 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3d3w h ALA 189 N 1.62 0.03 0.00 1.69 0.00 -1.10 -3.39 119.26 118.10 3d3w h ALA 189 Ca 0.45 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.97 3d3w h ALA 189 Cb 2.48 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 20.42 3d3w h ALA 189 CO 0.87 0.14 -1.55 0.25 0.00 0.00 0.00 179.25 178.96 3d3w n THR 190 N -4.66 0.08 0.03 0.00 -2.24 -1.25 -4.34 114.28 101.90 3d3w n THR 190 Ca -0.08 -0.29 0.07 0.00 -2.27 0.00 0.00 64.05 61.49 3d3w n THR 190 Cb 0.28 0.13 0.26 0.00 -2.10 0.00 0.00 70.33 68.90 3d3w n THR 190 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 3d3w n TRP 191 N -1.96 1.03 0.19 4.78 7.02 -1.10 -4.15 117.44 123.25 3d3w n TRP 191 Ca -0.04 -0.42 0.07 0.00 -1.02 0.00 0.00 57.50 56.09 3d3w n TRP 191 Cb 0.36 -0.15 0.29 0.00 -2.42 0.00 0.00 31.31 29.39 3d3w n TRP 191 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 3d3w h SER 192 N 3.06 0.00 -2.69 -0.99 0.87 -1.76 -3.40 113.55 108.65 3d3w h SER 192 Ca 0.00 0.00 -0.56 0.00 -1.23 0.00 0.00 61.79 60.00 3d3w h SER 192 Cb 1.05 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.99 3d3w h SER 192 CO 0.14 0.31 1.10 -0.62 -0.53 0.00 0.00 176.83 177.23 3d3w s ASP 193 N -6.30 6.51 0.26 6.23 -1.08 -1.26 -4.91 116.67 116.13 3d3w s ASP 193 Ca 0.02 1.88 0.17 0.00 -0.52 0.00 0.00 52.55 54.11 3d3w s ASP 193 Cb 0.09 -2.53 0.94 0.00 -1.46 0.00 0.00 42.92 39.96 3d3w s ASP 193 CO 0.68 -1.10 1.53 -0.81 0.52 0.00 0.00 175.17 175.98 3d3w n PRO 194 N 7.39 0.11 -0.01 4.34 -0.04 -1.26 -1.38 135.00 144.15 3d3w n PRO 194 Ca 0.18 0.61 0.05 0.00 -0.04 0.00 0.00 63.50 64.30 3d3w n PRO 194 Cb 0.44 -1.87 -0.10 0.00 -0.04 0.00 0.00 33.50 31.93 3d3w n PRO 194 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 3d3w n HIS 195 N -2.11 0.00 -0.13 0.54 1.44 -1.26 -3.00 115.22 110.70 3d3w n HIS 195 Ca -0.01 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.59 3d3w n HIS 195 Cb 0.03 -0.33 -0.02 0.00 0.12 0.00 0.00 29.99 29.79 3d3w n HIS 195 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 3d3w h LYS 196 N 0.00 0.74 0.00 -1.40 6.56 -1.74 -2.69 116.57 118.04 3d3w h LYS 196 Ca -0.04 -0.28 -0.04 0.00 -1.06 0.00 0.00 60.65 59.23 3d3w h LYS 196 Cb 0.74 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 32.35 3d3w h LYS 196 CO 0.00 0.87 -0.20 0.00 -2.06 0.00 0.00 179.45 178.07 3d3w h ALA 197 N 0.84 0.99 -0.43 3.86 0.00 -1.42 -3.30 119.26 119.80 3d3w h ALA 197 Ca 0.10 -0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 3d3w h ALA 197 Cb 0.59 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 3d3w h ALA 197 CO 0.04 0.25 -0.02 -0.22 0.00 0.00 0.00 179.25 179.29 3d3w h LYS 198 N 0.00 0.77 -0.61 0.00 1.63 -1.38 -0.67 116.57 116.31 3d3w h LYS 198 Ca -0.00 -0.26 -0.07 0.00 -0.85 0.00 0.00 60.65 59.48 3d3w h LYS 198 Cb 0.78 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.32 3d3w h LYS 198 CO 0.03 0.85 0.12 1.15 -3.45 0.00 0.00 179.45 178.15 3d3w h THR 199 N 0.61 1.26 -0.35 1.00 2.02 -1.60 -2.36 112.91 113.48 3d3w h THR 199 Ca 0.12 -0.96 -0.05 0.00 0.77 0.00 0.00 66.41 66.29 3d3w h THR 199 Cb 0.52 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 3d3w h THR 199 CO 0.03 0.36 0.02 -0.03 0.37 0.00 0.00 175.52 176.27 3d3w h MET 200 N 0.90 0.60 -0.99 6.66 1.85 -1.66 -3.14 114.93 119.17 3d3w h MET 200 Ca 0.19 -0.18 0.12 0.00 -0.61 0.00 0.00 59.70 59.22 3d3w h MET 200 Cb 0.39 -0.06 -0.09 0.00 0.43 0.00 0.00 31.60 32.28 3d3w h MET 200 CO 0.01 0.70 0.62 1.25 -0.40 0.00 0.00 176.91 179.09 3d3w h LEU 201 N 0.43 0.89 -2.01 3.39 5.85 -0.94 0.18 115.31 123.10 3d3w h LEU 201 Ca 0.10 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 3d3w h LEU 201 Cb 0.41 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.32 3d3w h LEU 201 CO 0.01 0.47 -0.09 0.78 -0.34 0.00 0.00 178.44 179.27 3d3w h ASN 202 N 0.96 0.00 -0.07 1.25 4.21 -1.38 -1.98 115.58 118.56 3d3w h ASN 202 Ca 0.50 0.00 0.00 0.00 1.21 0.00 0.00 56.30 58.01 3d3w h ASN 202 Cb 0.51 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.71 3d3w h ASN 202 CO -0.27 0.09 0.00 0.54 -1.29 0.00 0.00 177.43 176.50 3d3w n ARG 203 N -3.56 1.66 -3.69 0.81 1.74 0.04 -4.79 116.66 108.87 3d3w n ARG 203 Ca -0.02 -0.97 -0.39 0.00 -0.77 0.00 0.00 57.85 55.70 3d3w n ARG 203 Cb 0.22 -1.44 -0.12 0.00 -1.02 0.00 0.00 32.46 30.10 3d3w n ARG 203 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3d3w s ILE 204 N -1.92 4.02 0.36 0.55 1.01 -0.75 -4.25 121.20 120.22 3d3w s ILE 204 Ca 0.36 -1.14 0.15 0.00 0.00 0.00 0.00 60.65 60.02 3d3w s ILE 204 Cb 0.20 -3.31 0.36 0.00 0.01 0.00 0.00 42.46 39.71 3d3w s ILE 204 CO 0.31 -0.26 1.73 -0.65 0.00 0.00 0.00 174.94 176.06 3d3w h PRO 205 N 8.29 0.43 0.00 2.79 0.11 -1.77 0.16 132.00 142.02 3d3w h PRO 205 Ca -0.23 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.85 3d3w h PRO 205 Cb 1.09 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.10 3d3w h PRO 205 CO 0.64 0.28 0.00 1.28 -0.21 0.00 0.00 178.00 180.00 3d3w n LEU 206 N -4.79 0.00 -0.92 2.35 4.77 -0.83 -4.93 117.00 112.64 3d3w n LEU 206 Ca 0.28 0.31 -0.10 0.00 -0.03 0.00 0.00 56.01 56.47 3d3w n LEU 206 Cb 0.88 -0.31 -0.03 0.00 -2.33 0.00 0.00 43.42 41.62 3d3w n LEU 206 CO 0.19 -0.00 -0.11 0.61 -1.33 0.00 0.00 177.39 176.75 3d3w n GLY 207 N 1.29 0.74 3.35 -0.72 0.00 0.57 -4.97 105.19 105.46 3d3w n GLY 207 Ca 0.13 -0.53 -0.12 0.00 0.00 0.00 0.00 46.02 45.51 3d3w n GLY 207 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3d3w s LYS 208 N -3.44 1.08 0.66 1.61 -2.85 -1.26 -5.02 119.74 110.52 3d3w s LYS 208 Ca 0.00 -0.51 -0.11 0.00 -1.00 0.00 0.00 55.97 54.35 3d3w s LYS 208 Cb 0.00 0.49 -0.01 0.00 -2.06 0.00 0.00 37.83 36.25 3d3w s LYS 208 CO 0.00 -0.42 1.05 -0.06 0.10 0.00 0.00 175.35 176.02 3d3w s PHE 209 N -3.31 3.44 0.30 1.78 0.08 -1.26 -4.78 117.98 114.22 3d3w s PHE 209 Ca -0.00 1.10 -0.28 0.00 0.12 0.00 0.00 56.93 57.86 3d3w s PHE 209 Cb 0.00 -2.90 -0.09 0.00 -0.57 0.00 0.00 43.02 39.46 3d3w s PHE 209 CO -0.09 -0.96 1.05 0.00 -0.10 0.00 0.00 175.22 175.13 3d3w s ALA 210 N -3.25 3.32 0.40 5.36 0.00 -0.76 -5.01 121.76 121.81 3d3w s ALA 210 Ca 0.56 0.79 -0.11 0.00 0.00 0.00 0.00 51.96 53.21 3d3w s ALA 210 Cb -0.11 -3.29 -0.07 0.00 0.00 0.00 0.00 23.12 19.66 3d3w s ALA 210 CO 0.52 -0.08 0.76 -1.21 0.00 0.00 0.00 175.76 175.75 3d3w s GLU 211 N -1.62 3.80 0.31 0.00 0.41 -1.26 -3.98 118.70 116.36 3d3w s GLU 211 Ca 0.47 0.48 0.08 0.00 -0.41 0.00 0.00 54.97 55.59 3d3w s GLU 211 Cb -0.28 -2.40 0.83 0.00 -1.78 0.00 0.00 34.13 30.49 3d3w s GLU 211 CO 0.36 -0.02 1.74 0.28 -0.49 0.00 0.00 175.26 177.13 3d3w h VAL 212 N 1.18 0.58 -0.77 2.63 2.07 -1.97 -1.96 116.25 118.02 3d3w h VAL 212 Ca -0.47 -0.21 0.00 0.00 0.82 0.00 0.00 66.70 66.84 3d3w h VAL 212 Cb 1.19 -0.09 -0.04 0.00 -1.52 0.00 0.00 31.29 30.83 3d3w h VAL 212 CO 0.64 0.11 0.49 -0.08 0.02 0.00 0.00 177.57 178.75 3d3w h GLU 213 N 0.62 1.02 -0.41 1.57 4.81 -1.97 -1.16 114.58 119.06 3d3w h GLU 213 Ca 0.62 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 59.80 3d3w h GLU 213 Cb 1.11 -0.22 -0.03 0.00 0.63 0.00 0.00 28.75 30.23 3d3w h GLU 213 CO -0.45 0.69 0.21 0.45 -0.73 0.00 0.00 179.01 179.18 3d3w h HIS 214 N 1.05 0.38 -0.21 0.92 3.86 -1.75 -0.69 115.15 118.72 3d3w h HIS 214 Ca 0.28 0.02 -0.05 0.00 -1.16 0.00 0.00 60.37 59.46 3d3w h HIS 214 Cb -0.09 -0.11 -0.01 0.00 1.06 0.00 0.00 27.41 28.26 3d3w h HIS 214 CO 0.00 0.20 -0.06 0.28 0.86 0.00 0.00 177.93 179.21 3d3w h VAL 215 N 0.42 1.29 -0.80 2.45 2.07 -1.43 -2.85 116.25 117.40 3d3w h VAL 215 Ca 0.17 -1.07 0.03 0.00 0.82 0.00 0.00 66.70 66.65 3d3w h VAL 215 Cb 0.08 1.57 -0.05 0.00 -1.52 0.00 0.00 31.29 31.37 3d3w h VAL 215 CO -0.12 0.33 0.52 0.58 0.02 0.00 0.00 177.57 178.90 3d3w h VAL 216 N 0.12 1.15 -0.43 2.57 2.07 -1.02 -0.43 116.25 120.28 3d3w h VAL 216 Ca 0.05 -0.35 0.03 0.00 0.82 0.00 0.00 66.70 67.25 3d3w h VAL 216 Cb 0.53 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.29 3d3w h VAL 216 CO 0.02 0.19 0.23 0.78 0.02 0.00 0.00 177.57 178.81 3d3w h ASN 217 N 1.02 0.35 -0.40 0.57 2.35 -1.12 0.37 115.58 118.72 3d3w h ASN 217 Ca 0.31 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 56.04 3d3w h ASN 217 Cb -0.03 -0.05 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 3d3w h ASN 217 CO -0.10 0.25 0.11 0.00 -1.65 0.00 0.00 177.43 176.04 3d3w h ALA 218 N 1.21 0.53 -0.08 -0.83 0.00 -1.21 -1.25 119.26 117.64 3d3w h ALA 218 Ca 0.18 -0.18 0.04 0.00 0.00 0.00 0.00 54.91 54.95 3d3w h ALA 218 Cb 0.06 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 3d3w h ALA 218 CO -0.11 0.19 -0.21 0.82 0.00 0.00 0.00 179.25 179.94 3d3w h ILE 219 N 0.51 0.49 -0.88 0.00 2.04 -0.66 -1.23 117.51 117.79 3d3w h ILE 219 Ca 0.13 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.98 3d3w h ILE 219 Cb 0.28 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 3d3w h ILE 219 CO -0.00 0.00 0.52 -0.07 0.00 0.00 0.00 178.15 178.60 3d3w h LEU 220 N -0.29 1.07 -0.63 1.44 3.38 -0.81 0.14 115.31 119.61 3d3w h LEU 220 Ca 0.08 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3d3w h LEU 220 Cb 0.41 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.86 3d3w h LEU 220 CO -0.25 0.83 0.41 0.15 0.09 0.00 0.00 178.44 179.67 3d3w h PHE 221 N 1.22 0.80 0.00 1.13 3.04 -1.03 -2.17 116.94 119.93 3d3w h PHE 221 Ca 0.32 0.02 -0.09 0.00 3.98 0.00 0.00 57.97 62.19 3d3w h PHE 221 Cb -0.03 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 38.20 3d3w h PHE 221 CO 0.00 0.51 -0.45 -0.07 -2.02 0.00 0.00 178.31 176.28 3d3w h LEU 222 N 0.85 0.00 -0.65 0.59 3.38 -0.50 -2.56 115.31 116.42 3d3w h LEU 222 Ca 0.23 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.05 3d3w h LEU 222 Cb -0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.65 3d3w h LEU 222 CO -0.05 0.45 -0.61 -0.07 0.09 0.00 0.00 178.44 178.25 3d3w h LEU 223 N 0.00 0.25-10.37 1.67 3.38 -0.63 -3.46 115.31 106.15 3d3w h LEU 223 Ca -0.00 -0.15 -0.51 0.00 0.09 0.00 0.00 57.88 57.31 3d3w h LEU 223 Cb 1.11 -0.07 0.07 0.00 0.09 0.00 0.00 40.66 41.85 3d3w h LEU 223 CO 0.06 0.80 0.41 -0.94 0.09 0.00 0.00 178.44 178.86 3d3w s SER 224 N -6.89 6.01 0.18 -0.43 1.04 -0.83 -4.76 113.70 108.02 3d3w s SER 224 Ca -0.04 1.40 0.15 0.00 0.48 0.00 0.00 55.95 57.94 3d3w s SER 224 Cb 0.12 -2.39 0.73 0.00 0.10 0.00 0.00 66.02 64.58 3d3w s SER 224 CO 0.80 -1.01 1.45 0.47 0.98 0.00 0.00 173.24 175.93 3d3w n ASP 225 N -2.83 0.35 0.32 7.02 8.00 -1.26 -2.54 116.55 125.60 3d3w n ASP 225 Ca 0.06 0.64 0.20 0.00 0.71 0.00 0.00 54.79 56.40 3d3w n ASP 225 Cb 0.54 -0.69 1.08 0.00 -0.02 0.00 0.00 41.12 42.03 3d3w n ASP 225 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 3d3w h ARG 226 N 0.00 0.00 -0.48 -1.24 2.47 -1.84 -2.34 114.38 110.95 3d3w h ARG 226 Ca 0.00 0.00 -0.30 0.00 -1.26 0.00 0.00 59.98 58.42 3d3w h ARG 226 Cb 0.10 0.00 -0.19 0.00 -1.65 0.00 0.00 29.97 28.23 3d3w h ARG 226 CO 0.00 0.00 -0.20 -1.13 0.56 0.00 0.00 179.97 179.20 3d3w n SER 227 N -2.95 3.48 0.02 7.04 3.41 -1.05 -4.84 113.62 118.71 3d3w n SER 227 Ca -0.03 -3.80 0.02 0.00 -0.26 0.00 0.00 58.87 54.80 3d3w n SER 227 Cb 0.13 -0.59 0.09 0.00 -0.26 0.00 0.00 64.21 63.58 3d3w n SER 227 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3d3w n GLY 228 N -1.01 -0.59 0.10 5.00 0.00 -0.88 -0.89 105.19 106.92 3d3w n GLY 228 Ca 0.38 0.01 0.09 0.00 0.00 0.00 0.00 46.02 46.50 3d3w n GLY 228 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3d3w n MET 229 N -1.58 1.25 -3.78 1.61 2.81 -1.26 -4.96 117.12 111.21 3d3w n MET 229 Ca 0.00 -2.40 -0.36 0.00 -1.81 0.00 0.00 57.70 53.12 3d3w n MET 229 Cb 0.02 -1.40 -0.13 0.00 -0.71 0.00 0.00 33.22 31.01 3d3w n MET 229 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 3d3w s THR 230 N -2.57 4.05 -0.06 2.03 2.01 -0.07 -5.07 115.64 115.96 3d3w s THR 230 Ca 0.28 -0.38 -0.20 0.00 0.31 0.00 0.00 61.69 61.70 3d3w s THR 230 Cb 0.25 -2.94 0.04 0.00 0.01 0.00 0.00 72.50 69.86 3d3w s THR 230 CO 0.03 0.28 0.46 0.28 -0.69 0.00 0.00 174.62 174.98 3d3w s THR 231 N 1.56 0.03 -0.02 -0.82 -1.32 -1.26 -4.70 115.64 109.10 3d3w s THR 231 Ca 0.05 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.31 3d3w s THR 231 Cb -0.16 -0.75 0.00 0.00 -1.51 0.00 0.00 72.50 70.09 3d3w s THR 231 CO 0.02 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 172.92 3d3w n GLY 232 N 1.53 0.47 3.99 6.08 0.00 0.80 -4.96 105.19 113.10 3d3w n GLY 232 Ca -0.19 -0.25 -0.20 0.00 0.00 0.00 0.00 46.02 45.39 3d3w n GLY 232 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d3w s SER 233 N -2.23 5.40 -0.36 1.61 1.04 -1.26 -4.62 113.70 113.29 3d3w s SER 233 Ca 0.00 -0.16 0.00 0.00 0.48 0.00 0.00 55.95 56.27 3d3w s SER 233 Cb 0.00 -0.79 0.12 0.00 0.10 0.00 0.00 66.02 65.45 3d3w s SER 233 CO 0.00 -1.01 0.17 0.42 0.98 0.00 0.00 173.24 173.80 3d3w s THR 234 N -2.62 0.81 -0.48 2.02 -4.23 -1.26 -1.44 115.64 108.43 3d3w s THR 234 Ca 0.57 -1.78 -0.27 0.00 -1.18 0.00 0.00 61.69 59.02 3d3w s THR 234 Cb -0.10 -1.59 0.03 0.00 1.34 0.00 0.00 72.50 72.18 3d3w s THR 234 CO 0.37 -0.82 1.04 -0.22 -0.54 0.00 0.00 174.62 174.44 3d3w s LEU 235 N 1.13 3.81 0.18 4.79 0.20 0.32 -4.87 118.68 124.24 3d3w s LEU 235 Ca 0.14 0.23 -0.30 0.00 0.69 0.00 0.00 54.13 54.89 3d3w s LEU 235 Cb -0.21 -3.32 -0.08 0.00 -0.43 0.00 0.00 46.19 42.15 3d3w s LEU 235 CO -0.12 -1.18 1.21 -2.16 -0.29 0.00 0.00 176.35 173.80 3d3w s PRO 236 N 4.16 4.48 -0.51 0.98 0.04 -1.26 -0.96 135.00 141.93 3d3w s PRO 236 Ca 0.42 1.89 0.07 0.00 0.04 0.00 0.00 61.00 63.42 3d3w s PRO 236 Cb -0.09 -3.24 0.35 0.00 0.04 0.00 0.00 34.50 31.57 3d3w s PRO 236 CO 0.28 -0.10 0.90 0.28 0.04 0.00 0.00 177.00 178.40 3d3w n VAL 237 N 2.53 2.11 -1.44 -0.36 0.31 0.21 -4.86 118.33 116.82 3d3w n VAL 237 Ca 0.04 -5.20 0.06 0.00 -0.01 0.00 0.00 64.34 59.23 3d3w n VAL 237 Cb 0.44 -1.03 0.09 0.00 -0.91 0.00 0.00 33.84 32.43 3d3w n VAL 237 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 3d3w n GLU 238 N -0.12 0.78 -1.62 5.55 -0.00 -1.26 -1.42 120.64 122.55 3d3w n GLU 238 Ca 0.29 -1.96 -0.17 0.00 -0.00 0.00 0.00 57.16 55.32 3d3w n GLU 238 Cb 0.49 -1.10 -0.07 0.00 -0.00 0.00 0.00 31.44 30.76 3d3w n GLU 238 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 3d3w n GLY 239 N -0.87 1.41 0.36 -1.84 0.00 -1.26 -1.63 105.19 101.36 3d3w n GLY 239 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 3d3w n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d3w n GLY 240 N -0.40 0.84 0.30 -0.02 0.00 -1.26 -1.97 105.19 102.68 3d3w n GLY 240 Ca -0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 45.88 3d3w n GLY 240 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3d3w h PHE 241 N 0.00 0.82 0.00 1.61 3.57 -1.49 -1.06 116.94 120.39 3d3w h PHE 241 Ca 0.00 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 3d3w h PHE 241 Cb 0.00 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 38.49 3d3w h PHE 241 CO 0.00 0.29 -0.16 -1.49 -2.23 0.00 0.00 178.31 174.72 3d3w h TRP 242 N 0.73 0.00 0.00 0.41 6.55 -1.88 -3.11 115.95 118.65 3d3w h TRP 242 Ca 0.41 0.00 -0.04 0.00 0.95 0.00 0.00 58.89 60.22 3d3w h TRP 242 Cb 0.45 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.74 3d3w h TRP 242 CO -0.07 0.16 -0.17 0.00 -1.05 0.00 0.00 178.44 177.31 3d3w h ALA 243 N 1.84 0.93 0.00 1.49 0.00 -1.57 -3.53 119.26 118.42 3d3w h ALA 243 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3d3w h ALA 243 Cb 0.50 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3d3w h ALA 243 CO 0.02 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.48